data_2kia_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 2kia _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 ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.076 0 CA-C-O 120.796 0.331 . . . . 0.0 110.792 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.49 138.43 35.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.784 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.453 ' CG ' ' CE2' ' A' ' 119' ' ' TYR . 7.7 mp0 -124.5 115.76 21.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.994 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.45 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 8.1 mmt85 -134.58 130.79 37.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.002 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.519 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 0.2 OUTLIER -121.58 137.61 54.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.133 179.792 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.464 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -144.09 167.01 23.39 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.292 0.567 . . . . 0.0 112.007 -179.824 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.426 ' HB2' ' CD2' ' A' ' 38' ' ' TYR . 7.2 ptm180 -149.09 153.47 37.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.525 178.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -153.47 113.39 2.62 Favored Pre-proline 0 C--N 1.328 -0.365 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.612 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.422 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 75.5 Cg_endo -87.65 98.97 0.45 Allowed 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 123.026 2.484 . . . . 0.0 112.214 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -118.53 141.83 48.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.96 0.409 . . . . 0.0 111.076 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.421 HG23 ' N ' ' A' ' 21' ' ' ARG . 14.6 mt -87.1 147.41 5.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.217 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.426 ' HD2' ' CE1' ' A' ' 53' ' ' HIS . 5.4 mtt180 -69.17 133.47 89.64 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.985 179.259 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.502 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 12.0 Cg_endo -55.76 -49.27 16.31 Favored 'Trans proline' 0 N--CA 1.464 -0.215 0 C-N-CA 122.524 2.15 . . . . 0.0 112.462 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.532 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -51.17 -58.69 5.48 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.307 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.493 ' HA ' ' CG ' ' A' ' 27' ' ' LYS . 1.2 m-20 -69.68 -30.29 67.91 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.094 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.17 -46.15 68.81 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.668 -179.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.532 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.3 p90 -98.85 -36.45 9.78 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -177.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 23' ' ' ALA . 6.5 ptmt -60.95 -32.23 71.77 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.537 -0.465 . . . . 0.0 111.303 -178.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.416 ' CB ' ' HB2' ' A' ' 31' ' ' ASN . 43.4 m-20 -155.56 117.13 2.32 Favored Pre-proline 0 C--N 1.329 -0.316 0 C-N-CA 121.014 -0.274 . . . . 0.0 111.426 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -66.69 -24.4 47.76 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.418 2.078 . . . . 0.0 112.187 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.1 mp0 -94.58 -43.17 8.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.636 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.416 ' HB2' ' CB ' ' A' ' 28' ' ' ASP . 27.3 m-80 -88.16 53.96 2.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.439 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.429 ' HD3' ' O ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -119.62 70.19 0.85 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.253 -179.563 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.9 mmpt? -40.9 133.27 2.17 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.246 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.404 ' HD2' HG12 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -97.52 124.21 41.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.719 -179.773 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -99.68 129.35 9.87 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.586 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.453 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 21.3 m-90 -102.03 124.79 48.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.955 0.407 . . . . 0.0 110.728 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 82.6 t90 -114.69 117.01 29.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.149 -179.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.468 ' HB2' ' HG3' ' A' ' 50' ' ' MET . 1.0 OUTLIER -117.84 148.89 41.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.087 179.216 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.431 ' HB3' ' NE2' ' A' ' 49' ' ' GLN . . . -157.31 124.68 5.23 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.126 0.489 . . . . 0.0 111.723 -179.104 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.519 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 9.5 t-160 -97.64 93.38 6.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.066 178.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.555 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 21.7 m-85 -77.53 149.36 34.92 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.535 -179.025 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.472 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 86.8 m-20 -122.83 110.81 15.91 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.08 178.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 61.9 -134.01 46.54 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 119.921 -1.133 . . . . 0.0 111.074 -178.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.423 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.4 Cg_exo -73.68 -14.65 24.51 Favored 'Trans proline' 0 CA--C 1.53 0.294 0 C-N-CA 122.448 2.099 . . . . 0.0 112.644 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' TRP . . . . . 0.423 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 0.6 OUTLIER -121.93 -162.89 1.02 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.665 -178.413 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.555 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 2.2 tt -135.21 154.45 35.85 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.129 0 CA-C-O 121.028 0.442 . . . . 0.0 111.688 -179.661 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.423 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -126.55 -19.14 4.65 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.267 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.427 ' HB3' ' CZ ' ' A' ' 93' ' ' PHE . 7.2 mtm180 -128.73 133.56 48.17 Favored 'General case' 0 C--O 1.23 0.055 0 CA-C-O 120.951 0.405 . . . . 0.0 111.084 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.431 ' NE2' ' HB3' ' A' ' 39' ' ' ALA . 0.0 OUTLIER -142.08 137.53 31.08 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.924 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.468 ' HG3' ' HB2' ' A' ' 38' ' ' TYR . 0.6 OUTLIER -146.82 128.5 15.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.614 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -117.36 138.76 51.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.196 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.7 mt -135.12 120.77 19.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.055 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.426 ' CE1' ' HD2' ' A' ' 21' ' ' ARG . 0.3 OUTLIER -133.61 131.62 21.37 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.5 179.701 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -48.21 -27.05 8.93 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.639 2.226 . . . . 0.0 112.697 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -106.66 -13.87 15.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.27 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.62 120.97 30.25 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.797 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -49.83 168.21 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.585 2.19 . . . . 0.0 112.506 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -60.32 96.96 0.11 Allowed 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.552 2.168 . . . . 0.0 112.405 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 7.8 mt -79.1 96.04 2.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.079 0.466 . . . . 0.0 110.755 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.484 ' CD2' ' CZ3' ' A' ' 97' ' ' TRP . 1.0 OUTLIER -86.83 116.37 24.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.797 -179.903 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.411 ' HB2' ' HB3' ' A' ' 49' ' ' GLN . 20.1 mt -119.76 151.89 38.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.952 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.433 ' CG2' ' CE2' ' A' ' 105' ' ' TYR . 16.1 m -143.42 158.5 17.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.114 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.47 148.22 52.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.126 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.51 -55.6 4.18 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.526 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.4 mttm -80.28 -67.02 0.81 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.864 0.364 . . . . 0.0 110.871 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -97.24 39.82 1.17 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.819 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.85 -28.63 61.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.016 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -82.88 -27.18 30.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.901 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -82.45 -54.39 5.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.102 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.0 ptp -56.59 174.32 0.15 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.096 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.83 128.12 35.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.989 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.17 43.18 1.41 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.798 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.31 131.45 16.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.801 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -53.96 167.82 0.25 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.017 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.446 HD21 ' CD2' ' A' ' 41' ' ' PHE . 2.6 mm? -44.04 -53.57 6.2 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.155 -179.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -70.38 -32.03 69.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.966 -179.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -80.09 -11.17 59.79 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.82 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.433 HG22 ' CZ ' ' A' ' 41' ' ' PHE . 0.1 OUTLIER -74.41 -67.19 0.65 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.88 0.372 . . . . 0.0 111.054 -179.947 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 124.84 -27.94 5.3 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.287 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.445 HD11 ' CG ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -59.55 -35.0 73.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.999 0.428 . . . . 0.0 110.382 179.684 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.47 -40.97 89.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.56 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 13.8 mtt180 -67.35 -28.86 68.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.857 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.7 mtpt -55.28 -176.41 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.972 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.44 76.74 5.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.206 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 72.56 66.83 1.97 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.968 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -83.83 -17.62 40.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.764 0.316 . . . . 0.0 110.954 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.433 ' HA ' ' O ' ' A' ' 14' ' ' PHE . 0.6 OUTLIER -52.27 160.16 0.84 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.932 0.396 . . . . 0.0 111.645 -179.708 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.424 HG22 ' CG ' ' A' ' 16' ' ' ARG . 1.5 pp -149.73 -179.72 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.899 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.2 mp -98.69 148.18 34.2 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.668 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -65.64 -22.0 58.4 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.62 2.213 . . . . 0.0 112.443 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.33 -40.32 93.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.046 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -69.85 -45.57 67.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.905 0.383 . . . . 0.0 110.936 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.427 ' CZ ' ' HB3' ' A' ' 48' ' ' ARG . 14.0 t80 -57.38 -51.59 68.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.746 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.03 -22.83 63.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.78 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.11 -50.45 71.85 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.123 0.487 . . . . 0.0 109.793 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 20.6 mm -76.98 -33.97 21.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.757 179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.484 ' CZ3' ' CD2' ' A' ' 60' ' ' LEU . 3.4 t-105 -52.42 -41.13 62.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.997 179.464 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -86.33 -30.55 22.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.633 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.83 -29.88 63.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.341 -179.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 16.2 m -107.23 -77.9 0.59 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.201 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 172.85 33.57 0.03 OUTLIER Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.621 -0.799 . . . . 0.0 112.743 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . 0.465 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -60.08 -48.54 85.61 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.311 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.414 ' HA ' ' CD1' ' A' ' 124' ' ' LEU . 3.6 mp -52.86 -42.53 43.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.816 0.341 . . . . 0.0 111.102 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.91 -44.86 96.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.018 0.437 . . . . 0.0 110.282 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.433 ' CE2' ' CG2' ' A' ' 62' ' ' VAL . 10.6 t80 -62.58 -43.12 99.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.359 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.406 ' HB3' ' CD2' ' A' ' 124' ' ' LEU . 0.5 OUTLIER -66.0 -44.6 84.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.89 179.883 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -61.11 -29.92 70.05 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.987 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.61 -50.44 30.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.894 -179.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.41 -31.66 65.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.443 0.64 . . . . 0.0 109.746 179.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.463 ' CD1' HD21 ' A' ' 124' ' ' LEU . 9.3 mt -57.91 -49.01 82.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-N 115.063 -0.972 . . . . 0.0 110.448 179.263 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -70.61 -36.71 73.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.605 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 6.4 p -77.45 -6.61 54.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.214 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 27.6 mmt85 67.89 31.54 5.65 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.864 0.364 . . . . 0.0 110.9 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -107.94 -28.85 9.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.665 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.12 -21.54 59.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.329 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 65.35 82.09 0.21 Allowed Pre-proline 0 C--N 1.332 -0.171 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.851 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . 0.424 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 1.1 Cg_endo -45.36 97.48 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.854 2.37 . . . . 0.0 112.46 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 19.3 m -117.34 -55.81 2.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.91 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.453 ' CE2' ' CG ' ' A' ' 12' ' ' GLN . 8.2 t80 -160.32 -52.26 0.05 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.189 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.404 ' CB ' ' NE ' ' A' ' 48' ' ' ARG . . . -56.87 -41.88 78.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.313 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.424 ' OG1' ' HA ' ' A' ' 117' ' ' PRO . 80.6 p -57.93 -49.25 77.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.559 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.24 -49.02 78.8 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.353 0.597 . . . . 0.0 109.56 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -57.49 -32.56 67.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.855 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.463 HD21 ' CD1' ' A' ' 110' ' ' ILE . 0.4 OUTLIER -68.6 -46.1 70.22 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.026 179.035 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -51.47 -39.54 57.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.804 -0.634 . . . . 0.0 109.974 179.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 43.2 m-20 -78.94 -32.1 45.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.292 179.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.2 tp -74.14 -7.34 52.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.925 179.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 38.6 mt . . . . . 0 C--N 1.333 -0.152 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.098 -179.799 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 84.8 mtt-85 . . . . . 0 N--CA 1.458 -0.071 0 CA-C-O 120.78 0.324 . . . . 0.0 110.996 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -76.44 163.67 26.73 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.818 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.5 mp0 -121.43 103.0 8.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.041 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.489 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -116.99 122.09 43.25 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.613 -179.88 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.506 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 2.2 m-85 -108.51 148.71 29.84 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.677 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.489 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 1.8 m-85 -146.74 149.57 33.65 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.38 0.609 . . . . 0.0 112.186 -179.449 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.45 ' HG3' ' CE2' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -148.69 136.67 20.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.229 179.198 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -141.67 131.91 12.86 Favored Pre-proline 0 C--N 1.329 -0.305 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -90.52 115.52 0.52 Allowed 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 123.183 2.589 . . . . 0.0 111.722 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.438 ' N ' ' CD1' ' A' ' 19' ' ' PHE . 2.1 p90 -134.08 149.56 51.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.89 0.376 . . . . 0.0 110.908 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.402 ' CG2' ' HB2' ' A' ' 32' ' ' LYS . 12.3 mt -98.77 140.59 18.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.122 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.5 mtp180 -65.01 124.53 86.96 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.296 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.487 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 86.2 Cg_exo -46.43 -50.36 10.41 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.523 2.149 . . . . 0.0 112.853 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.544 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -50.24 -58.46 5.56 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.118 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.506 ' HA ' ' CG ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -68.66 -31.37 70.45 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.161 179.838 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.07 -45.48 68.14 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.757 -178.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.544 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.2 p90 -98.08 -36.6 10.04 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -177.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.527 ' HG2' ' O ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -59.88 -31.88 70.2 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.353 -179.068 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.427 ' CB ' ' HB2' ' A' ' 31' ' ' ASN . 28.0 m-20 -153.59 125.67 3.84 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 120.835 -0.346 . . . . 0.0 111.475 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -72.97 -28.73 12.77 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.487 2.125 . . . . 0.0 112.014 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.4 mm-40 -94.02 -44.04 8.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.449 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.427 ' HB2' ' CB ' ' A' ' 28' ' ' ASP . 44.5 m-20 -85.67 55.14 3.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.409 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.443 ' HD3' ' O ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -122.33 68.77 0.95 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.089 -179.707 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.5 mmpt? -41.5 135.72 2.0 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.123 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.15 109.84 22.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.856 -179.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.407 ' O ' ' CD1' ' A' ' 19' ' ' PHE . . . -83.76 123.63 6.26 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.332 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 8.1 m-90 -98.13 132.57 43.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.796 0.331 . . . . 0.0 110.784 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 27.2 t90 -114.06 117.86 32.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.259 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.45 ' CE2' ' HG3' ' A' ' 16' ' ' ARG . 3.3 m-85 -110.1 149.72 29.63 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.006 179.345 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.537 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . . . -170.34 124.81 0.73 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.162 0.506 . . . . 0.0 112.132 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.506 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 20.1 t-160 -96.9 99.62 11.17 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.623 178.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.569 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 18.3 m-85 -85.65 119.95 26.54 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.497 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.431 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 12.1 p-10 -88.18 110.86 21.03 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.38 -136.29 49.48 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 119.954 -1.117 . . . . 0.0 110.842 -178.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.406 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 8.9 Cg_exo -72.09 -16.46 28.69 Favored 'Trans proline' 0 CA--C 1.531 0.33 0 C-N-CA 122.407 2.071 . . . . 0.0 112.335 179.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' TRP . . . . . 0.414 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.8 OUTLIER -115.81 -173.51 2.36 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.773 0.32 . . . . 0.0 111.795 -178.491 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.569 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 3.6 tt -131.02 153.04 38.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 121.227 0.537 . . . . 0.0 112.211 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.4 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -130.33 -22.6 2.76 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.739 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 -127.88 140.3 52.1 Favored 'General case' 0 N--CA 1.461 0.084 0 CA-C-O 120.778 0.323 . . . . 0.0 111.159 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.537 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 18.0 tt0 -153.44 136.39 15.45 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.003 0.43 . . . . 0.0 111.136 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.412 ' HG2' ' CZ3' ' A' ' 97' ' ' TRP . 0.0 OUTLIER -136.61 132.65 35.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.63 179.724 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.476 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 0.3 OUTLIER -119.32 125.91 50.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.815 179.865 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.447 ' CD1' ' CE1' ' A' ' 38' ' ' TYR . 0.8 OUTLIER -125.54 113.53 17.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.965 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 14.6 m80 -122.23 133.89 24.56 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.703 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -50.69 -24.35 12.87 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.405 2.07 . . . . 0.0 112.518 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -106.38 -22.15 12.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.244 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 4.9 mmtt -115.18 125.95 28.34 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.985 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -49.49 167.55 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.425 2.083 . . . . 0.0 112.614 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -60.89 84.07 0.08 OUTLIER 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.715 2.277 . . . . 0.0 112.418 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.476 ' HB ' ' HB2' ' A' ' 51' ' ' GLU . 21.5 mt -60.44 106.73 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.679 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.456 ' HG ' ' CH2' ' A' ' 97' ' ' TRP . 0.9 OUTLIER -83.86 117.31 23.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.949 -179.78 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.452 ' HB3' ' HB3' ' A' ' 49' ' ' GLN . 1.5 mm? -117.14 146.86 42.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.786 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.5 p -155.11 156.66 4.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.338 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -72.66 138.79 46.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.758 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.21 -62.74 2.82 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.242 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.441 ' HB2' ' HA ' ' A' ' 115' ' ' ALA . 2.2 tmtp? -67.4 -35.16 78.74 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.992 0.425 . . . . 0.0 110.512 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.411 ' HB3' ' HB2' ' A' ' 69' ' ' GLU . 71.9 m-20 -134.43 58.23 1.78 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.776 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -66.91 -21.6 65.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.35 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -85.34 -38.79 18.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.838 0.352 . . . . 0.0 110.871 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.411 ' HB2' ' HB3' ' A' ' 66' ' ' ASP . 0.3 OUTLIER -80.13 -33.82 38.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.896 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.405 ' N ' HD12 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -48.66 170.09 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.021 -179.997 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 9.3 t -64.47 -40.75 96.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.184 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 77.09 -66.44 0.24 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.947 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.43 171.7 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.314 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -96.78 -169.67 1.92 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.668 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.443 HD22 ' CE1' ' A' ' 15' ' ' PHE . 64.9 mt -66.28 -44.75 82.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.585 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -70.06 -31.21 68.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.462 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -85.31 -24.35 27.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.613 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.451 HG23 ' CE2' ' A' ' 41' ' ' PHE . 0.7 OUTLIER -63.81 -77.04 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.758 0.313 . . . . 0.0 111.196 -179.781 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.401 ' HA2' ' CG ' ' A' ' 82' ' ' ARG . . . 140.49 -18.17 2.85 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.55 -0.833 . . . . 0.0 113.104 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.82 -51.21 60.86 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.929 0.395 . . . . 0.0 110.828 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.442 HG21 ' CE2' ' A' ' 15' ' ' PHE . 54.8 p -56.02 -52.69 63.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.153 -179.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.401 ' CG ' ' HA2' ' A' ' 79' ' ' GLY . 1.4 ppt_? -62.29 -27.71 69.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.67 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 10.7 tttt -59.95 -168.56 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.796 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -90.91 77.79 6.12 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.536 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 55.04 69.12 1.36 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.327 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -89.6 22.54 2.97 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.98 179.51 4.91 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.761 0.315 . . . . 0.0 110.721 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.459 ' CG1' ' N ' ' A' ' 89' ' ' LEU . 3.8 tt -159.58 159.07 2.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.074 0.464 . . . . 0.0 111.103 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.459 ' N ' ' CG1' ' A' ' 88' ' ' ILE . 4.2 mp -73.42 146.41 86.37 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.811 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.5 -30.8 14.62 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.533 2.155 . . . . 0.0 112.309 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.71 -38.48 73.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.935 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -69.23 -48.28 62.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.845 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.404 ' CZ ' ' CG ' ' A' ' 50' ' ' MET . 14.2 t80 -55.23 -52.97 61.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.549 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -22.68 64.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.478 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -50.37 73.97 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.172 0.511 . . . . 0.0 109.687 179.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.403 ' HB ' ' CE ' ' A' ' 50' ' ' MET . 18.2 mm -71.47 -32.96 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.323 179.24 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.456 ' CH2' ' HG ' ' A' ' 60' ' ' LEU . 16.9 t-105 -57.69 -36.74 72.35 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.752 178.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.42 ' CG ' HD13 ' A' ' 103' ' ' ILE . 1.0 OUTLIER -85.11 -25.69 27.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.227 179.136 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 25.0 ttt85 -61.56 -53.62 53.98 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.272 -179.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -81.2 -84.66 0.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.084 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -173.44 36.39 0.13 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.444 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . 0.403 ' HA3' ' CE2' ' A' ' 97' ' ' TRP . . . -54.31 -61.3 7.35 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.538 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.42 HD13 ' CG ' ' A' ' 98' ' ' GLU . 3.1 mp -55.31 -46.31 78.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.695 0.283 . . . . 0.0 111.681 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -58.99 -49.26 78.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.941 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -60.76 -50.91 71.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.411 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.65 -44.79 85.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.787 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.401 ' HG2' ' CD2' ' A' ' 124' ' ' LEU . 1.8 mm100 -61.43 -29.93 70.25 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.844 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 32.6 t -68.31 -50.67 51.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.968 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -75.13 -32.37 61.33 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.307 0.575 . . . . 0.0 109.784 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.417 ' CG1' HG23 ' A' ' 121' ' ' THR . 7.0 mt -57.71 -48.68 82.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.264 179.353 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -72.42 -36.06 68.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.72 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.5 -8.31 56.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.327 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 15.6 mmt85 72.0 46.6 0.34 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.005 0.431 . . . . 0.0 110.958 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 9.2 mm-40 -122.37 -40.41 2.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.67 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.441 ' HA ' ' HB2' ' A' ' 65' ' ' LYS . . . -59.3 -19.88 49.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.413 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 62.96 118.1 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.577 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -49.22 90.9 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.409 2.073 . . . . 0.0 112.625 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 10.8 t -119.35 -165.07 1.11 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.513 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -64.45 -47.62 78.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.733 0.302 . . . . 0.0 110.778 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -60.06 -52.08 66.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.273 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.417 HG23 ' CG1' ' A' ' 110' ' ' ILE . 80.3 p -57.83 -49.13 77.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.594 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.25 -54.02 51.47 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.525 0.679 . . . . 0.0 109.721 179.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' MET . . . . . 0.441 ' O ' ' HB2' ' A' ' 127' ' ' LEU . 0.0 OUTLIER -56.25 -35.41 67.37 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.778 178.663 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.403 HD22 ' CD1' ' A' ' 110' ' ' ILE . 0.3 OUTLIER -65.47 -44.95 85.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.825 178.763 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 60.8 mm-40 -49.97 -44.21 50.61 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.279 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -83.86 -23.71 31.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.782 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.441 ' HB2' ' O ' ' A' ' 123' ' ' MET . 4.4 tp -65.73 -19.68 65.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.743 0.306 . . . . 0.0 110.502 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.332 -0.161 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.133 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.527 0.068 0 CA-C-O 120.889 0.376 . . . . 0.0 111.175 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.51 156.73 21.55 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.994 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 67.2 mm-40 -131.22 107.46 9.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.027 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.492 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 3.0 mtp180 -127.49 139.53 52.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.847 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.515 ' CE2' ' CG ' ' A' ' 40' ' ' HIS . 0.7 OUTLIER -122.47 135.03 54.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.3 -179.652 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.492 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 0.6 OUTLIER -138.9 154.93 48.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.288 0.566 . . . . 0.0 111.926 -179.218 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.489 ' HB3' ' CG2' ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.22 144.16 26.37 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.608 179.525 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.416 ' N ' ' HG2' ' A' ' 16' ' ' ARG . 0.5 OUTLIER -148.97 132.17 8.22 Favored Pre-proline 0 C--N 1.329 -0.301 0 C-N-CA 120.851 -0.34 . . . . 0.0 111.784 -179.693 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.47 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 64.6 Cg_endo -91.65 111.54 0.31 Allowed 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 123.11 2.54 . . . . 0.0 112.25 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.0 p90 -131.11 140.74 50.05 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.795 0.331 . . . . 0.0 110.83 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.518 HG12 ' HG3' ' A' ' 34' ' ' LYS . 9.3 mt -84.7 143.4 11.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.051 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.77 124.73 87.2 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.5 179.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.572 ' CA ' ' HG3' ' A' ' 25' ' ' GLN . 72.1 Cg_exo -39.5 -55.13 1.68 Allowed 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.956 2.437 . . . . 0.0 112.938 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.65 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -44.83 -58.16 3.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.636 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.485 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -63.73 -34.65 78.35 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.969 -178.907 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.572 ' HG3' ' CA ' ' A' ' 22' ' ' PRO . 0.9 OUTLIER -54.99 -51.29 66.67 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -178.393 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.65 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 0.9 OUTLIER -88.23 -40.52 13.6 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -177.862 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.547 ' HG2' ' O ' ' A' ' 23' ' ' ALA . 12.3 ptmt -58.74 -33.01 69.77 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.716 -178.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -160.52 123.31 1.85 Allowed Pre-proline 0 C--N 1.328 -0.338 0 C-N-CA 120.766 -0.373 . . . . 0.0 111.606 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -73.13 -25.67 15.72 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.571 2.18 . . . . 0.0 112.206 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -93.06 -44.34 8.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.461 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -88.0 54.44 3.09 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.443 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.452 ' HA ' ' HB3' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -123.5 64.64 1.02 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.489 -179.384 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.84 143.01 5.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.618 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.518 ' HG3' HG12 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -97.06 157.97 15.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.085 0.469 . . . . 0.0 111.592 -179.352 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -130.07 132.23 6.91 Favored Glycine 0 N--CA 1.451 -0.326 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.966 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.47 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 22.1 m-90 -97.75 131.09 44.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.879 0.371 . . . . 0.0 111.228 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 39.2 t90 -115.35 117.65 31.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.085 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.47 ' CZ ' ' HD2' ' A' ' 16' ' ' ARG . 1.6 m-85 -109.91 156.9 19.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.055 179.371 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.492 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . . . -170.37 124.49 0.72 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.126 0.489 . . . . 0.0 111.906 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.515 ' CG ' ' CE2' ' A' ' 14' ' ' PHE . 11.0 t-160 -97.0 92.41 6.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.288 178.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.553 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 8.8 m-85 -74.47 155.76 37.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.077 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.544 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.7 OUTLIER -125.08 110.91 14.72 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.812 -0.811 . . . . 0.0 108.812 178.957 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 59.06 -133.84 52.52 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 119.706 -1.235 . . . . 0.0 110.678 -177.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.413 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 7.3 Cg_exo -72.53 -19.6 24.58 Favored 'Trans proline' 0 CA--C 1.532 0.394 0 C-N-CA 122.359 2.039 . . . . 0.0 112.133 179.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' TRP . . . . . 0.439 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.7 OUTLIER -113.17 -160.12 0.71 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.567 -178.756 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.553 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 7.6 tt -140.75 155.74 22.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-O 121.084 0.469 . . . . 0.0 111.849 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.411 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -128.65 -16.08 4.33 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.712 -0.676 . . . . 0.0 112.197 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.415 ' CB ' ' HB3' ' A' ' 40' ' ' HIS . 4.2 mtt180 -137.06 137.86 39.79 Favored 'General case' 0 C--O 1.231 0.085 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.192 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.492 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 19.4 tt0 -151.56 125.7 9.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.255 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -125.02 111.97 16.0 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.154 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.418 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 4.2 mt-10 -99.76 132.33 45.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.662 -179.256 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.442 HD13 ' CE1' ' A' ' 38' ' ' TYR . 3.6 mt -127.17 101.68 6.62 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.254 179.244 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -125.49 150.04 66.62 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 120.872 0.368 . . . . 0.0 111.332 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -61.69 -31.52 86.31 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.645 2.23 . . . . 0.0 112.198 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -94.7 -8.65 37.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.177 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.25 114.45 10.65 Favored Pre-proline 0 C--N 1.331 -0.204 0 CA-C-N 116.687 -0.233 . . . . 0.0 110.785 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -50.96 -176.57 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.459 2.106 . . . . 0.0 112.311 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -59.15 85.2 0.06 OUTLIER 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 122.416 2.077 . . . . 0.0 112.398 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.418 ' HB ' ' HB2' ' A' ' 51' ' ' GLU . 87.7 mt -76.03 97.47 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.807 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.483 ' CD2' ' CZ3' ' A' ' 97' ' ' TRP . 4.3 mt -83.74 100.53 10.96 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.487 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.43 HD13 ' CB ' ' A' ' 66' ' ' ASP . 0.3 OUTLIER -95.98 152.57 18.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.346 -179.461 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.445 HG11 ' HB3' ' A' ' 65' ' ' LYS . 11.5 p -152.56 161.64 2.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.656 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.8 158.58 28.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.818 0.342 . . . . 0.0 111.502 -179.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.17 -66.8 0.7 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.459 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.445 ' HB3' HG11 ' A' ' 62' ' ' VAL . 7.5 tptm -62.89 -41.3 99.36 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.836 0.351 . . . . 0.0 110.821 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.43 ' CB ' HD13 ' A' ' 61' ' ' LEU . 24.8 m-20 -132.56 56.99 1.81 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.788 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.27 -17.74 62.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.487 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 3.6 mtm -83.12 -30.45 27.91 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.713 0.292 . . . . 0.0 111.147 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.419 ' CB ' HD12 ' A' ' 61' ' ' LEU . 6.0 mm-40 -97.88 -23.75 15.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.242 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.1 ttm -57.44 163.79 2.19 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.863 0.364 . . . . 0.0 111.108 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 8.8 t -46.99 -49.76 20.3 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.332 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 77.2 -57.49 0.51 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.987 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.7 mmtm -55.88 158.84 3.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.018 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -90.81 176.28 6.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.254 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.458 ' CD1' ' CD2' ' A' ' 41' ' ' PHE . 0.9 OUTLIER -54.75 -51.17 66.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.873 0.368 . . . . 0.0 111.56 -179.617 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -31.52 69.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.283 -179.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -81.42 -10.15 59.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.752 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.4 p -91.51 -73.96 0.52 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.77 0.319 . . . . 0.0 111.143 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 139.09 -20.91 3.0 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.785 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.454 ' CD1' ' CE1' ' A' ' 41' ' ' PHE . 3.8 mt -49.29 -30.04 6.8 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.991 0.424 . . . . 0.0 110.813 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 63.0 p -80.56 -31.92 36.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.362 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -94.48 7.87 44.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.046 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.2 mptt -92.69 32.05 1.29 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.726 0.298 . . . . 0.0 111.216 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 58.46 63.07 1.79 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.964 0.411 . . . . 0.0 111.053 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 62.76 60.38 7.82 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.627 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -77.32 -3.65 41.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.65 0.262 . . . . 0.0 111.576 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -51.51 168.13 0.08 Allowed 'General case' 0 CA--C 1.528 0.129 0 CA-C-O 120.839 0.352 . . . . 0.0 111.358 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.489 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 1.0 OUTLIER -151.23 179.94 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.151 179.872 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.82 145.82 30.39 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.717 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.78 -10.48 28.64 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.591 2.194 . . . . 0.0 112.532 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.05 -51.93 19.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.56 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -67.45 -42.91 82.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.039 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -56.98 -53.28 59.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.879 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.88 -19.34 61.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.732 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -62.37 -50.52 71.24 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 179.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 19.3 mm -75.95 -33.79 25.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.59 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.483 ' CZ3' ' CD2' ' A' ' 60' ' ' LEU . 12.9 t-105 -52.45 -40.98 62.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.007 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -86.24 -31.56 21.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.584 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.71 -52.91 63.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.385 -179.637 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 95.0 m -79.77 -82.47 0.11 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.225 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -178.3 37.89 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.622 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . 0.41 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -72.02 -41.25 55.1 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.542 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 29.4 mm -64.68 -46.65 91.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.799 0.333 . . . . 0.0 110.897 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -60.17 -49.12 78.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.492 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -57.61 -49.11 77.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.286 179.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.407 HD11 HG13 ' A' ' 110' ' ' ILE . 0.2 OUTLIER -59.03 -45.02 91.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.361 179.355 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.409 ' HG2' ' CD2' ' A' ' 124' ' ' LEU . 0.9 OUTLIER -61.14 -29.75 69.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.997 179.615 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.36 -50.5 45.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.972 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -74.0 -31.72 63.08 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.333 0.587 . . . . 0.0 109.716 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.419 ' CG1' HG22 ' A' ' 121' ' ' THR . 11.7 mt -59.0 -49.23 83.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.517 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -72.39 -37.18 68.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.783 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 5.8 m -76.0 -8.33 56.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.358 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 72.11 28.59 2.46 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.806 0.336 . . . . 0.0 110.867 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -98.55 -29.73 12.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.652 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.71 -163.92 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.886 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -133.76 91.74 24.56 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.195 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -50.04 90.25 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.578 2.185 . . . . 0.0 111.849 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 2.4 p -136.12 -50.46 0.7 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.553 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -162.23 -61.6 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.339 . . . . 0.0 111.576 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.469 ' O ' ' HB2' ' A' ' 124' ' ' LEU . . . -53.59 -38.59 64.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.558 -179.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.419 HG22 ' CG1' ' A' ' 110' ' ' ILE . 17.7 p -69.3 -35.64 76.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.786 0.327 . . . . 0.0 110.679 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -70.22 -55.44 9.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.279 0.562 . . . . 0.0 110.532 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' MET . . . . . 0.438 ' HE2' ' N ' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -56.44 -29.22 61.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.374 179.207 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.469 ' HB2' ' O ' ' A' ' 120' ' ' ALA . 0.3 OUTLIER -69.47 -44.61 70.82 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.095 0.474 . . . . 0.0 109.937 178.96 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 42.5 mm-40 -54.03 -44.84 71.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.584 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.07 -30.11 31.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.707 179.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.418 ' HB3' ' HA ' ' A' ' 124' ' ' LEU . 1.2 tt -66.61 -16.05 63.9 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.282 179.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 10.0 mt . . . . . 0 C--N 1.332 -0.167 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.953 179.828 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.912 0.387 . . . . 0.0 111.36 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -69.01 177.6 2.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.921 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.433 ' HG3' ' CZ ' ' A' ' 119' ' ' TYR . 12.5 mm100 -127.74 111.91 14.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.948 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.471 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -116.43 135.51 53.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.749 179.882 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.523 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 0.0 OUTLIER -126.85 149.74 49.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.55 -179.524 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.471 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 0.2 OUTLIER -154.67 162.46 41.12 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.226 0.536 . . . . 0.0 111.653 179.981 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.43 ' CG ' HG22 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.29 154.08 38.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.627 178.843 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -151.93 127.64 5.0 Favored Pre-proline 0 C--N 1.328 -0.361 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.891 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.452 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 75.3 Cg_endo -87.43 94.73 0.46 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.953 2.435 . . . . 0.0 111.981 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.0 p90 -111.76 155.08 24.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.87 0.366 . . . . 0.0 110.907 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.583 HG12 ' CG ' ' A' ' 34' ' ' LYS . 1.4 mt -100.0 153.11 4.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.344 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 -82.47 134.9 47.32 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.526 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.518 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 72.9 Cg_exo -39.96 -60.25 0.59 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.956 2.438 . . . . 0.0 113.051 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.598 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -46.11 -54.01 9.33 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.826 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.405 ' HB3' ' HA ' ' A' ' 32' ' ' LYS . 0.2 OUTLIER -61.02 -37.53 82.89 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.213 -178.93 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.515 ' HG3' ' CA ' ' A' ' 22' ' ' PRO . 0.9 OUTLIER -55.7 -57.35 12.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.913 0.387 . . . . 0.0 111.805 -178.965 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.598 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.6 p90 -86.47 -9.0 57.14 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.87 -179.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.9 mtpp -70.25 -44.49 68.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.948 0.404 . . . . 0.0 110.366 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -174.18 138.85 0.7 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.867 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -67.96 -23.44 40.71 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.549 2.166 . . . . 0.0 112.449 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.5 mm100 -95.76 -40.5 9.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.005 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -93.73 48.32 1.28 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.962 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.405 ' HA ' ' HB3' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -110.0 61.88 0.6 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.671 179.785 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.01 135.62 0.88 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.663 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.583 ' CG ' HG12 ' A' ' 20' ' ' ILE . 8.4 mtmt -104.82 141.15 37.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.519 -179.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -112.95 135.75 12.91 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.524 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.452 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 15.6 m-90 -100.47 111.67 23.95 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.929 0.395 . . . . 0.0 110.845 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 39.0 t90 -95.04 117.66 30.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.808 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.426 ' CE2' ' HD2' ' A' ' 16' ' ' ARG . 14.5 m-85 -105.58 152.43 23.09 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.372 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -163.43 123.46 2.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.267 0.556 . . . . 0.0 111.445 179.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.52 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 3.5 t-160 -99.39 86.89 3.48 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.401 -0.818 . . . . 0.0 108.796 178.801 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.671 ' CG ' ' HB ' ' A' ' 46' ' ' ILE . 7.6 m-85 -71.81 156.41 39.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.747 -178.479 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.513 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 4.3 t70 -130.38 118.25 20.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.317 -0.856 . . . . 0.0 108.81 178.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 58.63 -136.46 51.1 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 119.732 -1.223 . . . . 0.0 110.828 -178.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.427 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.4 Cg_exo -73.71 -15.46 24.16 Favored 'Trans proline' 0 CA--C 1.53 0.292 0 C-N-CA 122.495 2.13 . . . . 0.0 112.332 179.425 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' TRP . . . . . 0.427 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 0.8 OUTLIER -119.83 -157.68 0.71 Allowed 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.714 -178.467 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.671 ' HB ' ' CG ' ' A' ' 41' ' ' PHE . 5.8 tt -137.81 156.54 31.96 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.104 0 CA-C-O 121.149 0.5 . . . . 0.0 112.094 -179.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.424 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -129.94 -15.15 3.88 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.521 -0.763 . . . . 0.0 112.166 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.481 ' CB ' ' HB3' ' A' ' 40' ' ' HIS . 11.2 mtt180 -136.28 138.64 41.98 Favored 'General case' 0 C--O 1.23 0.053 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.753 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -146.43 130.81 17.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.226 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -127.46 112.81 15.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.608 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.477 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -89.93 118.94 29.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.053 -179.753 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.423 HD12 ' CD1' ' A' ' 38' ' ' TYR . 43.3 mt -120.38 102.73 8.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.806 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -130.82 136.22 28.57 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.914 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -52.25 -25.95 25.41 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.354 2.036 . . . . 0.0 112.28 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -94.87 -28.26 15.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.14 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.3 mttp -119.79 119.5 31.19 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.086 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.45 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 72.6 Cg_exo -48.79 171.0 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.565 2.177 . . . . 0.0 112.121 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.45 ' HD2' ' HB3' ' A' ' 57' ' ' PRO . 19.1 Cg_endo -59.02 83.42 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.462 2.108 . . . . 0.0 112.367 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.477 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 63.8 mt -61.39 104.87 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.776 179.845 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.438 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.2 OUTLIER -79.92 100.8 8.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.848 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.0 mt -109.51 145.09 36.86 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.735 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.5 t -141.66 147.2 22.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.085 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.53 151.74 23.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.01 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.04 -58.87 4.99 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.406 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.12 -31.64 39.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.92 0.39 . . . . 0.0 110.802 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -123.62 54.13 1.31 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.74 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.38 -30.21 71.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.891 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.24 -40.48 16.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.826 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -73.13 -54.94 7.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.902 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 46.0 ttm -52.24 163.23 0.41 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.842 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 3.0 t -51.39 136.67 24.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.844 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -119.93 47.25 1.77 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.0 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.52 134.21 10.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.015 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -55.28 164.95 0.82 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.885 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.2 tp -50.78 -45.5 59.18 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.721 -179.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.21 -31.79 69.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.602 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.26 -21.58 28.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.699 -179.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -74.51 0.09 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.85 0.357 . . . . 0.0 111.177 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 138.67 -25.19 2.85 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.326 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -53.5 -36.21 61.47 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.972 0.415 . . . . 0.0 110.661 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.5 p -74.21 -30.64 62.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.66 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.3 mmm180 -72.68 -31.95 65.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.609 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.4 mptt -60.9 -168.22 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.812 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.52 73.81 2.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.994 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 72.03 66.38 2.12 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.535 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.0 -10.04 59.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.569 0.223 . . . . 0.0 111.349 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -52.55 154.7 2.47 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.896 0.379 . . . . 0.0 111.415 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.43 HG22 ' CG ' ' A' ' 16' ' ' ARG . 1.2 pt -144.78 168.28 9.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.198 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.413 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 2.3 mt -78.81 144.75 64.94 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.554 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 89' ' ' LEU . 11.5 Cg_exo -69.02 -35.4 14.91 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.369 2.046 . . . . 0.0 111.387 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 6.9 mtm180 -55.35 -54.4 44.14 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.344 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -57.62 -45.18 85.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.279 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -55.29 -53.09 60.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.824 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.64 -21.15 60.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.825 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -50.77 71.56 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.261 0.553 . . . . 0.0 109.649 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.443 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 16.7 mm -72.9 -34.93 47.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.246 179.032 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.434 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 11.9 t-105 -54.08 -39.08 66.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.142 179.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -85.67 -25.96 26.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.604 179.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.443 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -56.36 -54.3 47.18 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.393 -179.759 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 8.3 t -83.68 -67.52 0.78 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.061 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 160.62 40.91 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.563 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . 0.438 ' HA2' ' CD2' ' A' ' 60' ' ' LEU . . . -60.76 -52.93 49.38 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.349 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.44 ' HA ' ' CD1' ' A' ' 124' ' ' LEU . 3.7 mp -53.86 -42.12 51.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.72 0.295 . . . . 0.0 111.136 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.64 -43.9 97.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.013 0.435 . . . . 0.0 110.2 179.38 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -63.88 -40.97 97.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.132 179.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.431 ' CD1' HD11 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -68.21 -38.52 82.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.659 179.69 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -65.58 -30.07 70.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.516 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.3 m -70.62 -50.05 41.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.342 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.76 -33.5 68.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.33 0.586 . . . . 0.0 109.747 179.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 5.1 mt -56.93 -49.18 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.48 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -72.27 -38.08 68.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.598 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 59.0 m -66.39 -15.86 63.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.124 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.0 mmm180 76.81 30.43 0.59 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.892 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 42.2 mm-40 -102.76 -28.69 11.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.586 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.86 158.09 22.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.046 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.1 mtt85 -110.15 95.32 21.03 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.782 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -47.91 129.64 18.26 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.72 2.28 . . . . 0.0 112.588 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.414 ' CG2' ' CB ' ' A' ' 47' ' ' ALA . 1.1 t -161.1 -54.38 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.004 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.433 ' CZ ' ' HG3' ' A' ' 12' ' ' GLN . 68.5 t80 -159.59 -62.17 0.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.081 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.417 ' CB ' ' HG3' ' A' ' 48' ' ' ARG . . . -53.99 -44.18 70.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.276 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -62.15 -34.89 77.24 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.912 0.387 . . . . 0.0 110.465 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -71.37 -58.7 3.28 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.675 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' MET . . . . . 0.416 ' HG3' ' O ' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -58.22 -29.41 65.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.325 179.397 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.44 ' CD1' ' HA ' ' A' ' 103' ' ' ILE . 7.4 tt -68.23 -48.87 63.97 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.146 0.498 . . . . 0.0 109.971 179.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -53.15 -36.39 60.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.159 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 18.5 m-20 -86.65 -29.28 22.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.536 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.439 ' HB3' ' HA ' ' A' ' 124' ' ' LEU . 1.3 tt -72.83 -10.0 59.3 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.879 179.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 4.0 pp . . . . . 0 C--N 1.333 -0.122 0 CA-C-O 120.763 0.316 . . . . 0.0 111.165 179.932 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.4 mtt85 . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 120.791 0.329 . . . . 0.0 110.916 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.27 158.99 16.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.931 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.428 ' HG3' ' CE2' ' A' ' 119' ' ' TYR . 89.3 mm-40 -130.14 102.9 6.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.806 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.549 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -122.26 127.95 50.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.097 -179.579 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.498 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 0.4 OUTLIER -115.46 151.34 34.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.296 179.772 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.549 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 0.8 OUTLIER -151.51 159.09 44.3 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-O 121.289 0.566 . . . . 0.0 112.041 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.492 ' HB3' ' CG2' ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.29 145.67 27.17 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.961 179.332 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.401 ' N ' ' HG2' ' A' ' 16' ' ' ARG . 0.6 OUTLIER -153.07 124.69 3.71 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.684 0.278 . . . . 0.0 111.745 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.462 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 68.3 Cg_endo -89.27 103.61 0.38 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.063 2.509 . . . . 0.0 111.914 179.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.2 p90 -116.87 138.25 51.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.957 0.408 . . . . 0.0 111.076 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.467 HG12 ' HG3' ' A' ' 34' ' ' LYS . 37.4 mt -78.87 134.42 27.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.117 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.5 ttp180 -58.19 139.88 83.54 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.643 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.462 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 14.3 Cg_endo -56.59 -45.38 37.46 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.395 2.063 . . . . 0.0 112.434 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.517 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -55.92 -58.35 8.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.173 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.545 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 0.6 OUTLIER -68.35 -29.85 68.67 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.765 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.39 -57.08 10.94 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.319 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.517 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.8 p90 -91.74 -13.56 31.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.747 -179.485 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.545 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 0.1 OUTLIER -62.31 -46.31 89.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.844 0.354 . . . . 0.0 110.554 179.785 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -166.39 142.94 4.08 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.244 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -69.75 -26.1 27.98 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.636 2.224 . . . . 0.0 112.258 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -94.95 -36.17 11.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.627 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -98.3 49.88 1.0 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.687 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.414 ' HD3' ' O ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -109.66 63.36 0.6 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.826 179.999 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.98 142.81 0.64 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.368 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.467 ' HG3' HG12 ' A' ' 20' ' ' ILE . 0.4 OUTLIER -113.42 152.18 30.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.32 -179.618 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.421 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -127.94 138.28 10.32 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.289 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.462 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 28.3 m-90 -97.73 128.32 44.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.887 0.375 . . . . 0.0 110.708 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.416 ' CZ2' ' OE1' ' A' ' 49' ' ' GLN . 23.2 t90 -113.91 117.36 31.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.309 -179.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.454 ' CE2' ' HD2' ' A' ' 16' ' ' ARG . 1.3 m-85 -111.72 155.34 23.62 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.031 179.189 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.435 ' HB3' ' CE1' ' A' ' 41' ' ' PHE . . . -170.53 126.74 0.77 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.043 0.449 . . . . 0.0 111.884 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.498 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 17.0 t-160 -98.1 99.12 10.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.608 178.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.567 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 34.1 m-85 -85.25 114.52 22.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.629 -179.117 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.453 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 51.9 t0 -88.39 113.89 24.45 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 59.67 -136.04 50.6 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 119.966 -1.111 . . . . 0.0 111.062 -178.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.425 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.4 Cg_exo -73.53 -15.25 24.74 Favored 'Trans proline' 0 N--CA 1.463 -0.28 0 C-N-CA 122.527 2.151 . . . . 0.0 112.266 179.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' TRP . . . . . 0.425 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 0.9 OUTLIER -118.05 -173.99 2.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.965 0.412 . . . . 0.0 111.765 -178.527 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.567 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 1.5 tt -129.62 147.1 33.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.59 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -122.5 -21.03 5.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.98 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.424 ' HD2' ' CE2' ' A' ' 93' ' ' PHE . 5.3 ttm180 -127.17 139.23 53.1 Favored 'General case' 0 C--N 1.334 -0.089 0 C-N-CA 120.868 -0.333 . . . . 0.0 111.253 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.437 ' HB3' ' HB3' ' A' ' 61' ' ' LEU . 1.1 tt0 -154.51 139.24 17.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.786 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 1.2 ttm -140.44 116.75 10.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.9 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.432 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -95.95 136.83 35.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.002 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.416 HD13 ' CE1' ' A' ' 38' ' ' TYR . 81.0 mt -134.46 119.13 18.14 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.075 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.421 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 1.7 m-70 -143.24 135.0 12.95 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.915 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -52.65 -26.86 31.11 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.565 2.177 . . . . 0.0 112.181 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -98.9 -24.46 14.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.968 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -118.01 120.61 32.34 Favored Pre-proline 0 C--O 1.234 0.275 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.84 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -54.15 168.89 0.78 Allowed 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.456 2.104 . . . . 0.0 112.204 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.52 86.77 0.04 OUTLIER 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.577 2.185 . . . . 0.0 112.38 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.432 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 88.6 mt -67.44 95.56 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.099 0.476 . . . . 0.0 110.62 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.439 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.1 OUTLIER -71.65 127.63 33.18 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.913 -179.774 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.437 ' HB3' ' HB3' ' A' ' 49' ' ' GLN . 0.3 OUTLIER -132.67 147.18 52.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.085 -179.764 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.5 p -156.24 142.1 10.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.837 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.27 164.03 1.46 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.285 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.24 -70.02 2.17 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.324 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -57.21 6.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.862 0.363 . . . . 0.0 110.654 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -110.08 45.61 1.09 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.58 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.59 -21.71 65.82 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.399 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 5.5 ptp -81.26 -31.81 33.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.89 0.376 . . . . 0.0 110.625 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.4 ' HB2' HD23 ' A' ' 61' ' ' LEU . 27.2 mp0 -85.29 -36.8 20.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.897 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.412 ' N ' HD23 ' A' ' 61' ' ' LEU . 0.8 OUTLIER -46.0 170.07 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.518 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 3.8 m -51.51 -26.6 8.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.109 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 68.16 -78.11 0.04 OUTLIER 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.971 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.51 -178.63 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.22 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -95.4 -164.72 1.19 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.691 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.419 HD11 ' CD2' ' A' ' 41' ' ' PHE . 3.8 mm? -69.48 -49.36 55.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.508 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -62.46 -31.59 72.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.688 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -83.31 -27.94 29.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.505 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.436 HG23 ' CE2' ' A' ' 41' ' ' PHE . 0.6 OUTLIER -67.2 -78.42 0.06 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.835 0.35 . . . . 0.0 111.085 -179.763 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 144.44 -21.97 2.04 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.76 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.412 ' CD1' ' CE1' ' A' ' 41' ' ' PHE . 2.5 mt -51.88 -33.13 35.32 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.91 0.386 . . . . 0.0 111.075 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 68.1 p -83.55 -31.45 26.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.789 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 46.7 mtm-85 -66.45 -29.78 69.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.886 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -166.5 0.12 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.854 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -100.61 92.21 5.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.008 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 53.81 74.13 0.34 Allowed Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.803 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -85.41 4.44 35.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.592 0.234 . . . . 0.0 111.56 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -59.98 158.09 11.55 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.813 0.339 . . . . 0.0 111.4 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.492 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 0.9 OUTLIER -147.38 -179.95 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.177 179.985 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.03 146.59 33.21 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.626 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -68.18 -16.85 44.96 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.6 2.2 . . . . 0.0 112.69 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.07 -54.58 39.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.147 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -70.36 -41.32 73.28 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.916 0.389 . . . . 0.0 110.992 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.424 ' CE2' ' HD2' ' A' ' 48' ' ' ARG . 9.4 t80 -57.8 -53.01 63.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.941 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.65 -21.22 60.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.849 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -60.68 -50.34 73.88 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.283 0.563 . . . . 0.0 109.616 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 19.9 mm -75.44 -34.9 31.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.636 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.447 ' CE2' ' HA3' ' A' ' 102' ' ' GLY . 41.4 t-105 -52.92 -40.46 63.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.915 179.307 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -85.94 -28.22 24.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.717 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.75 -44.08 81.38 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.251 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 50.2 t -90.09 -76.91 0.41 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.01 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 173.95 37.45 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.573 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . 0.447 ' HA3' ' CE2' ' A' ' 97' ' ' TRP . . . -68.76 -44.27 70.82 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.499 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 4.3 mt -60.88 -39.9 83.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.935 0.397 . . . . 0.0 110.922 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -63.39 -45.81 89.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.12 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 21.9 t80 -62.05 -36.22 80.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.174 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.413 ' CD2' HG22 ' A' ' 121' ' ' THR . 0.3 OUTLIER -71.47 -40.23 70.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.58 179.605 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -64.73 -29.9 70.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.597 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 5.1 m -71.95 -50.06 32.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.475 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.94 -34.07 72.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.5 0.667 . . . . 0.0 109.622 178.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.43 ' CG1' HG22 ' A' ' 121' ' ' THR . 5.9 mt -56.95 -49.18 80.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.512 179.278 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -72.13 -34.17 68.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.642 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.414 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 12.3 t -75.79 -8.97 58.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.303 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . 0.414 ' HB2' ' O ' ' A' ' 112' ' ' SER . 5.3 mmm180 68.41 27.66 6.32 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.855 0.359 . . . . 0.0 110.909 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -109.62 -24.11 11.11 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.761 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . 0.418 ' HB1' ' CG2' ' A' ' 121' ' ' THR . . . -56.96 -21.96 34.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.32 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 75.2 ttt180 67.68 92.95 0.06 OUTLIER Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.316 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -46.66 90.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.877 2.385 . . . . 0.0 112.305 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -114.06 -63.41 1.45 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.183 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.428 ' CE2' ' HG3' ' A' ' 12' ' ' GLN . 9.5 t80 -161.8 -55.75 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.037 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.461 ' O ' ' HB2' ' A' ' 124' ' ' LEU . . . -53.73 -30.12 42.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.18 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.43 HG22 ' CG1' ' A' ' 110' ' ' ILE . 22.2 p -69.79 -37.9 76.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.747 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -68.48 -54.06 19.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.011 0.434 . . . . 0.0 110.704 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' MET . . . . . 0.453 ' HG3' ' O ' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -57.92 -29.63 65.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.564 179.519 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.461 ' HB2' ' O ' ' A' ' 120' ' ' ALA . 0.2 OUTLIER -67.08 -50.13 62.71 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.084 0.469 . . . . 0.0 110.312 179.012 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 44.8 mm-40 -53.42 -41.62 66.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.618 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -80.95 -31.13 35.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.39 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.36 -12.04 61.31 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.534 179.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 8.7 mt . . . . . 0 C--N 1.332 -0.154 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.382 179.966 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.802 0.334 . . . . 0.0 111.05 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -95.18 170.46 9.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.098 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.458 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 4.3 mp0 -131.25 102.81 6.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.936 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.509 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 3.2 mtt-85 -122.08 126.6 48.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.002 0.43 . . . . 0.0 111.015 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.511 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 2.7 m-85 -108.77 134.84 50.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.811 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.509 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 2.9 m-85 -131.43 153.49 49.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.38 0.61 . . . . 0.0 112.542 -178.307 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.461 ' HB3' ' CG2' ' A' ' 88' ' ' ILE . 0.8 OUTLIER -145.99 142.78 28.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.622 179.21 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -151.35 114.68 3.08 Favored Pre-proline 0 C--N 1.328 -0.362 0 C-N-CA 120.759 -0.377 . . . . 0.0 111.628 -179.456 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.442 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 74.7 Cg_endo -87.49 98.12 0.45 Allowed 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.894 2.396 . . . . 0.0 111.956 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 42.9 p90 -116.72 137.9 51.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.925 0.393 . . . . 0.0 111.059 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.519 HG12 ' HG3' ' A' ' 34' ' ' LYS . 24.2 mt -78.92 145.72 9.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.325 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.16 142.32 94.86 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.429 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.446 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 19.1 Cg_endo -58.68 -50.78 8.45 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.508 2.139 . . . . 0.0 112.22 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.489 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -55.25 -58.23 8.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.066 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.493 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 1.1 m-20 -65.37 -30.25 71.06 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.0 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.51 -56.05 20.3 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.393 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.489 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.7 p90 -94.52 -5.0 47.03 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.976 -179.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.493 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 5.3 mtpp -73.02 -46.58 51.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.885 0.374 . . . . 0.0 110.818 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -162.59 141.48 6.87 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.287 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -73.18 -9.28 23.16 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.686 2.258 . . . . 0.0 112.543 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 78.5 mm-40 -110.83 -33.8 6.43 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.958 0.409 . . . . 0.0 110.814 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -97.44 37.07 1.39 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.761 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.4 ' HB2' ' CG2' ' A' ' 20' ' ' ILE . 0.0 OUTLIER -71.36 -35.02 70.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.412 -179.753 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 46.96 93.35 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.196 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.519 ' HG3' HG12 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -77.9 149.9 34.17 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.479 -179.763 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.424 ' HA3' ' CD2' ' A' ' 53' ' ' HIS . . . -121.79 132.94 9.18 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.247 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.442 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 21.5 m-90 -98.26 124.23 42.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.894 0.378 . . . . 0.0 110.957 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.412 ' CD1' ' HG2' ' A' ' 51' ' ' GLU . 63.4 t90 -107.64 117.13 33.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.973 -179.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.433 ' CE1' HD12 ' A' ' 52' ' ' LEU . 22.5 m-85 -111.54 151.43 28.7 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.432 179.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.405 ' HB3' HD12 ' A' ' 46' ' ' ILE . . . -169.99 124.07 0.75 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.078 0.466 . . . . 0.0 111.343 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.511 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 16.8 t-160 -99.83 96.17 7.4 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.73 179.307 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.592 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 5.1 m-85 -79.09 143.39 35.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.225 -179.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.539 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.3 OUTLIER -113.37 111.71 22.44 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.822 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.87 -133.21 49.5 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 119.907 -1.139 . . . . 0.0 111.224 -178.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.413 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.9 Cg_exo -73.36 -16.78 24.53 Favored 'Trans proline' 0 CA--C 1.531 0.325 0 C-N-CA 122.509 2.139 . . . . 0.0 112.517 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' TRP . . . . . 0.425 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.5 OUTLIER -119.06 -163.48 0.97 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.751 -178.501 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.592 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 4.9 tt -134.85 155.53 38.49 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.693 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.413 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -131.59 -20.88 2.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.427 -179.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.5 mtt180 -128.9 134.8 48.39 Favored 'General case' 0 C--O 1.23 0.064 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.764 -179.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.98 122.61 12.54 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.971 0.415 . . . . 0.0 111.466 -179.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.432 ' HE1' ' CE1' ' A' ' 93' ' ' PHE . 24.2 ttp -122.77 115.6 22.3 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.038 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.412 ' HG2' ' CD1' ' A' ' 37' ' ' TRP . 1.4 mt-10 -105.2 129.61 53.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.005 0.431 . . . . 0.0 111.69 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.433 HD12 ' CE1' ' A' ' 38' ' ' TYR . 5.2 mt -128.75 106.43 8.93 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.312 179.456 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.424 ' CD2' ' HA3' ' A' ' 35' ' ' GLY . 0.2 OUTLIER -131.7 138.7 33.17 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.543 -0.298 . . . . 0.0 111.13 -179.635 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.43 -23.91 26.09 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.381 2.054 . . . . 0.0 112.202 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -88.46 -32.85 18.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.129 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.12 125.74 24.17 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.09 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.421 ' CB ' ' CD ' ' A' ' 58' ' ' PRO . 76.9 Cg_exo -50.81 -175.66 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.692 2.261 . . . . 0.0 112.485 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.421 ' CD ' ' CB ' ' A' ' 57' ' ' PRO . 33.3 Cg_exo -58.7 81.3 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.584 2.189 . . . . 0.0 112.498 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.406 ' HB ' ' HB2' ' A' ' 51' ' ' GLU . 94.6 mt -65.56 95.29 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.092 0.472 . . . . 0.0 110.441 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.447 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.4 OUTLIER -78.0 117.55 19.43 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.108 -179.608 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 53.9 mt -121.52 151.37 40.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.732 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.8 p -151.63 145.74 16.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.091 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.38 139.89 58.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.916 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.83 -47.43 1.4 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.394 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.67 -42.46 9.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.901 0.381 . . . . 0.0 110.685 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -121.32 47.9 1.76 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.699 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.53 -29.84 70.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.045 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -85.38 -30.33 23.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.201 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -79.41 -50.11 11.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.196 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.1 ptp -52.93 -177.47 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.157 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.48 -50.92 61.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.764 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 75.17 -57.8 0.59 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.311 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -46.26 154.77 0.25 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.326 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -74.83 174.11 9.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.922 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.442 HD12 ' CE1' ' A' ' 15' ' ' PHE . 4.0 mm? -58.19 -45.99 86.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.473 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -69.71 -40.84 76.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.925 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -65.82 -22.63 66.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.547 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.45 -69.94 0.5 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.722 0.296 . . . . 0.0 110.921 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 126.11 -19.83 6.39 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.684 -0.769 . . . . 0.0 112.671 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.14 -53.11 37.58 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.851 0.358 . . . . 0.0 110.713 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' THR . . . . . 0.439 HG23 ' CE2' ' A' ' 15' ' ' PHE . 11.6 p -58.06 -49.88 75.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.665 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -58.17 -27.15 63.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.456 179.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -163.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.578 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -99.71 82.22 2.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.792 0.33 . . . . 0.0 110.81 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.67 70.27 1.03 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.565 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -95.93 32.62 1.85 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.602 0.239 . . . . 0.0 111.164 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.463 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 0.7 OUTLIER -113.07 141.38 46.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.35 -179.891 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.461 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 0.1 OUTLIER -124.67 157.28 32.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.78 179.545 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.429 HD12 ' CB ' ' A' ' 91' ' ' ARG . 0.3 OUTLIER -61.52 145.63 90.93 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.506 179.747 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -60.6 -23.38 75.54 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.599 2.199 . . . . 0.0 112.51 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.429 ' CB ' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -62.26 -53.3 57.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.22 -179.921 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -57.71 -56.34 23.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.28 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.432 ' CE1' ' HE1' ' A' ' 50' ' ' MET . 52.4 t80 -50.18 -53.35 28.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.806 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.36 -20.45 62.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.525 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.401 ' HB2' ' O ' ' A' ' 91' ' ' ARG . 0.4 OUTLIER -60.59 -50.01 75.23 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 109.541 -0.541 . . . . 0.0 109.541 179.089 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 15.0 mm -72.38 -35.41 51.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.579 179.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.426 ' CZ3' ' HG ' ' A' ' 60' ' ' LEU . 12.7 t-105 -52.58 -41.93 64.05 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.125 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -85.99 -26.46 25.43 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.655 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.17 -53.24 60.45 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.449 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 70.9 m -86.85 -87.16 0.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.341 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -167.23 48.64 0.25 Allowed Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.543 -0.837 . . . . 0.0 112.683 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . 0.447 ' HA2' ' CD2' ' A' ' 60' ' ' LEU . . . -69.37 -39.56 80.87 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.565 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 16.7 mm -70.08 -44.95 77.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.799 0.333 . . . . 0.0 111.288 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.03 -49.21 78.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.813 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 94.0 t80 -59.5 -50.45 73.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.053 0.454 . . . . 0.0 110.407 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.439 ' CD1' HG22 ' A' ' 121' ' ' THR . 0.2 OUTLIER -57.29 -46.53 83.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.393 179.508 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -59.67 -29.82 68.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.663 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 15.1 m -67.11 -50.32 61.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.777 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.32 -33.78 71.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.564 0.697 . . . . 0.0 109.436 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.43 ' CG1' HG22 ' A' ' 121' ' ' THR . 9.5 mt -56.31 -48.73 79.25 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.258 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -72.0 -32.56 67.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.245 179.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.451 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 0.3 OUTLIER -74.71 -9.28 58.41 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.062 179.491 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . 0.451 ' HB2' ' O ' ' A' ' 112' ' ' SER . 15.7 mmm180 69.66 31.37 3.63 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.966 0.413 . . . . 0.0 110.998 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -108.9 -29.97 8.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.555 179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -71.38 102.15 2.56 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.866 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 39.2 mtt85 -58.04 109.78 2.06 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.191 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . 0.548 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 75.6 Cg_exo -50.5 89.82 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.676 2.25 . . . . 0.0 112.187 179.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.5 t -141.58 81.77 1.79 Allowed 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.834 0.349 . . . . 0.0 111.822 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.458 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 7.8 t80 65.13 -64.34 0.17 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 179.003 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.54 -52.22 60.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.921 0.391 . . . . 0.0 111.397 -179.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.548 ' OG1' ' HA ' ' A' ' 117' ' ' PRO . 0.6 OUTLIER -65.26 -46.58 79.95 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.677 179.669 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.85 -56.27 21.24 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.387 0.613 . . . . 0.0 110.256 179.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' MET . . . . . 0.401 ' CE ' ' C ' ' A' ' 123' ' ' MET . 0.0 OUTLIER -53.69 -33.66 56.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.335 179.17 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.72 -49.04 74.64 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.15 0.5 . . . . 0.0 109.818 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 40.7 mm-40 -50.79 -40.2 54.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.909 178.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -79.3 -32.0 43.38 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.068 178.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.31 -21.43 59.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.118 178.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.332 -0.173 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.952 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.42 ' HD2' ' HA2' ' A' ' 43' ' ' GLY . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.207 0 CA-C-O 120.683 0.278 . . . . 0.0 111.023 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -44.76 147.4 0.63 Allowed 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.951 0.405 . . . . 0.0 111.705 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 74.2 mm-40 -118.91 112.64 19.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.952 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.569 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 1.1 mtp180 -115.4 132.36 56.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.006 0.432 . . . . 0.0 110.767 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.498 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 1.3 m-85 -115.59 135.21 54.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.399 -179.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.569 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 0.6 OUTLIER -136.76 154.17 50.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.289 0.566 . . . . 0.0 112.007 -178.759 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.478 ' HD2' ' CE2' ' A' ' 38' ' ' TYR . 0.6 OUTLIER -149.21 147.16 28.08 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.767 179.872 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.509 HG12 HD11 ' A' ' 80' ' ' LEU . 0.4 OUTLIER -153.28 127.63 4.58 Favored Pre-proline 0 C--O 1.233 0.213 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.781 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.409 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 66.2 Cg_endo -91.87 114.83 0.37 Allowed 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 123.222 2.614 . . . . 0.0 111.573 179.17 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.7 p90 -131.31 142.95 50.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.955 0.407 . . . . 0.0 111.573 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.475 HG12 ' HG3' ' A' ' 34' ' ' LYS . 23.4 mt -88.03 134.2 28.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.801 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -56.21 122.84 51.29 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.571 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.467 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 84.5 Cg_exo -44.5 -46.82 11.73 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.568 2.178 . . . . 0.0 112.787 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.513 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -54.74 -58.24 8.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.109 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.511 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 7.0 m-20 -67.96 -29.39 68.43 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.853 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.67 -55.04 25.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.273 -179.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.513 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.1 p90 -94.03 -14.31 25.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.91 -179.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.511 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 3.3 mtpt -62.98 -50.95 68.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.797 0.332 . . . . 0.0 110.768 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 179.07 144.53 0.34 Allowed Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.347 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -73.55 -2.29 11.94 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.756 2.304 . . . . 0.0 112.824 179.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.38 -46.55 8.65 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.026 0.441 . . . . 0.0 110.575 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -95.33 33.55 1.56 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.195 179.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.8 mmtt -45.83 -76.59 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.518 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 61.83 93.87 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.727 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.475 ' HG3' HG12 ' A' ' 20' ' ' ILE . 1.2 ttmt -91.06 138.28 31.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.375 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -107.66 134.63 12.31 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.269 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.409 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 11.4 m-90 -98.61 134.58 41.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.879 0.371 . . . . 0.0 110.82 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.414 ' CZ3' HD23 ' A' ' 80' ' ' LEU . 26.2 t90 -113.39 117.27 31.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.06 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.478 ' CE2' ' HD2' ' A' ' 16' ' ' ARG . 53.2 m-85 -116.28 142.74 46.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.053 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.502 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . . . -164.97 124.22 1.8 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.279 0.561 . . . . 0.0 111.883 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.504 ' HB3' ' HG3' ' A' ' 48' ' ' ARG . 5.5 t-160 -90.81 95.75 10.29 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.341 -0.845 . . . . 0.0 108.733 178.403 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.622 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 7.7 m-85 -76.98 158.57 30.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.544 -178.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.596 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 3.5 t70 -126.32 115.09 19.14 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.42 ' HA2' ' HD2' ' A' ' 10' ' ' ARG . . . 57.65 -135.61 51.55 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 119.804 -1.189 . . . . 0.0 111.124 -178.452 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_exo -71.7 -18.26 28.86 Favored 'Trans proline' 0 CA--C 1.53 0.289 0 C-N-CA 122.53 2.154 . . . . 0.0 112.278 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' TRP . . . . . 0.402 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.7 OUTLIER -116.15 -159.34 0.72 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.391 -178.83 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.622 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 4.7 tt -131.62 157.73 43.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 CA-C-O 121.304 0.573 . . . . 0.0 112.255 -179.287 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.446 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -112.45 -37.3 5.0 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.013 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.504 ' HG3' ' HB3' ' A' ' 40' ' ' HIS . 0.1 OUTLIER -146.38 160.32 42.2 Favored 'General case' 0 CA--C 1.523 -0.084 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.964 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.502 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 9.1 tt0 -149.9 150.55 32.06 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.158 0.504 . . . . 0.0 111.646 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.408 ' HB2' ' CZ3' ' A' ' 97' ' ' TRP . 3.3 ttm -138.85 122.51 17.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.134 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -111.44 139.75 46.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.043 0.449 . . . . 0.0 111.583 -179.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.429 HD11 ' CD1' ' A' ' 38' ' ' TYR . 0.7 OUTLIER -135.08 101.77 4.98 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.364 179.652 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -116.68 138.05 24.21 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.096 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -52.06 -26.6 26.19 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.662 2.241 . . . . 0.0 112.331 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -98.89 -25.04 14.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.968 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -117.06 118.98 35.53 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.774 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.403 ' O ' ' N ' ' A' ' 59' ' ' ILE . 73.1 Cg_exo -48.72 177.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.405 2.07 . . . . 0.0 112.261 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -56.75 82.4 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.536 2.157 . . . . 0.0 112.345 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.403 ' N ' ' O ' ' A' ' 57' ' ' PRO . 5.8 mt -65.01 107.05 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.861 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.447 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.3 OUTLIER -83.28 136.96 34.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.893 -179.93 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.449 ' HB3' ' HB3' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -132.68 145.79 51.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.024 -179.804 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.0 p -150.37 131.91 5.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.982 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.67 164.7 1.02 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.414 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.79 -70.71 1.15 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.407 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.62 -55.67 18.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.948 0.404 . . . . 0.0 110.788 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.432 ' CB ' HD13 ' A' ' 61' ' ' LEU . 66.6 m-20 -99.13 59.33 1.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.864 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -69.04 -23.97 64.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.203 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 7.1 mmt -85.25 -37.87 19.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.994 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -81.69 -36.59 28.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.202 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 63.4 tpp -52.11 158.62 1.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.18 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 5.4 t -49.1 -58.7 4.51 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.105 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 66.03 19.36 11.19 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.216 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.405 ' HB2' ' CG2' ' A' ' 78' ' ' THR . 15.6 mmtt -123.69 131.67 53.66 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.782 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -58.64 166.4 1.85 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.41 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.429 HD23 ' CZ ' ' A' ' 15' ' ' PHE . 12.2 mt -58.8 -53.11 62.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.682 0.277 . . . . 0.0 111.432 -179.458 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -62.87 -31.93 73.07 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.275 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -77.82 -36.67 49.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.322 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.405 ' CG2' ' HB2' ' A' ' 73' ' ' LYS . 0.7 OUTLIER -62.8 -73.27 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.118 -179.808 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 140.23 -6.6 2.81 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.532 -0.842 . . . . 0.0 113.101 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.54 HD13 ' HB3' ' A' ' 15' ' ' PHE . 2.6 mm? -63.12 -38.15 90.02 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.249 0.547 . . . . 0.0 110.161 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 69.0 p -87.56 -28.52 21.91 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.978 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.04 -36.11 82.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.612 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -80.24 -164.61 0.71 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.753 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -109.86 112.88 25.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.911 0.386 . . . . 0.0 111.302 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.82 82.6 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.954 -0.641 . . . . 0.0 113.227 179.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.412 ' CB ' ' O ' ' A' ' 80' ' ' LEU . . . -118.63 15.19 13.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.718 0.294 . . . . 0.0 111.163 179.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.404 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 14.6 mt-10 -87.02 166.4 15.07 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.895 0.378 . . . . 0.0 111.286 -179.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.449 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 0.8 OUTLIER -146.98 168.11 5.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.008 179.688 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -90.01 140.82 27.61 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.742 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.13 -16.47 54.62 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.632 2.221 . . . . 0.0 112.649 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -71.76 -54.06 11.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.205 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.409 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 0.0 OUTLIER -66.95 -39.83 87.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.972 -179.803 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -58.5 -53.21 60.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.477 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.75 -19.32 62.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.411 179.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.409 ' HB2' ' HA ' ' A' ' 92' ' ' GLN . 0.1 OUTLIER -61.82 -50.18 73.35 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.117 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 14.0 mm -72.23 -37.76 60.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.405 179.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.456 ' O ' ' N ' ' A' ' 102' ' ' GLY . 41.2 t-105 -52.88 -42.15 65.01 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.152 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -85.72 -21.9 28.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.699 179.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -58.24 -54.07 51.1 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.356 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 41.6 t -86.12 -83.01 0.19 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.29 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -165.84 31.45 0.22 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.601 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . 0.456 ' N ' ' O ' ' A' ' 97' ' ' TRP . . . -52.64 -48.06 56.73 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.65 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.461 ' HA ' ' CD1' ' A' ' 124' ' ' LEU . 24.2 mm -66.29 -43.13 91.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.742 0.306 . . . . 0.0 111.056 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.86 -39.43 74.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.97 0.415 . . . . 0.0 110.552 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -64.2 -53.48 48.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.637 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.454 ' CD1' HD13 ' A' ' 124' ' ' LEU . 1.5 mt -61.59 -37.66 84.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.632 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.36 -31.05 72.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.702 179.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 14.7 m -70.14 -50.33 41.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.642 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.06 -31.91 66.57 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.246 0.546 . . . . 0.0 109.729 179.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 4.6 mt -56.89 -47.14 83.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.247 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -69.59 -39.31 77.35 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.436 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.57 -14.1 62.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.111 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . 0.405 ' NH1' ' HB3' ' A' ' 113' ' ' ARG . 3.6 mmm180 72.45 29.47 2.11 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.817 0.341 . . . . 0.0 111.004 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -111.81 -21.32 11.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.05 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -56.68 -26.36 56.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.443 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 56.7 mtt180 60.74 96.56 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.631 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -47.11 92.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.592 2.195 . . . . 0.0 112.566 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 23.8 m -106.24 -59.54 1.77 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.59 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -165.59 -56.26 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.151 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.8 -40.85 66.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.191 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 6.6 p -60.79 -40.68 93.5 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.164 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -63.99 -54.26 37.17 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.42 0.628 . . . . 0.0 109.424 178.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' MET . . . . . 0.443 ' HE1' ' C ' ' A' ' 123' ' ' MET . 2.5 tmm? -56.35 -33.63 65.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.662 178.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.461 ' CD1' ' HA ' ' A' ' 103' ' ' ILE . 1.2 tt -67.55 -44.81 77.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.04 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 46.3 mm-40 -52.88 -38.73 61.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.014 179.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 49.9 m-20 -80.99 -34.28 33.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.345 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 tp -68.98 -11.25 60.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.823 179.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 14.5 mt . . . . . 0 C--O 1.231 0.121 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.224 -179.951 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.6 ttm-85 . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.936 0.398 . . . . 0.0 111.01 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 63.67 133.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.108 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.422 ' HG3' ' CZ ' ' A' ' 119' ' ' TYR . 90.6 mm-40 -125.0 102.82 7.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.69 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.465 ' CB ' ' CZ ' ' A' ' 15' ' ' PHE . 18.3 mtp180 -117.53 129.35 55.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.159 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.504 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 1.3 m-85 -113.46 134.64 54.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.982 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.465 ' CZ ' ' CB ' ' A' ' 13' ' ' ARG . 2.2 m-85 -134.67 153.49 51.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.215 0.531 . . . . 0.0 112.019 -178.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.447 ' HB3' ' CG2' ' A' ' 88' ' ' ILE . 0.6 OUTLIER -149.17 146.11 27.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.803 179.486 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.431 ' N ' ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -143.06 122.31 7.56 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 120.656 0.265 . . . . 0.0 111.359 -179.589 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.466 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 74.3 Cg_endo -88.44 89.49 0.47 Allowed 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.938 2.425 . . . . 0.0 112.354 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 29.1 p90 -109.15 144.78 36.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.819 0.342 . . . . 0.0 110.878 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 4.8 mt -90.77 144.96 8.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.045 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.409 ' O ' ' CG ' ' A' ' 25' ' ' GLN . 7.5 mtt180 -70.12 134.4 87.41 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.503 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.511 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 85.3 Cg_exo -41.26 -60.81 0.58 Allowed 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.949 2.432 . . . . 0.0 113.19 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.62 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -46.22 -53.89 9.77 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.899 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.507 ' HB3' ' HA ' ' A' ' 32' ' ' LYS . 1.4 m-20 -60.34 -36.79 78.79 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.651 -0.704 . . . . 0.0 112.072 -178.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.503 ' HG3' ' CA ' ' A' ' 22' ' ' PRO . 1.3 mt-30 -56.92 -57.59 11.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.723 -179.147 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.62 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.8 p90 -86.36 -3.03 58.92 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.71 -179.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.85 -43.69 35.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.865 0.364 . . . . 0.0 110.424 179.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.421 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 3.4 t70 -168.39 148.69 4.29 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.121 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 2.8 Cg_exo -73.44 -30.38 10.14 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.758 2.305 . . . . 0.0 111.781 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -94.6 -41.97 9.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.802 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -87.35 53.59 2.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.642 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.507 ' HA ' ' HB3' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -122.34 62.09 0.97 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.859 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.02 148.7 0.24 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.313 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.92 117.65 34.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.332 -179.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -85.39 124.34 6.75 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.793 -0.718 . . . . 0.0 111.948 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.466 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 24.2 m-90 -97.88 131.31 44.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.038 0.447 . . . . 0.0 111.258 -179.518 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 33.2 t90 -116.2 117.15 29.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.636 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.446 ' CE2' ' HG3' ' A' ' 16' ' ' ARG . 11.7 m-85 -110.11 152.08 26.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.622 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.45 ' HB3' ' CE1' ' A' ' 41' ' ' PHE . . . -170.3 124.26 0.72 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.013 0.435 . . . . 0.0 111.319 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.504 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 14.1 t-160 -97.11 101.0 12.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.75 179.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.578 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 7.7 m-85 -87.96 123.38 32.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.495 -179.263 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.427 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 38.3 m-20 -95.87 121.45 37.62 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 56.09 -137.77 46.36 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 119.944 -1.122 . . . . 0.0 111.042 -178.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.42 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 7.2 Cg_exo -73.33 -16.06 24.93 Favored 'Trans proline' 0 CA--C 1.531 0.355 0 C-N-CA 122.38 2.053 . . . . 0.0 112.28 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' TRP . . . . . 0.42 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 0.9 OUTLIER -117.26 -170.25 1.81 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.943 0.401 . . . . 0.0 111.89 -178.434 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.578 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 3.9 tt -128.28 154.65 39.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.878 -179.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.413 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -131.97 -19.37 2.58 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.132 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.415 ' HB2' ' HB3' ' A' ' 40' ' ' HIS . 5.9 mtm180 -130.27 142.65 50.54 Favored 'General case' 0 C--N 1.337 0.054 0 CA-C-O 120.85 0.357 . . . . 0.0 111.039 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.38 132.88 18.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.207 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 14.1 ttp -133.4 120.71 21.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.331 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.4 ' HB3' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -105.24 135.0 47.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.267 -179.648 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.426 HD11 ' CE1' ' A' ' 38' ' ' TYR . 54.7 mt -135.15 101.88 5.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.71 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -120.75 155.4 57.19 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.015 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.16 -30.03 81.53 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.757 2.305 . . . . 0.0 112.457 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -109.82 9.67 24.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.478 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -142.3 113.12 6.16 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.792 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -50.92 -179.9 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.432 2.088 . . . . 0.0 112.336 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.25 82.69 0.07 OUTLIER 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.665 2.244 . . . . 0.0 112.488 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.4 ' HB ' ' HB3' ' A' ' 51' ' ' GLU . 7.1 mt -64.8 98.48 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.991 0.424 . . . . 0.0 110.709 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.426 HD11 ' CZ3' ' A' ' 97' ' ' TRP . 0.2 OUTLIER -76.1 112.69 12.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.773 -179.74 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -115.74 152.6 32.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.847 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p -158.79 146.47 7.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.048 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.22 162.03 2.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.026 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.09 -65.75 2.26 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.065 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.3 -36.4 66.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.034 0.445 . . . . 0.0 110.342 179.489 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -119.49 54.83 0.98 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.505 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.44 -34.22 77.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.203 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 36.5 mmm -85.71 -38.94 17.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.881 0.372 . . . . 0.0 110.777 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.58 -44.9 61.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.976 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 21.3 ttm -52.32 163.51 0.4 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.927 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 0.425 ' O ' ' CB ' ' A' ' 72' ' ' GLU . 1.8 t -46.7 -55.07 8.36 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.208 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.425 ' CB ' ' O ' ' A' ' 71' ' ' CYS . 2.7 tt0 84.04 -21.89 0.24 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.786 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.47 -179.69 5.87 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.922 0.391 . . . . 0.0 111.163 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -99.26 -171.58 2.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.463 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.413 HD12 ' CE1' ' A' ' 15' ' ' PHE . 3.6 mm? -67.3 -49.99 61.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.568 -179.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.27 -41.72 73.08 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.854 0.359 . . . . 0.0 111.338 -179.394 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -61.81 -38.4 88.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.684 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -59.82 -72.42 0.11 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.146 -179.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 132.88 -19.4 4.42 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.551 -179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 mp -52.79 -42.83 65.4 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.032 0.444 . . . . 0.0 110.765 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 28.3 p -71.2 -39.63 71.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.649 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -60.87 -30.41 70.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.557 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.6 mtpp -60.11 -177.11 0.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.691 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.54 68.88 2.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.767 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.56 64.55 1.68 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.638 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -92.6 26.25 2.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.709 0.29 . . . . 0.0 111.233 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.99 155.65 16.65 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.85 0.357 . . . . 0.0 110.928 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.447 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 1.0 OUTLIER -133.56 178.69 5.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.072 179.818 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -93.75 158.45 36.51 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.828 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo -73.0 -35.81 4.98 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.736 2.291 . . . . 0.0 112.107 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.96 -54.26 41.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.223 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -64.3 -45.87 86.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.18 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -55.33 -53.25 58.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.014 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -72.6 -20.22 61.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.679 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.93 -49.63 76.93 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 16.7 mm -73.76 -35.06 42.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.366 179.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.432 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 5.8 t-105 -54.65 -39.7 68.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.991 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.63 -25.59 26.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.531 179.272 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.8 -53.7 54.8 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.085 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 52.3 t -83.96 -76.65 0.29 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.026 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 175.01 39.0 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.598 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . 0.432 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -58.9 -62.22 6.48 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.429 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 3.7 mp -52.93 -38.37 28.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.784 0.326 . . . . 0.0 111.258 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.96 -40.13 87.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.982 0.42 . . . . 0.0 110.515 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -69.72 -41.55 75.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.496 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.428 ' CD1' HD12 ' A' ' 110' ' ' ILE . 0.3 OUTLIER -68.22 -50.31 54.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.876 179.888 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -29.68 70.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.037 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 4.0 m -68.52 -50.51 51.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.793 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.29 -35.1 71.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.645 0.736 . . . . 0.0 109.389 178.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.428 HD12 ' CD1' ' A' ' 106' ' ' LEU . 15.9 mt -56.24 -45.23 81.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.534 179.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -70.34 -41.16 73.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.031 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.502 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 21.6 p -76.55 -4.63 43.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.424 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . 0.502 ' HB2' ' O ' ' A' ' 112' ' ' SER . 24.2 mmm180 75.38 24.12 1.43 Allowed 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.79 0.329 . . . . 0.0 111.332 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.38 -24.19 20.87 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.386 179.082 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -102.11 107.7 18.87 Favored 'General case' 0 N--CA 1.456 -0.136 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.873 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . 0.42 ' O ' ' N ' ' A' ' 118' ' ' THR . 0.2 OUTLIER -56.17 135.15 74.92 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.937 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_exo -52.42 84.95 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.596 2.197 . . . . 0.0 112.517 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.42 ' N ' ' O ' ' A' ' 116' ' ' ARG . 3.6 p -107.62 -176.59 3.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.413 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.422 ' CZ ' ' HG3' ' A' ' 12' ' ' GLN . 40.2 t80 -59.17 -36.35 75.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.87 0.367 . . . . 0.0 110.77 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -69.15 -52.08 31.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.116 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.413 ' HA ' HD12 ' A' ' 110' ' ' ILE . 60.5 p -58.63 -49.28 78.09 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.835 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.97 -48.54 79.69 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.244 0.545 . . . . 0.0 109.826 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' MET . . . . . 0.413 ' O ' ' HE1' ' A' ' 123' ' ' MET . 0.0 OUTLIER -62.14 -33.37 74.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.883 178.785 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.97 -50.26 69.28 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.168 179.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 86.6 mm-40 -52.92 -42.57 65.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.359 179.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -79.06 -29.84 43.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.638 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.413 ' CB ' ' HE1' ' A' ' 123' ' ' MET . 1.3 tt -76.73 -7.02 54.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.647 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 20.3 mt . . . . . 0 C--N 1.332 -0.163 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.896 179.924 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 18.6 mtt180 . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.781 0.324 . . . . 0.0 111.029 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.2 134.14 42.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.943 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 89.7 mm-40 -119.1 102.68 8.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.941 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.477 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -122.34 143.23 49.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.787 179.868 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.543 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 0.7 OUTLIER -124.34 134.74 53.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.709 -179.621 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.477 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 0.2 OUTLIER -143.56 155.53 44.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.236 0.541 . . . . 0.0 111.881 -179.695 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.512 ' HG3' ' CE2' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -149.6 153.4 37.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.897 178.71 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.79 133.09 8.82 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.757 0.313 . . . . 0.0 111.535 -179.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.424 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 70.7 Cg_endo -91.97 120.25 0.54 Allowed 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.183 2.589 . . . . 0.0 111.777 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.7 p90 -144.59 155.99 43.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.99 0.424 . . . . 0.0 111.154 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 2.2 mt -108.9 150.53 11.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.812 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -69.23 123.22 87.82 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.25 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.578 ' CA ' ' HG3' ' A' ' 25' ' ' GLN . 67.2 Cg_exo -40.0 -50.79 3.3 Favored 'Trans proline' 0 C--O 1.239 0.554 0 C-N-CA 122.952 2.435 . . . . 0.0 112.996 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.649 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -47.6 -59.09 3.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.879 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.441 ' HA ' ' HG2' ' A' ' 27' ' ' LYS . 0.8 OUTLIER -62.63 -33.59 75.33 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.505 -0.77 . . . . 0.0 112.833 -178.831 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.578 ' HG3' ' CA ' ' A' ' 22' ' ' PRO . 0.5 OUTLIER -55.89 -53.89 51.28 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -178.314 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.649 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.9 p90 -88.88 -40.72 12.91 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -178.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.561 ' HG2' ' O ' ' A' ' 23' ' ' ALA . 11.0 ptmt -58.34 -36.26 73.17 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 -178.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -156.91 116.67 2.06 Favored Pre-proline 0 C--N 1.33 -0.28 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.893 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.27 -7.01 19.85 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.617 2.212 . . . . 0.0 112.366 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -95.8 -36.14 11.26 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.947 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -88.99 46.02 1.35 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.441 178.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.9 mmtp -78.86 59.65 2.64 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.948 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 12.2 mmtm -53.8 100.7 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.025 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.92 121.35 31.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.949 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -113.66 144.48 18.18 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.727 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.426 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 11.2 m-90 -106.21 132.73 51.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.843 0.354 . . . . 0.0 110.745 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.494 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 22.4 t90 -115.05 117.56 30.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.222 -179.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.512 ' CE2' ' HG3' ' A' ' 16' ' ' ARG . 0.4 OUTLIER -117.24 152.28 35.16 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.32 179.146 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.44 ' HB3' ' CE1' ' A' ' 41' ' ' PHE . . . -170.58 130.29 0.86 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.203 0.525 . . . . 0.0 111.807 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.532 ' HB3' ' HG3' ' A' ' 48' ' ' ARG . 8.4 t-160 -96.68 103.68 15.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.496 -0.775 . . . . 0.0 108.997 178.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.645 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 7.1 m-85 -90.3 127.42 36.16 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.589 -179.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.424 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 1.1 m-20 -93.88 113.36 25.36 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 178.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 57.48 -136.51 50.6 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.025 -1.084 . . . . 0.0 110.959 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -71.17 -19.2 29.89 Favored 'Trans proline' 0 N--CA 1.465 -0.192 0 C-N-CA 122.385 2.056 . . . . 0.0 112.08 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' TRP . . . . . 0.404 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -111.4 -174.0 2.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.505 -178.864 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.645 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 1.4 tt -121.44 149.33 24.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.172 0.51 . . . . 0.0 112.198 -179.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -105.42 -40.33 5.84 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.832 -179.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.532 ' HG3' ' HB3' ' A' ' 40' ' ' HIS . 1.6 ptp180 -149.58 153.24 36.8 Favored 'General case' 0 CA--C 1.523 -0.084 0 C-N-CA 120.542 -0.463 . . . . 0.0 111.512 -179.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -148.23 156.11 42.17 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.896 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.452 ' CG ' ' HB2' ' A' ' 38' ' ' TYR . 22.8 ptm -142.61 122.64 13.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.297 179.523 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.408 ' O ' ' HA ' ' A' ' 58' ' ' PRO . 0.0 OUTLIER -98.78 126.51 44.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.324 -179.405 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 20.4 mt -128.21 112.05 14.09 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.752 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -140.02 134.63 15.87 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.2 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -50.99 -26.19 17.95 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.399 2.066 . . . . 0.0 112.234 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -96.68 -28.76 14.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.949 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.408 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 5.5 mttp -116.26 121.68 33.23 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.79 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 56' ' ' LYS . 9.5 Cg_endo -50.94 169.63 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.341 2.028 . . . . 0.0 112.111 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.408 ' HA ' ' O ' ' A' ' 51' ' ' GLU . 19.2 Cg_endo -60.84 78.54 0.07 OUTLIER 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.536 2.157 . . . . 0.0 112.477 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 11.8 mt -65.46 89.96 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 121.075 0.464 . . . . 0.0 110.7 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.448 ' CD2' ' CZ3' ' A' ' 97' ' ' TRP . 7.2 mt -68.68 113.72 6.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.558 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.509 ' CD2' ' HB3' ' A' ' 69' ' ' GLU . 5.7 mt -101.96 155.72 17.98 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.399 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.428 HG22 ' CE2' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -164.52 140.08 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.867 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.12 161.2 7.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.928 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.39 -69.86 2.92 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.84 -179.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -45.12 73.12 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.043 0.449 . . . . 0.0 110.426 179.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.435 ' CB ' ' CD2' ' A' ' 61' ' ' LEU . 21.9 m-20 -114.35 52.64 0.83 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.569 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -62.46 -38.22 88.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.107 -179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 75.7 mmm -85.64 -31.08 22.75 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.949 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.509 ' HB3' ' CD2' ' A' ' 61' ' ' LEU . 0.3 OUTLIER -75.52 -36.54 60.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.049 -179.754 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.416 ' HA ' ' CD1' ' A' ' 61' ' ' LEU . 0.2 OUTLIER -47.42 172.45 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.244 179.861 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 0.424 ' O ' ' CB ' ' A' ' 72' ' ' GLU . 21.5 p -45.88 -41.55 11.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.181 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.424 ' CB ' ' O ' ' A' ' 71' ' ' CYS . 10.5 tt0 82.19 -13.78 0.83 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.84 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.88 -176.41 3.05 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.908 0.385 . . . . 0.0 110.864 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -106.4 174.07 6.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.463 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.426 HD11 ' CZ ' ' A' ' 15' ' ' PHE . 32.4 tp -56.21 -44.21 79.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.461 -179.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -70.96 -46.18 62.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.714 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.48 -28.88 65.33 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -178.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.427 HG22 ' CZ ' ' A' ' 41' ' ' PHE . 0.9 OUTLIER -56.49 -67.28 0.32 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.736 0.303 . . . . 0.0 111.243 -179.589 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 131.46 -20.28 4.69 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.876 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.7 mt -53.22 -29.91 34.95 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.977 0.418 . . . . 0.0 110.822 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 11.2 p -86.24 -43.36 13.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.737 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.53 -30.18 69.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.703 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 43.6 mttt -67.45 -177.25 0.69 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.978 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 20.5 mmt85 -81.62 73.75 8.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.1 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.92 65.05 3.81 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.65 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -76.82 -5.35 47.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.573 0.225 . . . . 0.0 111.501 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -55.03 150.03 11.02 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.973 0.416 . . . . 0.0 111.147 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.458 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 9.8 pt -136.46 169.45 20.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.135 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -82.58 146.17 52.79 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.757 179.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -67.34 -24.78 42.92 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.557 2.171 . . . . 0.0 112.534 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -54.1 49.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.992 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -58.61 -49.0 79.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.006 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -55.66 -53.32 58.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.714 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.83 -21.82 65.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.791 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.74 -50.59 68.48 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.059 0.457 . . . . 0.0 109.862 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 18.8 mm -77.85 -34.48 19.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.71 179.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.448 ' CZ3' ' CD2' ' A' ' 60' ' ' LEU . 28.0 t-105 -52.59 -40.68 62.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.909 179.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -86.12 -30.91 22.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.425 179.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -57.34 -54.23 49.19 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.424 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 73.7 m -74.69 -75.85 0.15 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.162 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 171.25 38.32 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.619 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . 0.435 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -69.21 -41.7 78.61 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.342 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.433 HD13 HG21 ' A' ' 103' ' ' ILE . 37.1 mm -65.15 -44.08 95.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.757 0.313 . . . . 0.0 110.824 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -49.09 78.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.328 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.428 ' CE2' HG22 ' A' ' 62' ' ' VAL . 2.2 t80 -62.6 -37.89 88.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.065 179.36 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.1 -35.72 76.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.442 179.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.91 -33.24 75.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.306 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 2.6 m -68.78 -49.92 54.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.3 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.07 -34.79 75.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.398 0.618 . . . . 0.0 109.772 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.407 HG12 ' HB ' ' A' ' 121' ' ' THR . 2.6 mt -56.94 -47.13 83.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.61 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -72.15 -33.1 67.47 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.562 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.419 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 10.0 t -77.57 -8.94 58.6 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.23 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . 0.419 ' HB2' ' O ' ' A' ' 112' ' ' SER . 74.1 mmt-85 68.81 26.83 5.9 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 120.907 0.384 . . . . 0.0 111.105 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -108.92 -21.9 12.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.774 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -56.81 -22.62 37.64 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.365 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 68.49 81.83 0.2 Allowed Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.835 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . 0.498 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 68.7 Cg_exo -51.85 89.42 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.654 2.236 . . . . 0.0 112.489 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 71.5 p -117.9 -36.64 3.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.889 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 12.0 t80 -176.3 -49.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.126 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -55.02 -52.14 64.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.215 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.498 ' OG1' ' HA ' ' A' ' 117' ' ' PRO . 70.5 p -59.58 -45.21 92.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.629 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.94 -55.48 30.18 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 121.662 0.744 . . . . 0.0 109.627 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' MET . . . . . 0.429 ' HA ' ' OD1' ' A' ' 126' ' ' ASN . 0.0 OUTLIER -57.58 -32.75 67.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.784 178.492 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.82 -41.98 82.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.079 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -52.66 -44.53 66.25 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.329 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ASN . . . . . 0.429 ' OD1' ' HA ' ' A' ' 123' ' ' MET . 0.9 OUTLIER -81.08 -27.73 35.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.66 179.465 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.423 ' HB2' ' O ' ' A' ' 123' ' ' MET . 1.0 OUTLIER -64.82 -19.26 65.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.851 0.358 . . . . 0.0 110.344 178.958 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.8 mt . . . . . 0 C--N 1.333 -0.144 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.241 179.978 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.833 0.349 . . . . 0.0 111.003 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.84 153.36 17.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.023 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.419 ' HG2' ' CZ ' ' A' ' 119' ' ' TYR . 13.5 mp0 -122.1 102.94 8.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.888 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.481 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -108.99 136.99 47.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.007 0.432 . . . . 0.0 110.833 -179.822 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.508 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 0.4 OUTLIER -119.55 138.87 52.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.189 -179.701 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.481 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 5.5 m-85 -142.3 152.15 42.69 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.463 0.649 . . . . 0.0 112.685 -178.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.494 ' HG3' ' CD2' ' A' ' 38' ' ' TYR . 8.2 ttp180 -149.59 147.41 28.11 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 114.836 -1.074 . . . . 0.0 109.59 179.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.452 ' N ' ' HG2' ' A' ' 16' ' ' ARG . 0.6 OUTLIER -153.4 129.53 5.35 Favored Pre-proline 0 C--N 1.331 -0.235 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.451 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 52.8 Cg_endo -91.88 117.57 0.45 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 123.23 2.62 . . . . 0.0 111.621 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -135.76 160.03 39.81 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.12 0.486 . . . . 0.0 111.558 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.603 HG12 ' HD3' ' A' ' 34' ' ' LYS . 1.9 mt -102.18 147.24 9.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.186 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.9 mtp180 -75.25 141.51 74.03 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.118 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.476 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 11.5 Cg_endo -55.13 -52.36 8.07 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.584 2.189 . . . . 0.0 112.702 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.549 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -53.46 -58.83 5.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.377 -179.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.527 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 20.2 m-20 -67.09 -30.7 70.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.109 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.59 -56.54 14.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.469 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.549 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.3 p90 -91.39 -16.85 26.74 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.659 -179.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.527 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 0.6 OUTLIER -59.51 -45.16 92.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.794 0.331 . . . . 0.0 110.784 179.668 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -168.11 133.18 1.51 Allowed Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.267 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -67.43 -13.49 39.38 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.57 2.18 . . . . 0.0 112.271 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -98.1 -34.29 10.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.383 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -98.54 26.63 5.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.823 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 40.9 mttt -57.98 -67.18 0.37 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.457 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.1 mmmm 60.06 116.4 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.925 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.603 ' HD3' HG12 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -108.38 143.49 37.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.002 0.429 . . . . 0.0 110.964 179.788 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -95.45 139.01 14.27 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.21 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.452 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 12.8 m-90 -97.68 111.08 23.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.112 0.482 . . . . 0.0 110.495 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.478 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 12.1 t90 -95.7 117.5 30.63 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.551 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.494 ' CD2' ' HG3' ' A' ' 16' ' ' ARG . 1.0 OUTLIER -117.86 144.8 45.08 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.153 179.001 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.487 ' HB3' ' CE1' ' A' ' 41' ' ' PHE . . . -170.32 124.5 0.72 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.122 0.487 . . . . 0.0 111.696 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.496 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 8.8 t-160 -92.64 104.34 16.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.341 178.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.622 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 3.5 m-85 -86.86 153.02 21.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.179 0.514 . . . . 0.0 111.658 -178.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.445 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 28.1 p-10 -123.19 114.06 19.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.073 178.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 59.23 -135.49 51.61 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 119.892 -1.147 . . . . 0.0 111.151 -178.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.416 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 7.6 Cg_exo -72.7 -17.61 25.92 Favored 'Trans proline' 0 N--CA 1.464 -0.227 0 C-N-CA 122.506 2.137 . . . . 0.0 112.469 179.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' TRP . . . . . 0.421 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.7 OUTLIER -116.02 -165.91 1.09 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.514 -178.584 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.622 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 2.4 tt -128.1 151.87 35.47 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-O 121.122 0.487 . . . . 0.0 111.927 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -103.03 -40.78 6.34 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.531 -0.758 . . . . 0.0 111.816 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.483 ' HG3' ' HB3' ' A' ' 40' ' ' HIS . 0.3 OUTLIER -144.85 154.28 42.49 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 120.7 -0.4 . . . . 0.0 111.396 -179.535 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.42 ' HB2' HD12 ' A' ' 46' ' ' ILE . 7.9 tt0 -141.13 141.73 34.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.362 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 5.3 ttm -135.99 111.64 9.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.178 179.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.467 ' HB3' ' HB ' ' A' ' 59' ' ' ILE . 4.5 tt0 -102.82 137.41 41.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.892 0.377 . . . . 0.0 111.523 -179.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.46 ' CD1' ' CE1' ' A' ' 38' ' ' TYR . 3.2 mt -133.79 124.78 27.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.8 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 25.6 m-70 -139.33 134.61 16.61 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.537 -0.302 . . . . 0.0 111.1 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -50.64 -25.71 15.45 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.54 2.16 . . . . 0.0 112.245 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -99.53 -27.37 13.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.006 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -114.47 118.99 40.8 Favored Pre-proline 0 C--O 1.234 0.262 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.826 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -49.7 177.37 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.565 2.177 . . . . 0.0 112.559 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -58.67 85.74 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.699 2.266 . . . . 0.0 112.216 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.467 ' HB ' ' HB3' ' A' ' 51' ' ' GLU . 44.4 mt -71.34 101.28 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.77 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.423 ' HG ' ' CZ3' ' A' ' 97' ' ' TRP . 1.1 mp -78.66 144.66 35.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.096 -179.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.405 HD22 ' CB ' ' A' ' 66' ' ' ASP . 84.5 mt -146.21 151.17 37.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.966 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.5 p -156.48 149.88 10.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.987 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.69 140.47 58.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.209 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.56 -49.46 1.46 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.332 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.08 -63.03 1.36 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.885 0.374 . . . . 0.0 110.727 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.405 ' CB ' HD22 ' A' ' 61' ' ' LEU . 18.6 m-20 -101.24 55.01 0.83 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.8 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.06 -27.26 63.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.971 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 50.0 mtp -84.77 -28.9 25.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.991 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -87.49 -42.08 13.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.09 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.8 ptm -57.25 -166.92 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.074 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 17.0 t -81.52 104.5 11.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.087 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -73.77 -17.96 61.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.935 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -78.84 177.12 8.96 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.018 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -105.37 -173.59 2.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.857 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.444 ' O ' ' OG1' ' A' ' 78' ' ' THR . 0.7 OUTLIER -54.72 -53.08 59.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.744 -179.462 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -71.58 -54.36 10.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.871 0.367 . . . . 0.0 111.787 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.03 -38.2 36.57 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.444 ' OG1' ' O ' ' A' ' 75' ' ' LEU . 2.0 p -48.12 -61.56 1.92 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.777 0.322 . . . . 0.0 111.543 -179.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 125.15 -28.68 5.04 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.703 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.425 ' CD2' ' CD1' ' A' ' 17' ' ' ILE . 1.1 mt -49.05 -45.55 43.07 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.998 0.428 . . . . 0.0 110.737 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.89 -32.26 61.8 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.46 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 5.9 mmm180 -61.74 -32.07 72.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.493 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.3 -174.65 5.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.631 179.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 8.4 mpt_? -102.47 119.48 38.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.946 0.403 . . . . 0.0 111.123 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 60.65 85.25 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.749 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -130.92 19.79 5.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.639 0.257 . . . . 0.0 111.244 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.464 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 30.5 mt-10 -99.83 160.0 14.64 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.959 0.409 . . . . 0.0 111.239 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.445 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 0.8 OUTLIER -138.16 174.51 10.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.042 179.916 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.44 HD11 ' CB ' ' A' ' 91' ' ' ARG . 0.4 OUTLIER -98.06 147.99 33.85 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.545 179.584 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -66.97 -22.98 47.43 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.483 2.122 . . . . 0.0 112.7 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.44 ' CB ' HD11 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -61.02 -54.79 40.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.786 0.327 . . . . 0.0 111.082 -179.767 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.451 ' HG3' ' N ' ' A' ' 93' ' ' PHE . 0.0 OUTLIER -70.51 -34.84 72.78 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.03 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.454 ' CE1' ' HD3' ' A' ' 48' ' ' ARG . 21.8 t80 -62.64 -53.23 57.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.482 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.81 -22.05 63.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.548 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.11 -50.82 71.67 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 179.157 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.431 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 17.5 mm -71.53 -35.93 58.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.259 178.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.423 ' CZ3' ' HG ' ' A' ' 60' ' ' LEU . 18.4 t-105 -53.45 -40.49 65.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.029 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -85.72 -23.93 27.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.816 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.431 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 7.4 mtt-85 -56.85 -54.1 50.28 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.053 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 43.1 t -81.51 -81.32 0.14 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.037 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -173.98 39.64 0.13 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.553 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . 0.416 ' HA2' ' CD2' ' A' ' 60' ' ' LEU . . . -61.33 -55.23 30.36 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.634 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.1 mm -57.18 -42.95 80.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.769 0.318 . . . . 0.0 111.173 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -65.25 -49.28 70.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.681 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -60.57 -40.07 90.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.514 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.38 -45.93 65.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.87 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -61.88 -29.95 70.54 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.988 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 54.6 p -72.55 -50.32 26.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.805 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.93 -35.9 77.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.579 0.704 . . . . 0.0 109.161 178.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.414 ' CD1' HD22 ' A' ' 124' ' ' LEU . 13.6 mt -58.59 -44.3 89.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.912 178.772 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.96 -43.13 83.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.535 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.436 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 5.9 m -72.58 -10.09 59.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.246 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 112' ' ' SER . 16.3 mmt180 75.39 27.28 1.07 Allowed 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.909 0.385 . . . . 0.0 110.987 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -92.31 -28.67 16.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.384 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -82.95 94.66 7.78 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.749 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.8 ptt180 -53.29 118.37 14.1 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.218 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -52.96 88.53 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.519 2.146 . . . . 0.0 112.124 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 5.2 t -110.2 -46.29 3.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.052 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.419 ' CZ ' ' HG2' ' A' ' 12' ' ' GLN . 9.8 t80 -177.36 -54.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.187 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.462 ' O ' ' HG3' ' A' ' 123' ' ' MET . . . -53.82 -40.31 66.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.863 0.363 . . . . 0.0 111.177 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 62.6 p -69.27 -43.74 73.29 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.481 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.57 -58.12 9.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.172 0.511 . . . . 0.0 110.239 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' MET . . . . . 0.462 ' HG3' ' O ' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -55.36 -29.93 59.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.046 179.119 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.436 ' N ' ' HE1' ' A' ' 123' ' ' MET . 0.1 OUTLIER -67.17 -48.94 66.46 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 121.022 0.439 . . . . 0.0 109.852 178.805 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -50.01 -39.62 41.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.796 179.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -80.09 -35.16 37.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.059 178.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.81 -20.29 34.63 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.652 179.046 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 9.6 mt . . . . . 0 C--N 1.332 -0.181 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.141 -179.717 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.784 0.326 . . . . 0.0 111.012 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -93.04 125.25 37.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.986 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.432 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 7.9 mp0 -111.96 102.8 11.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.974 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.512 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 2.9 mtt180 -113.92 126.8 55.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.977 0.418 . . . . 0.0 110.953 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.493 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 2.2 m-85 -109.0 134.99 50.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.884 179.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.512 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 2.6 m-85 -131.25 152.65 50.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.29 0.567 . . . . 0.0 112.335 -178.374 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.486 ' HB3' ' CG2' ' A' ' 88' ' ' ILE . 41.3 ttp85 -149.28 148.06 29.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.92 179.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -152.08 121.73 3.45 Favored Pre-proline 0 C--N 1.329 -0.286 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.646 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -86.15 88.41 0.78 Allowed 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.93 2.42 . . . . 0.0 112.32 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.7 p90 -116.0 139.66 50.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.931 0.396 . . . . 0.0 111.02 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.423 HG12 ' HD2' ' A' ' 34' ' ' LYS . 13.2 mt -86.85 142.58 12.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.927 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.8 110.22 2.35 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.118 179.369 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.499 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 76.4 Cg_exo -39.76 -51.84 2.83 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.795 2.33 . . . . 0.0 112.863 -179.393 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.534 ' O ' ' HG2' ' A' ' 27' ' ' LYS . . . -50.07 -58.76 4.83 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.871 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.517 ' HA ' ' HG2' ' A' ' 27' ' ' LYS . 6.1 m-20 -67.07 -33.05 74.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.24 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.07 -43.55 63.89 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.736 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.528 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.7 p90 -104.59 -34.93 8.02 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -178.031 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.534 ' HG2' ' O ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -61.84 -32.31 72.63 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.664 -0.415 . . . . 0.0 111.601 -178.774 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -150.2 120.32 3.83 Favored Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 120.844 -0.343 . . . . 0.0 111.523 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -72.67 -7.84 21.47 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.539 2.159 . . . . 0.0 112.321 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -109.81 -32.41 7.08 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.937 0.399 . . . . 0.0 110.394 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -97.72 28.18 3.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.658 179.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.5 mttt -59.83 -59.05 6.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.918 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.8 mmtt 70.54 113.78 0.05 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.599 -179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.423 ' HD2' HG12 ' A' ' 20' ' ' ILE . 0.3 OUTLIER -83.01 110.86 18.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.489 -179.938 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.432 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -91.34 117.59 5.22 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.833 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 10.1 m-90 -97.84 126.24 43.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.853 0.359 . . . . 0.0 110.431 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 11.2 t90 -113.65 119.87 38.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.614 -179.192 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.48 ' CE2' ' CD ' ' A' ' 16' ' ' ARG . 4.1 m-85 -115.96 150.46 37.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.941 178.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.518 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . . . -170.45 123.75 0.68 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.161 0.505 . . . . 0.0 111.61 179.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.493 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 18.0 t-160 -93.17 98.28 11.19 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.451 178.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.65 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 20.4 m-85 -85.93 127.31 34.58 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.426 -179.146 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.562 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 25.0 p-10 -93.7 110.99 22.59 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 178.53 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 58.93 -134.53 52.44 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.053 -1.07 . . . . 0.0 111.122 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.402 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 8.8 Cg_exo -71.66 -19.64 27.62 Favored 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 122.489 2.126 . . . . 0.0 112.204 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' TRP . . . . . 0.423 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.6 OUTLIER -112.82 -170.11 1.61 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.274 -178.851 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.65 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 3.2 tt -127.35 151.69 34.49 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-O 121.263 0.554 . . . . 0.0 112.114 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -111.6 -32.64 6.61 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.917 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.47 ' CZ ' ' CE2' ' A' ' 93' ' ' PHE . 4.2 ptm180 -157.19 154.97 30.11 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.46 -179.678 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.518 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -161.55 159.02 27.26 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.242 179.801 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 11.3 ttp -134.46 154.84 51.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.852 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.453 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.2 OUTLIER -129.49 117.67 20.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.897 179.694 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.3 mt -120.35 106.18 11.62 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.876 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.432 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 6.8 m170 -127.54 134.12 25.84 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.698 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -51.94 -23.44 16.58 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.342 2.028 . . . . 0.0 112.262 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -100.34 -26.95 13.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.113 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.408 ' HB2' ' HB2' ' A' ' 53' ' ' HIS . 7.9 mttt -117.84 126.02 27.61 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.977 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -54.9 173.46 0.27 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.767 2.312 . . . . 0.0 112.463 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -60.25 88.02 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.714 2.276 . . . . 0.0 112.383 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.453 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 75.0 mt -70.4 100.57 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.799 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.425 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.3 OUTLIER -77.97 123.99 27.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.693 -179.966 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.439 HD12 ' CB ' ' A' ' 69' ' ' GLU . 2.8 mm? -121.02 139.55 53.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.25 -179.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.2 p -149.14 139.26 16.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.951 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.16 155.95 13.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.988 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.76 -63.49 4.25 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.112 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.19 -67.93 0.6 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.997 0.427 . . . . 0.0 110.483 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.403 ' HB3' ' CD1' ' A' ' 61' ' ' LEU . 5.6 m-20 -97.11 47.16 1.04 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.404 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.447 ' HA ' ' HG2' ' A' ' 70' ' ' MET . 1.4 t0 -63.31 -25.35 68.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.438 -179.601 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -85.56 -35.73 20.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.753 0.311 . . . . 0.0 111.151 -179.696 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.439 ' CB ' HD12 ' A' ' 61' ' ' LEU . 1.1 mp0 -80.18 -36.22 35.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.256 -179.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.447 ' HG2' ' HA ' ' A' ' 67' ' ' ASP . 0.7 OUTLIER -56.0 -169.36 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.876 0.37 . . . . 0.0 111.146 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 3.5 m -68.19 -44.38 76.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.571 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 69.23 -64.65 0.33 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.101 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 11.0 mptt -54.3 178.91 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.113 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -94.67 -168.69 1.88 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.604 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.45 HD23 ' CE1' ' A' ' 15' ' ' PHE . 7.8 mt -71.99 -53.38 13.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.386 -179.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -31.69 70.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.219 -179.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -80.5 -36.37 33.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.327 -179.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -61.54 -80.06 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.051 -179.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 147.53 -16.43 1.45 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.507 -0.854 . . . . 0.0 113.038 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.3 mt -53.89 -35.24 61.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.905 0.383 . . . . 0.0 110.915 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 22.6 p -81.81 -39.92 23.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.594 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.5 mmm180 -63.97 -30.54 71.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.545 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -165.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.728 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -102.23 83.48 2.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.778 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.15 71.26 0.78 Allowed Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.336 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.431 ' O ' ' HA ' ' A' ' 15' ' ' PHE . . . -98.17 34.42 1.96 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.666 0.269 . . . . 0.0 110.978 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -90.9 147.81 22.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.224 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.486 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 1.3 pt -139.09 179.46 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.057 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -106.33 149.9 38.81 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.648 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -61.98 -30.7 83.67 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.506 2.137 . . . . 0.0 112.215 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.51 -54.0 50.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.351 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -64.02 -53.84 43.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.418 -179.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.47 ' CE2' ' CZ ' ' A' ' 48' ' ' ARG . 6.2 t80 -52.65 -53.23 50.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.189 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.402 ' OE2' ' NH1' ' A' ' 48' ' ' ARG . 1.2 tt0 -66.58 -22.75 66.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.39 179.562 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.09 -50.36 73.56 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.161 0.505 . . . . 0.0 109.756 179.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 17.0 mm -71.48 -34.5 53.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.662 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.45 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 25.5 t-105 -54.33 -38.14 65.67 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.031 179.27 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -85.55 -27.85 25.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.659 179.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.3 mtp85 -56.82 -50.65 71.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.13 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 76.6 m -84.97 -80.79 0.2 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.153 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -178.99 37.55 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.614 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . 0.45 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -59.66 -59.59 10.27 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.492 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.402 HG22 ' CD2' ' A' ' 124' ' ' LEU . 3.8 mp -52.8 -30.39 15.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.808 0.337 . . . . 0.0 111.477 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.83 -45.34 74.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.003 0.43 . . . . 0.0 110.578 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -68.23 -39.44 82.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.42 179.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.45 ' HB3' ' CD2' ' A' ' 124' ' ' LEU . 0.4 OUTLIER -69.68 -50.97 38.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.03 -179.852 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -29.59 69.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.87 0.366 . . . . 0.0 110.789 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 6.1 m -69.01 -50.12 51.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.653 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.64 -32.73 68.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.507 0.67 . . . . 0.0 109.854 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.478 ' CG1' HG23 ' A' ' 121' ' ' THR . 9.3 mt -58.97 -48.48 86.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 114.869 -1.059 . . . . 0.0 110.584 179.428 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -70.57 -35.78 73.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.578 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.5 -15.39 62.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.055 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 9.5 mmm180 74.97 35.27 0.62 Allowed 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.876 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -108.67 -27.35 9.87 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.792 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.14 -172.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.149 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 3.2 ttt180 -129.66 93.7 34.11 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.906 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -50.41 89.47 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.532 2.155 . . . . 0.0 112.323 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 6.5 p -129.07 -51.97 1.21 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.878 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.432 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 13.4 t80 -165.56 -55.49 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.265 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.428 ' O ' ' HG3' ' A' ' 123' ' ' MET . . . -53.96 -42.61 69.1 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.273 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.478 HG23 ' CG1' ' A' ' 110' ' ' ILE . 10.2 p -66.6 -38.74 87.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.686 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -67.73 -58.41 4.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.145 0.498 . . . . 0.0 110.688 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' MET . . . . . 0.436 ' HE3' ' N ' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -53.04 -29.6 30.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.414 179.521 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.45 ' CD2' ' HB3' ' A' ' 106' ' ' LEU . 0.4 OUTLIER -66.39 -52.74 43.62 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.02 0.438 . . . . 0.0 109.944 178.961 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -49.87 -37.04 29.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.012 179.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -80.99 -34.19 33.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.227 179.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.06 -18.85 60.08 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.398 179.082 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.9 mt . . . . . 0 C--N 1.332 -0.158 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.88 179.974 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.527 0.093 0 CA-C-O 120.732 0.301 . . . . 0.0 110.93 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -82.42 158.14 23.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.015 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.43 ' HG2' ' CZ ' ' A' ' 119' ' ' TYR . 8.2 mp0 -122.02 103.45 8.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.907 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.49 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -110.79 130.0 55.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.948 0.404 . . . . 0.0 110.893 179.829 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.518 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 0.9 OUTLIER -115.27 135.15 54.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.307 -179.946 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.544 ' HA ' ' HA ' ' A' ' 87' ' ' GLU . 0.3 OUTLIER -140.4 153.57 46.38 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.365 0.602 . . . . 0.0 112.219 -179.713 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.481 ' HB3' ' CG2' ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.58 143.0 25.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.393 179.112 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.425 HD11 HD11 ' A' ' 80' ' ' LEU . 0.3 OUTLIER -141.05 135.63 15.42 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 120.857 0.36 . . . . 0.0 111.919 -179.376 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.488 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 61.7 Cg_endo -92.07 103.28 0.21 Allowed 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 123.301 2.667 . . . . 0.0 112.296 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 15.1 p90 -123.31 148.79 45.6 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.937 0.398 . . . . 0.0 110.934 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 3.8 mt -94.3 149.25 4.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.016 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -71.86 131.13 86.01 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.678 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.524 ' CA ' ' HG3' ' A' ' 25' ' ' GLN . 77.6 Cg_exo -40.21 -60.16 0.62 Allowed 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.974 2.449 . . . . 0.0 113.138 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.608 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -45.85 -53.8 9.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.866 -179.596 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.432 ' HB3' ' HA ' ' A' ' 32' ' ' LYS . 4.3 m-20 -62.96 -34.49 77.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.257 -178.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.524 ' HG3' ' CA ' ' A' ' 22' ' ' PRO . 1.1 mt-30 -58.12 -57.49 12.59 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.703 0.287 . . . . 0.0 111.631 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.608 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.6 p90 -84.71 -7.5 59.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.641 -179.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.0 mtpp -74.1 -42.93 59.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.843 0.354 . . . . 0.0 110.56 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -173.07 139.0 0.85 Allowed Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.037 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.81 -21.54 33.11 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.6 2.2 . . . . 0.0 112.366 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -97.97 -31.72 12.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.715 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -100.25 42.63 1.1 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.778 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.432 ' HA ' ' HB3' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -102.26 60.44 0.84 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.508 179.703 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.402 ' HB3' ' HG2' ' A' ' 54' ' ' PRO . 13.9 mmtp -36.92 115.82 0.4 Allowed 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.679 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -85.22 134.04 34.16 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.207 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.417 ' HA2' ' HD3' ' A' ' 54' ' ' PRO . . . -120.93 138.58 12.76 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.648 -0.786 . . . . 0.0 112.531 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.488 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 29.3 m-90 -97.91 148.05 23.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.905 0.383 . . . . 0.0 110.82 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.413 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 86.4 t90 -130.93 117.36 19.14 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.909 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.452 ' CE2' ' HD2' ' A' ' 16' ' ' ARG . 2.2 m-85 -112.67 152.81 28.56 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.847 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.45 ' HB2' ' CE1' ' A' ' 41' ' ' PHE . . . -170.77 124.74 0.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.302 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.518 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 12.1 t-160 -93.92 101.74 13.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.151 179.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.574 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 11.0 m-85 -85.86 126.19 33.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.513 -179.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.461 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 4.2 m-20 -100.09 116.92 33.24 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 178.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 59.63 -140.09 48.18 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 119.986 -1.102 . . . . 0.0 111.014 -178.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -72.1 -12.68 28.25 Favored 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.489 2.126 . . . . 0.0 112.208 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' TRP . . . . . . . . . . . . . 1.2 m95 -118.22 -168.25 1.49 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.936 0.398 . . . . 0.0 111.95 -178.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.574 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 4.3 tt -134.73 156.12 39.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.576 -179.429 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.404 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -132.45 -28.32 1.67 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.123 -179.472 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.455 ' CB ' ' HB3' ' A' ' 40' ' ' HIS . 6.5 ttm180 -115.57 133.53 55.94 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.828 0.347 . . . . 0.0 111.107 -179.559 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.423 ' HB3' ' HB3' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -137.63 134.14 35.15 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.853 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 3.1 ttm -141.16 111.77 6.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.724 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.76 135.76 38.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.997 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.432 HD11 ' CE1' ' A' ' 38' ' ' TYR . 38.3 mt -131.13 102.14 5.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.744 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -121.66 138.4 28.4 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.918 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.417 ' HD3' ' HA2' ' A' ' 35' ' ' GLY . 50.3 Cg_exo -54.44 -29.4 58.87 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.45 2.1 . . . . 0.0 112.388 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 37.2 p30 -95.75 -20.71 18.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.193 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.8 mttt -124.2 115.16 27.5 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.834 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -47.17 173.34 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.512 2.141 . . . . 0.0 112.451 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -54.53 88.5 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.489 2.126 . . . . 0.0 112.356 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 5.4 mt -65.77 104.6 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.906 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.61 ' HG ' ' HA2' ' A' ' 102' ' ' GLY . 0.0 OUTLIER -76.43 133.22 39.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.804 -179.995 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.423 ' HB3' ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -141.32 154.43 45.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.087 -179.928 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.5 p -157.63 144.09 9.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.826 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.433 ' N ' ' CE ' ' A' ' 70' ' ' MET . . . -55.68 151.63 10.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.855 0.359 . . . . 0.0 111.198 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.08 -63.3 4.46 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.217 -179.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.95 -31.54 63.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.939 0.399 . . . . 0.0 110.573 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.414 ' CB ' ' HG ' ' A' ' 61' ' ' LEU . 9.3 m-20 -119.56 56.72 0.93 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.664 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.05 -32.22 73.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.071 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.57 -34.33 21.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.274 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.421 ' HB3' ' CD2' ' A' ' 61' ' ' LEU . 11.9 mp0 -81.15 -51.65 8.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.123 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.433 ' CE ' ' N ' ' A' ' 63' ' ' ALA . 28.0 tpp -38.36 152.1 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.415 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 0.42 ' O ' ' CB ' ' A' ' 72' ' ' GLU . 0.5 OUTLIER -42.04 -60.15 1.52 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.221 179.97 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.42 ' CB ' ' O ' ' A' ' 71' ' ' CYS . 0.0 OUTLIER 83.51 -21.79 0.26 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.934 179.647 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -94.74 122.48 37.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.644 0.259 . . . . 0.0 110.834 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.411 ' N ' ' CG ' ' A' ' 77' ' ' GLU . 7.2 m120 -50.83 176.09 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.886 0.374 . . . . 0.0 111.053 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.425 HD21 ' CD2' ' A' ' 41' ' ' PHE . 0.6 OUTLIER -50.65 -46.71 58.52 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.2 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.92 -56.31 12.4 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.537 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.411 ' CG ' ' N ' ' A' ' 74' ' ' ASN . 1.1 pm0 -61.45 -18.08 57.34 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.458 ' HB ' HD21 ' A' ' 80' ' ' LEU . 0.3 OUTLIER -74.81 -63.62 1.21 Allowed 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.917 179.843 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 122.83 -12.85 8.67 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.586 -0.816 . . . . 0.0 113.101 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.471 HD12 ' HB3' ' A' ' 15' ' ' PHE . 3.4 mm? -54.13 -36.67 63.51 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.267 0.556 . . . . 0.0 110.387 179.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 45.9 p -83.94 -21.51 31.8 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.912 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 7.7 mtt180 -84.52 -11.89 55.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.592 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.464 ' HB3' ' HB1' ' A' ' 86' ' ' ALA . 0.3 OUTLIER -93.34 24.7 3.75 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.958 0.409 . . . . 0.0 111.34 -179.849 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.5 mmt85 37.73 93.94 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 77.64 46.53 9.66 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.764 -0.732 . . . . 0.0 113.585 178.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.464 ' HB1' ' HB3' ' A' ' 83' ' ' LYS . . . -101.82 16.6 25.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.79 0.295 . . . . 0.0 111.011 179.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.544 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -89.27 167.08 13.36 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.898 0.38 . . . . 0.0 111.353 -179.673 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.481 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 0.9 OUTLIER -143.45 -179.95 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.999 179.843 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.76 155.77 36.01 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.743 179.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.29 -22.87 24.85 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.499 2.132 . . . . 0.0 112.404 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.91 -54.04 51.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.116 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -66.4 -38.28 87.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.903 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.43 ' CE1' ' HD2' ' A' ' 48' ' ' ARG . 15.3 t80 -58.28 -53.15 61.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.919 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.411 ' OE1' ' NH1' ' A' ' 48' ' ' ARG . 0.2 OUTLIER -70.13 -23.56 63.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.782 179.852 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.27 -50.95 72.03 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 179.04 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 20.5 mm -74.8 -30.79 24.89 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.954 178.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.426 ' CD1' ' HA3' ' A' ' 102' ' ' GLY . 24.2 t-105 -57.6 -36.4 71.7 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.737 178.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -85.41 -29.4 24.42 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.289 179.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 7.7 mtm180 -56.66 -52.97 62.87 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.108 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 42.6 t -83.5 -82.02 0.16 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.3 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -177.02 37.47 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.525 -0.845 . . . . 0.0 112.791 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . 0.61 ' HA2' ' HG ' ' A' ' 60' ' ' LEU . . . -56.08 -64.39 4.43 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.416 179.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.406 ' CG2' ' CD2' ' A' ' 128' ' ' LEU . 3.7 mp -52.94 -33.54 19.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.974 0.416 . . . . 0.0 111.181 179.682 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -68.17 -45.42 73.53 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.514 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -68.03 -41.69 81.75 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.424 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.409 ' HB3' ' CD2' ' A' ' 124' ' ' LEU . 0.3 OUTLIER -66.91 -51.13 59.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.83 179.86 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.411 ' HA ' ' HB ' ' A' ' 110' ' ' ILE . 0.0 OUTLIER -60.39 -29.23 68.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.846 179.919 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' SER . . . . . 0.41 ' N ' ' HG3' ' A' ' 107' ' ' GLN . 12.3 t -68.23 -50.69 52.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.735 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.99 -33.94 70.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.5 0.667 . . . . 0.0 109.35 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.42 ' CD1' HD21 ' A' ' 124' ' ' LEU . 10.3 mt -56.61 -46.11 82.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.009 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -68.63 -37.7 79.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.147 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' SER . . . . . 0.446 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 5.2 t -72.27 -10.51 59.88 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.9 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 112' ' ' SER . 3.6 mpp_? 69.65 32.51 3.29 Favored 'General case' 0 C--O 1.23 0.079 0 CA-C-O 121.015 0.436 . . . . 0.0 111.097 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.5 mt-30 -106.3 -25.92 11.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.398 179.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -75.99 90.57 3.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.078 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 12.2 mtt180 -48.86 105.57 0.52 Allowed Pre-proline 0 C--N 1.331 -0.198 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.833 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . 0.423 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 50.0 Cg_exo -53.44 98.84 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.392 2.061 . . . . 0.0 112.566 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 79.5 m -112.63 -43.86 3.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.609 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.43 ' CZ ' ' HG2' ' A' ' 12' ' ' GLN . 14.8 t80 -178.23 -47.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.951 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.454 ' O ' ' HG3' ' A' ' 123' ' ' MET . . . -56.31 -39.21 72.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.265 -179.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.423 ' OG1' ' HA ' ' A' ' 117' ' ' PRO . 37.7 p -68.98 -37.26 78.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.506 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.96 -58.35 8.93 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.214 0.53 . . . . 0.0 110.332 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' MET . . . . . 0.473 ' HE2' ' N ' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -58.17 -29.4 65.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.167 178.934 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.473 ' N ' ' HE2' ' A' ' 123' ' ' MET . 0.3 OUTLIER -70.28 -46.93 63.35 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.145 0.498 . . . . 0.0 109.875 178.982 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 17.8 mm-40 -50.73 -40.98 55.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.652 -0.703 . . . . 0.0 109.807 179.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 28.4 m-20 -76.1 -34.35 59.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.857 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.14 -20.0 56.36 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.374 178.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.406 ' CD2' ' CG2' ' A' ' 103' ' ' ILE . 1.0 OUTLIER . . . . . 0 C--O 1.233 0.204 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.938 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.873 0.368 . . . . 0.0 110.997 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -81.59 137.28 35.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.995 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.436 ' HG3' ' CE2' ' A' ' 119' ' ' TYR . 33.7 mm-40 -100.72 102.74 13.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.751 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.568 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -110.27 124.75 52.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.031 -179.45 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.502 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 1.1 m-85 -110.77 152.91 26.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.473 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.568 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 4.4 m-85 -152.2 152.73 32.61 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.367 0.603 . . . . 0.0 112.178 -179.559 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.458 ' HG3' ' CE2' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -148.96 139.43 22.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.394 179.217 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -142.25 125.72 9.6 Favored Pre-proline 0 C--N 1.329 -0.295 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.731 -179.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.498 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 67.9 Cg_endo -89.86 101.71 0.32 Allowed 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 123.065 2.51 . . . . 0.0 112.155 179.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.1 p90 -120.02 145.42 46.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.856 0.36 . . . . 0.0 110.912 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.46 HG12 ' HG3' ' A' ' 34' ' ' LYS . 3.0 mt -89.63 150.34 3.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.925 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -72.15 126.65 91.1 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.719 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.543 ' CA ' ' HG3' ' A' ' 25' ' ' GLN . 70.3 Cg_exo -39.83 -60.33 0.57 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.043 2.495 . . . . 0.0 113.097 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.641 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -44.87 -52.71 8.33 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.837 -179.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.487 ' HB3' ' HA ' ' A' ' 32' ' ' LYS . 2.1 m-20 -65.62 -37.06 85.52 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.508 -178.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.543 ' HG3' ' CA ' ' A' ' 22' ' ' PRO . 1.0 OUTLIER -54.91 -57.53 11.27 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -178.866 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.641 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.0 p90 -83.75 -16.75 43.6 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.706 -179.22 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.405 ' CD ' ' O ' ' A' ' 23' ' ' ALA . 1.0 OUTLIER -60.98 -47.1 88.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.755 0.312 . . . . 0.0 110.286 179.564 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 177.08 141.28 0.24 Allowed Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.124 179.378 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.42 -19.01 66.08 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.621 2.214 . . . . 0.0 112.289 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -86.34 -39.43 16.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.589 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -105.87 57.83 0.66 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.69 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.487 ' HA ' ' HB3' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -111.7 54.76 0.68 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.607 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -41.58 138.46 1.35 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.549 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.46 ' HG3' HG12 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -107.93 144.03 35.75 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.046 0.451 . . . . 0.0 111.862 -179.42 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -121.28 129.44 7.76 Favored Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.807 179.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.498 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 28.9 m-90 -98.08 133.99 41.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.013 0.435 . . . . 0.0 111.146 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 15.6 t90 -113.48 117.27 31.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.965 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.458 ' CE2' ' HG3' ' A' ' 16' ' ' ARG . 10.9 m-85 -110.38 147.57 33.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.219 179.534 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.405 ' CB ' ' NE2' ' A' ' 49' ' ' GLN . . . -170.13 124.71 0.75 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.059 0.457 . . . . 0.0 111.992 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.502 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 12.7 t-160 -97.68 98.04 9.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.375 178.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.605 ' CG ' ' HB ' ' A' ' 46' ' ' ILE . 11.8 m-85 -85.32 119.34 25.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.715 -178.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.448 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 3.3 p-10 -91.21 114.8 27.43 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 178.451 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 57.69 -135.95 51.23 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 119.908 -1.139 . . . . 0.0 111.153 -178.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.41 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 7.9 Cg_exo -72.62 -17.31 26.44 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 122.536 2.158 . . . . 0.0 112.444 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' TRP . . . . . 0.41 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 0.7 OUTLIER -115.36 -172.67 2.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.946 0.403 . . . . 0.0 111.8 -178.595 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.605 ' HB ' ' CG ' ' A' ' 41' ' ' PHE . 2.8 tt -131.98 153.67 38.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.726 -179.567 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.409 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -127.24 -26.77 3.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.646 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.487 ' CB ' ' HB3' ' A' ' 40' ' ' HIS . 2.1 ttp180 -117.5 136.77 53.0 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-O 120.817 0.341 . . . . 0.0 111.295 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.405 ' NE2' ' CB ' ' A' ' 39' ' ' ALA . 0.7 OUTLIER -145.12 132.48 20.65 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.887 179.967 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 2.5 ttm -143.48 129.45 19.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.677 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.469 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -114.11 140.71 48.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.165 -179.61 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.419 HD11 ' CE1' ' A' ' 38' ' ' TYR . 31.1 mt -135.29 108.53 7.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.811 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 -135.85 138.2 27.29 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.858 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -52.8 -23.88 22.03 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.602 2.201 . . . . 0.0 112.254 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -96.18 -28.71 14.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.999 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 1.8 mtpp -118.3 122.14 30.51 Favored Pre-proline 0 C--O 1.233 0.229 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.844 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.36 -179.99 0.07 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.582 2.188 . . . . 0.0 112.237 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -56.75 85.08 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.545 2.163 . . . . 0.0 112.332 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.469 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 91.1 mt -65.42 98.06 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.8 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.421 HD11 ' CZ3' ' A' ' 97' ' ' TRP . 0.4 OUTLIER -82.2 112.83 19.58 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.703 -179.975 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.403 ' CD1' ' HB3' ' A' ' 69' ' ' GLU . 71.9 mt -123.6 148.24 46.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.071 0.462 . . . . 0.0 111.324 -179.64 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.4 p -149.43 150.66 13.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.787 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.38 145.81 36.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.846 0.355 . . . . 0.0 111.305 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.92 -61.41 4.05 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.159 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -72.23 -68.38 0.47 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.896 0.379 . . . . 0.0 110.603 179.735 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -98.91 36.56 1.66 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.607 179.753 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.5 -21.28 36.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.284 -179.746 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 3.6 mpp? -82.13 -31.92 30.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.848 0.356 . . . . 0.0 110.659 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.403 ' HB3' ' CD1' ' A' ' 61' ' ' LEU . 1.9 mm-40 -84.69 -43.91 13.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.718 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 47.5 ttm -55.55 163.47 1.29 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.608 179.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -55.72 120.53 7.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.819 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -88.15 8.14 28.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.384 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.4 144.71 44.69 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.901 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -65.59 -176.63 0.36 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.666 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.454 ' CD1' ' CE1' ' A' ' 15' ' ' PHE . 28.1 tp -64.98 -43.83 91.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.407 -179.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.46 -31.87 69.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.066 -179.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -86.95 -26.03 24.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.666 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.433 HG21 ' CE2' ' A' ' 41' ' ' PHE . 0.7 OUTLIER -58.84 -76.44 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.771 0.32 . . . . 0.0 111.101 -179.762 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 140.27 -22.32 2.75 Favored Glycine 0 N--CA 1.453 -0.18 0 C-N-CA 120.51 -0.853 . . . . 0.0 113.005 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -49.01 -42.8 39.26 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.89 0.376 . . . . 0.0 110.914 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 45.7 p -71.75 -34.5 69.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.714 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -59.1 -33.47 70.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.6 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.96 179.69 0.5 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.915 179.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.9 mpp_? -93.91 73.34 4.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.572 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 78.63 66.62 1.7 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.232 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -93.31 24.94 3.59 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.689 0.281 . . . . 0.0 111.524 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.409 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 47.1 mt-10 -80.61 167.81 19.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.793 0.33 . . . . 0.0 110.889 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.472 ' CG1' ' N ' ' A' ' 89' ' ' LEU . 2.4 tt -148.41 159.65 6.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.106 0.479 . . . . 0.0 110.86 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.472 ' N ' ' CG1' ' A' ' 88' ' ' ILE . 5.1 mp -78.54 145.15 66.86 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.877 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.76 -23.75 25.86 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.604 2.202 . . . . 0.0 112.441 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.15 -40.47 74.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.045 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -69.0 -45.88 69.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.911 0.386 . . . . 0.0 110.844 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.42 ' CE2' ' HB3' ' A' ' 38' ' ' TYR . 7.6 t80 -56.09 -53.13 60.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.609 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.411 ' OE2' ' NH1' ' A' ' 48' ' ' ARG . 0.0 OUTLIER -68.2 -23.34 64.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.675 179.689 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.21 -50.2 74.59 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 121.246 0.546 . . . . 0.0 109.55 179.086 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 17.5 mm -74.41 -35.26 38.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.384 179.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.424 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 9.7 t-105 -53.12 -40.14 63.97 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.953 179.246 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -85.69 -26.97 25.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.748 179.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.84 -45.75 82.18 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.131 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 40.6 t -91.24 -79.22 0.37 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.039 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 179.18 36.95 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.686 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . 0.424 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -59.9 -57.81 17.43 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.344 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 3.7 mp -53.03 -34.9 21.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.797 0.332 . . . . 0.0 111.233 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.04 -43.36 82.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.022 0.439 . . . . 0.0 110.29 179.492 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -67.97 -38.89 83.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.493 179.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.401 ' HB3' ' CD2' ' A' ' 124' ' ' LEU . 0.4 OUTLIER -70.63 -50.85 32.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.856 179.96 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.414 ' HG3' ' N ' ' A' ' 108' ' ' SER . 0.0 OUTLIER -59.97 -29.48 68.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.811 -179.941 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' SER . . . . . 0.414 ' N ' ' HG3' ' A' ' 107' ' ' GLN . 37.1 p -69.86 -50.49 42.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.554 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.54 -30.24 65.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.534 0.683 . . . . 0.0 109.516 178.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.433 ' CD1' HD21 ' A' ' 124' ' ' LEU . 15.9 mt -61.21 -49.33 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.229 179.075 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -66.07 -37.96 87.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.43 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 63.8 m -82.17 -4.94 58.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.959 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? 63.91 64.05 0.79 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.071 0.462 . . . . 0.0 111.07 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -151.59 25.09 0.68 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.52 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -104.89 -9.87 17.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.506 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 65.13 86.33 0.14 Allowed Pre-proline 0 C--N 1.332 -0.167 0 CA-C-O 120.799 0.333 . . . . 0.0 110.919 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -50.35 99.53 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.568 2.178 . . . . 0.0 112.164 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.41 -45.22 1.22 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.957 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.436 ' CE2' ' HG3' ' A' ' 12' ' ' GLN . 16.3 t80 -177.66 -52.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.952 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.471 ' O ' ' HB2' ' A' ' 124' ' ' LEU . . . -53.94 -39.51 65.96 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.243 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.41 HG23 ' CG1' ' A' ' 110' ' ' ILE . 40.2 p -67.05 -40.89 87.24 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.857 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -66.33 -57.87 6.55 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.096 0.474 . . . . 0.0 110.684 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' MET . . . . . 0.443 ' HE2' ' N ' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -53.1 -29.65 31.84 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.209 179.455 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.471 ' HB2' ' O ' ' A' ' 120' ' ' ALA . 0.3 OUTLIER -69.66 -48.69 58.92 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 121.129 0.49 . . . . 0.0 110.03 178.821 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 36.5 mm-40 -50.32 -36.27 31.23 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.065 179.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -83.21 -32.67 26.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.975 178.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.69 -17.56 60.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.453 179.138 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 12.1 mt . . . . . 0 C--N 1.333 -0.139 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.226 -179.851 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.781 0.324 . . . . 0.0 110.895 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.1 mm100 -80.64 154.38 27.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.077 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.432 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 9.3 mp0 -113.48 107.61 16.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.789 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.505 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -108.15 127.62 53.98 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.902 0.382 . . . . 0.0 111.039 -179.642 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.507 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 1.4 m-85 -114.09 151.14 32.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.389 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.505 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 9.0 m-85 -150.24 157.72 43.39 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.185 0.517 . . . . 0.0 112.062 -179.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.433 ' HG3' ' CD2' ' A' ' 38' ' ' TYR . 34.3 ttp180 -149.21 149.66 31.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.835 179.28 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -151.47 115.77 3.1 Favored Pre-proline 0 C--N 1.33 -0.272 0 C-N-CA 121.066 -0.254 . . . . 0.0 111.284 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.414 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 89.8 Cg_endo -82.85 85.24 1.62 Allowed 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.725 2.284 . . . . 0.0 112.301 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.426 ' CE2' ' HB2' ' A' ' 37' ' ' TRP . 9.0 p90 -103.91 140.47 37.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.998 0.427 . . . . 0.0 110.729 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.4 mt -91.47 141.5 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.2 -179.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' A' ' 25' ' ' GLN . 0.1 OUTLIER -58.7 135.91 86.52 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.586 179.842 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.477 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 51.4 Cg_exo -54.52 -55.68 3.12 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.388 2.059 . . . . 0.0 112.949 -179.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.541 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -51.13 -54.96 20.37 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.71 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.51 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 40.7 m-20 -70.88 -31.04 67.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.158 -179.727 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.412 ' N ' ' O ' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -52.33 -57.11 10.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.65 -179.474 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.541 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.3 p90 -88.55 -19.14 26.75 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.594 -179.397 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.51 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 1.7 mtpp -56.04 -54.98 38.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.915 0.388 . . . . 0.0 110.801 179.744 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.8 p30 -167.27 144.79 3.92 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.327 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -73.35 -4.42 15.39 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.709 2.272 . . . . 0.0 112.764 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -98.3 -40.58 8.26 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.856 0.36 . . . . 0.0 110.928 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -109.07 34.3 3.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.803 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -33.22 75.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.08 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 59.68 108.33 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.78 -179.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.82 112.93 23.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.565 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.425 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -92.67 122.02 6.73 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.621 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.414 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 15.5 m-90 -98.62 121.0 40.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.871 0.367 . . . . 0.0 110.677 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.426 ' HB2' ' CE2' ' A' ' 19' ' ' PHE . 21.9 t90 -108.44 117.5 34.32 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.326 -179.429 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.436 ' CE1' ' CD1' ' A' ' 52' ' ' LEU . 14.2 m-85 -110.98 153.3 25.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.259 179.422 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.441 ' HB1' ' CE1' ' A' ' 41' ' ' PHE . . . -165.79 124.07 1.56 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.131 0.491 . . . . 0.0 111.681 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.507 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 11.7 t-160 -97.65 94.71 7.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.671 179.086 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.54 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 13.6 m-85 -78.03 149.19 34.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.472 -179.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.453 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 88.0 m-20 -122.64 110.83 16.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.14 178.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.47 -132.58 50.04 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.051 -1.071 . . . . 0.0 111.152 -178.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.423 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 5.7 Cg_exo -73.64 -18.19 22.62 Favored 'Trans proline' 0 N--CA 1.464 -0.261 0 C-N-CA 122.557 2.171 . . . . 0.0 112.505 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' TRP . . . . . 0.429 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.5 OUTLIER -117.51 -164.76 1.02 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.87 0.366 . . . . 0.0 111.769 -178.492 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.54 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 3.3 tt -136.66 152.98 29.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.183 -179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -125.28 -18.9 5.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.071 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.422 ' HB2' ' HB3' ' A' ' 40' ' ' HIS . 8.5 mtt180 -132.79 136.63 46.41 Favored 'General case' 0 N--CA 1.458 -0.07 0 CA-C-O 120.854 0.359 . . . . 0.0 111.406 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.43 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 0.8 OUTLIER -146.74 118.73 8.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.827 179.824 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 16.1 ttp -112.83 118.05 33.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.714 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -101.52 118.39 36.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.381 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.436 ' CD1' ' CE1' ' A' ' 38' ' ' TYR . 13.8 mt -119.27 116.53 26.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.627 179.697 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.425 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 7.9 m-70 -129.94 130.94 23.2 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.63 0.253 . . . . 0.0 111.004 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_exo -51.65 -24.62 17.98 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.399 2.066 . . . . 0.0 112.391 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.6 p-10 -104.15 -22.94 13.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.205 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.418 ' HB2' ' HB2' ' A' ' 53' ' ' HIS . 0.3 OUTLIER -119.66 127.87 26.19 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.63 -0.259 . . . . 0.0 110.946 179.828 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo -49.71 171.65 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.664 2.243 . . . . 0.0 112.451 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -62.68 77.61 0.11 Allowed 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.605 2.203 . . . . 0.0 112.354 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 6.7 mt -56.92 100.37 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 121.088 0.471 . . . . 0.0 110.765 179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.445 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.4 OUTLIER -76.43 131.84 39.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.062 -179.694 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.441 ' CD1' ' HB3' ' A' ' 66' ' ' ASP . 0.3 OUTLIER -132.19 146.66 52.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.72 179.93 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.6 p -150.75 137.16 12.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.224 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.04 167.68 2.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.273 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.25 -66.52 0.72 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.521 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.1 -66.49 0.59 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.925 0.393 . . . . 0.0 110.949 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.441 ' HB3' ' CD1' ' A' ' 61' ' ' LEU . 16.4 t0 -101.59 56.4 0.83 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.945 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.18 -17.43 62.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.592 -179.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 2.4 mtm -77.09 -30.9 55.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.895 0.379 . . . . 0.0 110.748 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.414 ' CB ' HD11 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -98.6 -21.44 16.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.196 179.984 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.3 -176.48 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.169 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 8.1 m -63.61 -47.25 82.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.795 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 70.29 25.35 4.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.112 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.64 154.41 39.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.705 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -79.54 -170.97 2.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.397 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.443 HD13 ' CZ ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -59.21 -53.1 62.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.252 -179.713 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.75 -44.75 66.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.175 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -54.78 -33.0 60.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.58 -179.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.35 -69.3 0.39 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.065 -179.646 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 133.48 -19.65 4.24 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.863 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.42 HD11 ' CE1' ' A' ' 41' ' ' PHE . 1.3 mp -51.85 -34.32 40.14 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.85 0.357 . . . . 0.0 111.025 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.14 -43.07 35.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.654 179.733 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.407 ' HB3' ' NH1' ' A' ' 82' ' ' ARG . 0.1 OUTLIER -60.06 -29.74 68.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.716 179.786 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -168.16 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.889 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.0 77.37 1.24 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.801 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 72.05 68.06 1.7 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.402 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -96.55 21.16 9.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.691 0.282 . . . . 0.0 111.267 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -86.1 150.18 24.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.924 0.392 . . . . 0.0 111.1 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.429 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 1.3 pt -133.67 -179.66 3.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.004 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -96.32 141.5 23.22 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.707 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -66.12 -13.86 41.77 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.577 2.184 . . . . 0.0 112.688 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -73.39 -49.89 24.77 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.43 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.406 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 0.2 OUTLIER -65.26 -42.93 92.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.968 0.413 . . . . 0.0 110.675 179.824 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -56.54 -53.39 58.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.555 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.27 -19.74 62.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.464 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.406 ' HB2' ' HA ' ' A' ' 92' ' ' GLN . 0.5 OUTLIER -61.25 -50.42 73.14 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.162 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.54 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 19.0 mm -73.72 -33.84 39.27 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.445 179.033 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.434 ' CH2' ' HG ' ' A' ' 60' ' ' LEU . 10.0 t-105 -53.03 -39.45 63.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.242 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -85.89 -30.54 22.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.609 179.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.54 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -58.13 -52.12 66.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.23 -179.882 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 32.4 m -78.29 -71.1 0.45 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.089 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 163.38 40.5 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.638 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . 0.445 ' HA2' ' CD2' ' A' ' 60' ' ' LEU . . . -60.35 -47.86 89.01 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.37 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.414 ' HA ' HD13 ' A' ' 124' ' ' LEU . 3.7 mp -56.55 -34.63 42.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.847 0.356 . . . . 0.0 111.426 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -67.84 -48.69 65.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.836 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -67.73 -41.14 83.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.715 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.416 ' CD1' HG22 ' A' ' 121' ' ' THR . 0.2 OUTLIER -67.84 -50.63 55.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.945 179.954 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.413 ' HG3' ' N ' ' A' ' 108' ' ' SER . 0.0 OUTLIER -60.78 -29.54 69.5 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.78 179.801 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' SER . . . . . 0.413 ' N ' ' HG3' ' A' ' 107' ' ' GLN . 4.1 m -67.99 -50.81 53.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.604 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.43 -32.33 68.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.413 0.625 . . . . 0.0 109.732 179.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.453 ' CG1' HG22 ' A' ' 121' ' ' THR . 5.0 mt -56.76 -49.16 79.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.406 179.073 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -69.42 -36.61 76.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.51 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 51.9 m -74.83 -9.29 58.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.282 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 70.86 39.81 1.01 Allowed 'General case' 0 N--CA 1.461 0.079 0 CA-C-O 120.901 0.381 . . . . 0.0 111.033 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -111.74 -28.99 7.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.835 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.01 -166.81 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.144 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.1 ttt180 -132.56 93.64 24.25 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.03 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -52.8 89.06 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.61 2.207 . . . . 0.0 112.116 179.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.6 t -132.88 -49.67 0.88 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.237 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.432 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 12.1 t80 -163.21 -62.28 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.889 0.376 . . . . 0.0 111.163 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.455 ' O ' ' HB2' ' A' ' 124' ' ' LEU . . . -53.85 -38.47 64.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.445 -179.59 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.453 HG22 ' CG1' ' A' ' 110' ' ' ILE . 0.9 OUTLIER -67.38 -44.64 78.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.693 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.56 -58.11 8.72 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.156 0.503 . . . . 0.0 110.696 179.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' MET . . . . . 0.437 ' HG3' ' O ' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -53.56 -29.98 39.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.485 179.512 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.455 ' HB2' ' O ' ' A' ' 120' ' ' ALA . 0.2 OUTLIER -66.54 -50.59 62.64 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.037 0.446 . . . . 0.0 109.922 178.863 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -49.77 -37.52 30.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.74 179.19 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -82.73 -31.46 28.45 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.014 178.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.4 -18.81 60.54 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.514 179.21 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.333 -0.15 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.066 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.816 0.341 . . . . 0.0 111.069 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -78.97 117.06 19.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.868 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 94.8 mm-40 -84.94 102.66 13.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.899 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.512 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 1.5 mmp_? -119.82 144.0 47.57 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.849 0.357 . . . . 0.0 110.645 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.527 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 0.9 OUTLIER -123.98 134.85 53.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.346 -179.653 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.512 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 7.7 m-85 -135.36 152.59 51.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.337 0.589 . . . . 0.0 111.971 -179.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.467 ' HB3' ' CG2' ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.4 142.62 25.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.691 179.15 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.451 ' CD1' HD22 ' A' ' 80' ' ' LEU . 0.4 OUTLIER -145.88 127.27 7.53 Favored Pre-proline 0 C--N 1.328 -0.36 0 C-N-CA 120.709 -0.396 . . . . 0.0 111.983 -179.692 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.42 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 60.7 Cg_endo -89.64 91.19 0.35 Allowed 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 123.176 2.584 . . . . 0.0 111.97 179.683 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.407 ' O ' ' CD1' ' A' ' 19' ' ' PHE . 27.1 p90 -111.27 133.96 53.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.983 0.421 . . . . 0.0 111.238 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.407 HG12 ' HD2' ' A' ' 34' ' ' LYS . 17.2 mt -89.94 142.78 12.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.763 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 mtt180 -60.08 130.11 88.83 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.215 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.455 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 9.3 Cg_endo -52.75 -50.93 12.35 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.46 2.107 . . . . 0.0 112.497 -179.567 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.519 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -53.98 -58.33 7.7 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.334 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.561 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 10.3 m-20 -66.0 -33.49 75.92 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.97 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -50.66 -54.63 21.48 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.469 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.519 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.4 p90 -95.8 -12.38 25.41 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.841 -179.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.561 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 1.6 mtpp -62.17 -48.61 79.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.93 0.395 . . . . 0.0 110.566 179.704 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -160.95 140.91 8.19 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.155 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -73.19 -5.74 17.7 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.621 2.214 . . . . 0.0 112.592 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -108.17 -33.92 7.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.897 0.38 . . . . 0.0 110.605 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -97.82 30.17 3.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.763 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 15.6 mttt -65.43 -59.98 3.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.976 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.83 121.44 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.519 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.407 ' HD2' HG12 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -98.98 131.46 45.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.045 -179.315 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -103.88 121.64 7.11 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.187 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.42 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 8.0 m-90 -97.81 119.62 36.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.903 0.382 . . . . 0.0 110.758 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.402 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 21.6 t90 -108.68 117.5 34.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.07 -179.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.445 ' CE1' ' CD1' ' A' ' 52' ' ' LEU . 4.5 m-85 -110.76 154.34 24.05 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.266 179.36 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.495 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . . . -170.38 123.83 0.69 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.123 0.487 . . . . 0.0 111.554 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.507 ' CG ' ' CE2' ' A' ' 14' ' ' PHE . 9.0 t-160 -95.57 96.05 8.79 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 178.72 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.604 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 7.4 m-85 -75.12 159.49 31.59 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.255 0.55 . . . . 0.0 111.433 -178.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.537 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.6 OUTLIER -133.09 120.35 21.16 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.113 179.003 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 58.39 -137.43 50.09 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 119.881 -1.152 . . . . 0.0 110.96 -178.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.417 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.2 Cg_exo -73.34 -16.23 24.83 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.456 2.104 . . . . 0.0 112.21 179.331 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' TRP . . . . . 0.418 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.8 OUTLIER -119.24 -158.85 0.75 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.344 -178.56 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.604 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 5.6 tt -130.82 154.84 41.3 Favored 'Isoleucine or valine' 0 C--O 1.231 0.108 0 CA-C-O 121.059 0.457 . . . . 0.0 112.089 -179.439 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -112.29 -35.44 5.6 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.457 -179.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.437 ' HG3' ' HB3' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -150.85 158.25 43.91 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 120.255 -0.578 . . . . 0.0 111.781 -179.392 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.495 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 21.8 pt20 -161.17 159.25 28.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.407 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.47 ' HE1' ' N ' ' A' ' 97' ' ' TRP . 0.0 OUTLIER -134.24 122.7 23.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.436 179.46 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.429 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 2.1 mt-10 -90.09 115.71 27.56 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.838 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.445 ' CD1' ' CE1' ' A' ' 38' ' ' TYR . 33.1 mt -119.09 101.86 8.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.937 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.418 ' CD2' ' N ' ' A' ' 53' ' ' HIS . 3.2 m-70 -135.11 136.26 24.44 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.565 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -51.08 -28.65 25.61 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.713 2.276 . . . . 0.0 112.215 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 15.2 p30 -96.41 -26.37 15.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.816 179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -113.1 112.6 49.73 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.77 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -50.01 175.05 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.468 2.112 . . . . 0.0 112.433 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -60.95 79.38 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.616 2.21 . . . . 0.0 112.357 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.429 ' HB ' ' HB2' ' A' ' 51' ' ' GLU . 7.6 mt -77.49 93.32 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.022 0.439 . . . . 0.0 110.502 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.44 ' HB3' ' CH2' ' A' ' 97' ' ' TRP . 2.8 mt -75.49 107.44 7.63 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.977 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.411 ' CD2' ' HB3' ' A' ' 66' ' ' ASP . 3.8 mt -98.32 153.41 18.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.912 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.7 p -154.78 142.07 12.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.952 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.67 164.66 1.95 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.397 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 66.68 -76.5 0.15 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.417 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.88 -61.79 2.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.977 0.418 . . . . 0.0 110.808 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.411 ' HB3' ' CD2' ' A' ' 61' ' ' LEU . 7.5 m-20 -108.14 42.83 1.3 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.672 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.61 -17.4 64.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.434 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -76.81 -28.05 55.42 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.803 0.335 . . . . 0.0 110.669 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -109.19 -23.84 11.42 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.249 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.4 176.55 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.868 0.366 . . . . 0.0 110.981 179.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 7.0 t -52.33 -66.7 0.34 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.802 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 72.37 7.12 5.63 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.516 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.47 157.9 18.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.962 0.41 . . . . 0.0 111.045 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -83.04 168.3 17.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.222 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.458 ' CD1' ' CE2' ' A' ' 15' ' ' PHE . 4.2 mm? -53.91 -53.58 50.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.747 0.308 . . . . 0.0 111.601 -179.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.56 -31.63 68.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.685 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -70.34 -40.8 73.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.462 -179.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.8 -76.58 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.306 -179.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 143.27 -24.21 2.21 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.508 -0.853 . . . . 0.0 113.007 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.451 HD22 ' CD1' ' A' ' 17' ' ' ILE . 1.0 OUTLIER -53.94 -48.58 70.09 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.06 0.457 . . . . 0.0 110.538 179.875 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.53 -48.32 82.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.614 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.76 -30.11 68.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.635 179.605 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.34 177.35 0.5 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.811 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -87.96 78.28 8.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.826 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 69.27 68.51 1.62 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.372 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -90.84 16.31 9.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.465 0.174 . . . . 0.0 111.463 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -84.03 155.15 22.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.953 0.406 . . . . 0.0 111.186 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.467 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 0.8 OUTLIER -136.95 179.04 4.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.964 179.748 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.8 mp -94.07 137.93 22.79 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.607 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.72 -21.18 62.06 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.437 2.092 . . . . 0.0 112.334 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.12 -39.43 72.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.997 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -70.12 -50.44 40.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.009 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.425 ' CZ ' ' HG2' ' A' ' 50' ' ' MET . 16.7 t80 -54.91 -49.42 71.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.767 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.14 -21.93 61.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.748 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.9 -50.44 72.18 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.2 0.524 . . . . 0.0 109.614 179.131 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.427 ' HB ' ' HE1' ' A' ' 50' ' ' MET . 20.8 mm -77.47 -34.11 20.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.671 179.336 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.47 ' N ' ' HE1' ' A' ' 50' ' ' MET . 53.0 t-105 -52.96 -40.55 63.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.919 179.353 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.15 -30.16 22.7 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.453 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -56.78 -54.15 49.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.221 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 95.3 m -75.8 -82.06 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.003 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -178.62 35.99 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.515 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -67.69 -37.66 89.22 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.607 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.456 HD12 HG22 ' A' ' 103' ' ' ILE . 30.9 mm -70.21 -39.41 76.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.855 0.359 . . . . 0.0 111.162 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.7 -42.92 97.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.974 0.416 . . . . 0.0 110.425 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -67.53 -42.99 81.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.717 179.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.49 -50.25 63.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.056 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.409 ' HG3' ' N ' ' A' ' 108' ' ' SER . 0.0 OUTLIER -60.9 -29.56 69.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.024 -179.962 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' SER . . . . . 0.409 ' N ' ' HG3' ' A' ' 107' ' ' GLN . 8.5 t -68.87 -50.49 49.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.76 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.09 -31.1 65.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.351 0.596 . . . . 0.0 109.505 178.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.404 ' HB ' ' HA ' ' A' ' 107' ' ' GLN . 10.7 mt -56.96 -48.8 80.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.127 179.136 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -69.53 -39.35 77.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.577 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.39 -12.03 61.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.191 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 73.2 35.83 0.89 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.842 0.353 . . . . 0.0 110.908 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -106.8 -28.91 9.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.661 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.99 -170.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.025 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -140.16 96.21 8.15 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.951 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -45.88 107.09 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.509 2.14 . . . . 0.0 112.276 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.7 p -144.69 -45.82 0.24 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.171 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -174.37 -49.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.916 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.434 ' O ' ' HB2' ' A' ' 124' ' ' LEU . . . -58.14 -39.06 77.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.232 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 40.3 p -68.64 -44.76 73.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.746 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.21 -58.26 9.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.089 0.471 . . . . 0.0 110.427 179.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' MET . . . . . 0.462 ' HE1' ' HB2' ' A' ' 123' ' ' MET . 0.0 OUTLIER -56.19 -29.59 61.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.18 179.22 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.435 ' N ' ' HE2' ' A' ' 123' ' ' MET . 0.0 OUTLIER -67.65 -51.36 50.84 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.003 0.43 . . . . 0.0 109.943 178.956 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 46.6 mm-40 -49.75 -38.39 33.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.067 179.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 -79.63 -34.23 40.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.227 179.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.49 -18.68 60.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.387 179.065 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.333 -0.122 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.873 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.819 0.343 . . . . 0.0 111.004 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 87.8 mm-40 -70.23 146.93 50.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.593 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.9 mp0 -112.82 113.73 25.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.918 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.452 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.7 OUTLIER -126.0 124.09 39.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.051 179.842 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.501 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -113.67 134.66 54.6 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.699 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.452 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 1.9 m-85 -133.5 160.65 36.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.28 0.562 . . . . 0.0 112.179 -178.685 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.479 ' HB3' ' CG2' ' A' ' 88' ' ' ILE . 0.4 OUTLIER -149.11 144.09 26.42 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.827 179.625 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.446 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -153.22 117.5 2.81 Favored Pre-proline 0 C--N 1.33 -0.269 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.96 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.49 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 1.2 Cg_endo -83.67 89.27 1.05 Allowed 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 123.057 2.504 . . . . 0.0 111.781 179.456 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.421 ' O ' ' CD1' ' A' ' 19' ' ' PHE . 20.8 p90 -103.1 136.58 42.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.944 0.402 . . . . 0.0 110.997 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.531 HG12 ' HG3' ' A' ' 34' ' ' LYS . 10.6 mt -84.81 139.67 17.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.072 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.7 mtp180 -60.66 139.06 93.08 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.261 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.461 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 19.5 Cg_endo -58.29 -50.55 9.51 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.409 2.073 . . . . 0.0 112.301 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.514 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -53.84 -58.34 7.6 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.077 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.511 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 45.4 m-20 -66.38 -32.69 74.23 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.983 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.418 ' HB3' ' O ' ' A' ' 22' ' ' PRO . 0.0 OUTLIER -50.37 -52.45 37.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.347 -179.653 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.514 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.9 p90 -98.17 -15.75 19.77 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.972 -179.317 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.511 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 0.7 OUTLIER -60.92 -46.51 90.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.937 0.398 . . . . 0.0 110.729 179.861 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -161.86 138.44 6.15 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.021 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.29 -7.08 20.57 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.515 2.143 . . . . 0.0 112.729 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -111.26 -29.75 7.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.854 0.359 . . . . 0.0 110.897 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.3 m120 -97.95 29.05 3.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.121 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 17.5 mttt -64.7 -62.32 1.65 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.115 0.484 . . . . 0.0 110.525 179.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.9 mmmt 67.77 100.98 0.05 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.505 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.531 ' HG3' HG12 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -81.87 139.17 34.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.457 -179.467 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.431 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -110.49 130.18 9.71 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.05 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.49 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 22.9 m-90 -97.49 112.85 24.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.054 0.454 . . . . 0.0 110.875 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.456 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 26.9 t90 -101.92 117.47 34.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.01 -179.509 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.478 ' CE1' ' CD1' ' A' ' 52' ' ' LEU . 1.2 m-85 -114.45 156.04 25.26 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.414 179.319 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.436 ' CB ' ' CD1' ' A' ' 46' ' ' ILE . . . -163.53 123.78 2.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.331 0.586 . . . . 0.0 111.852 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.491 ' HB3' ' CB ' ' A' ' 48' ' ' ARG . 2.4 t-160 -90.71 84.51 5.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.208 -0.906 . . . . 0.0 108.841 178.603 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.625 ' CG ' ' HB ' ' A' ' 46' ' ' ILE . 13.7 m-85 -71.83 149.83 44.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.836 -178.518 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.415 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.5 OUTLIER -133.03 119.13 19.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.432 -0.804 . . . . 0.0 108.898 178.968 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 62.71 -140.52 46.0 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 119.966 -1.111 . . . . 0.0 110.929 -178.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.419 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 2.6 Cg_exo -75.89 -1.17 11.07 Favored 'Trans proline' 0 CA--C 1.531 0.33 0 C-N-CA 122.691 2.261 . . . . 0.0 112.421 179.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' TRP . . . . . 0.419 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 1.5 m95 -135.5 -158.44 0.87 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.582 -178.374 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.625 ' HB ' ' CG ' ' A' ' 41' ' ' PHE . 4.2 tt -139.31 155.21 25.87 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.099 0 CA-C-O 121.119 0.485 . . . . 0.0 111.861 -179.231 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.41 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -123.85 -24.29 4.48 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.594 -0.73 . . . . 0.0 112.12 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.491 ' CB ' ' HB3' ' A' ' 40' ' ' HIS . 3.2 mtt180 -126.47 133.65 51.14 Favored 'General case' 0 C--O 1.227 -0.099 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.536 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.413 ' NE2' HD13 ' A' ' 61' ' ' LEU . 0.5 OUTLIER -144.16 137.48 27.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.913 0.387 . . . . 0.0 111.423 -179.943 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.445 ' HG2' ' CZ ' ' A' ' 93' ' ' PHE . 0.0 OUTLIER -133.62 115.51 14.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.524 179.729 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.404 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.1 OUTLIER -95.46 115.67 27.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.104 -179.73 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.478 ' CD1' ' CE1' ' A' ' 38' ' ' TYR . 15.1 mt -115.22 101.87 9.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.649 179.684 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.431 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 2.0 m-70 -123.8 133.6 24.74 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.041 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -52.66 -27.33 32.92 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.268 1.979 . . . . 0.0 112.118 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -94.75 -26.92 16.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.936 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.5 mptt -121.2 118.93 29.86 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.999 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.435 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 88.1 Cg_exo -46.09 170.13 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.536 2.157 . . . . 0.0 112.238 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.435 ' HD2' ' HB3' ' A' ' 57' ' ' PRO . 18.0 Cg_endo -58.2 82.22 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.446 2.098 . . . . 0.0 112.3 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.404 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 76.2 mt -61.03 105.36 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.735 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.443 ' HG ' ' CZ3' ' A' ' 97' ' ' TRP . 3.0 mp -81.43 121.38 26.18 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.987 -179.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.413 HD13 ' NE2' ' A' ' 49' ' ' GLN . 73.9 mt -129.4 154.17 47.19 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.076 -179.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.6 p -153.51 143.15 14.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.028 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.44 147.62 13.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.151 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.72 -50.51 2.3 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.568 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.74 -75.68 0.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.833 0.349 . . . . 0.0 110.888 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.93 56.14 3.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.916 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -68.18 -28.7 67.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.204 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.96 -20.71 34.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.235 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -94.78 -50.07 5.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.287 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.35 -163.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.153 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.65 114.36 11.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.595 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -103.14 37.76 1.91 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.886 0.374 . . . . 0.0 110.764 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.09 -179.18 6.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.819 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -94.67 164.21 13.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.683 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.417 HD12 ' CD2' ' A' ' 41' ' ' PHE . 0.6 OUTLIER -54.92 -32.32 61.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.659 -179.573 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.57 -56.06 7.41 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -179.273 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -77.91 -3.91 44.12 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.34 -53.56 41.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.755 0.312 . . . . 0.0 110.758 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 117.79 -25.13 8.62 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.7 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.405 HD23 ' CZ3' ' A' ' 37' ' ' TRP . 1.2 mt -56.92 -32.24 65.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.747 0.308 . . . . 0.0 111.005 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 5.1 p -80.04 -34.03 38.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.927 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -67.01 -30.5 70.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.876 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.58 -173.96 0.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.808 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.03 74.46 4.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.976 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 69.25 65.57 2.55 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.602 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -72.58 -10.26 59.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.637 0.256 . . . . 0.0 111.387 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -52.28 148.07 7.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.898 0.38 . . . . 0.0 111.388 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.479 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 1.0 OUTLIER -139.8 179.29 2.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.105 179.897 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -98.41 150.19 36.48 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.578 179.664 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.51 -29.94 71.14 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.489 2.126 . . . . 0.0 112.349 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.0 -49.69 74.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.472 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.501 ' HA ' ' HG2' ' A' ' 95' ' ' GLU . 4.8 mm-40 -64.37 -46.23 84.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.937 0.399 . . . . 0.0 111.637 -179.366 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.445 ' CZ ' ' HG2' ' A' ' 50' ' ' MET . 15.2 t80 -64.72 -43.93 91.84 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.365 -179.547 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -79.6 -30.02 41.34 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -179.053 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.501 ' HG2' ' HA ' ' A' ' 92' ' ' GLN . 11.8 pt-20 -63.91 -46.43 84.83 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 120.129 -0.628 . . . . 0.0 109.799 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.604 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 38.0 mm -71.21 -37.84 67.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 CA-C-O 121.142 0.496 . . . . 0.0 110.018 178.61 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.447 ' CE2' ' HA3' ' A' ' 102' ' ' GLY . 47.5 t-105 -52.48 -39.64 61.41 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.228 179.399 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -85.51 -24.57 27.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.729 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.604 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -56.77 -45.7 81.92 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.291 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 2.2 p -88.66 -54.63 4.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.606 -179.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 148.96 45.88 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.584 -0.817 . . . . 0.0 112.556 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . 0.447 ' HA3' ' CE2' ' A' ' 97' ' ' TRP . . . -71.09 -38.98 63.5 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.932 -0.652 . . . . 0.0 112.387 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 20.6 mm -62.44 -55.08 26.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.725 0.297 . . . . 0.0 110.951 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.19 -45.06 79.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.561 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -59.9 -49.36 77.99 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.342 179.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.01 -46.19 90.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.798 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.1 mm100 -59.41 -29.63 67.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.032 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.84 -50.67 40.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.933 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.13 -31.29 65.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.456 0.646 . . . . 0.0 109.607 178.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.407 ' CG1' HG23 ' A' ' 121' ' ' THR . 12.3 mt -58.69 -48.96 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.363 179.139 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -66.38 -42.44 87.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.321 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.74 -15.72 63.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.011 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 75.54 32.53 0.7 Allowed 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 120.921 0.391 . . . . 0.0 110.977 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -100.32 -26.73 13.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.792 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.11 -162.88 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.041 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.31 93.38 11.46 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.219 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -51.06 89.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.602 2.201 . . . . 0.0 112.035 179.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 9.0 t -138.23 -47.66 0.53 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.414 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.453 ' CE1' ' CE1' ' A' ' 40' ' ' HIS . 14.4 t80 -167.23 -47.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.629 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -59.97 -52.4 65.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.664 -179.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.407 HG23 ' CG1' ' A' ' 110' ' ' ILE . 69.1 p -65.32 -49.12 70.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.718 -179.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.86 -48.39 75.62 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.414 0.626 . . . . 0.0 109.799 179.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' MET . . . . . 0.414 ' HE1' ' HB3' ' A' ' 123' ' ' MET . 0.0 OUTLIER -58.01 -31.45 66.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.245 -0.888 . . . . 0.0 109.875 178.762 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.39 -49.41 66.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.891 178.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 63.7 mm-40 -49.99 -40.65 44.97 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.966 179.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -77.95 -32.82 51.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.129 178.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.03 -17.53 62.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.53 179.027 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.15 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.038 -179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.842 0.353 . . . . 0.0 110.804 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -97.67 167.98 10.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.865 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.451 ' HG2' ' CZ ' ' A' ' 119' ' ' TYR . 10.5 mp0 -119.38 108.3 14.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.902 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.54 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -117.58 120.56 38.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.019 -179.739 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.489 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 0.1 OUTLIER -113.8 148.94 35.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.515 179.897 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.54 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 0.2 OUTLIER -152.39 162.8 40.66 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.296 0.569 . . . . 0.0 111.857 179.944 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.447 ' HG3' ' CD2' ' A' ' 38' ' ' TYR . 7.0 ttp180 -149.26 148.04 29.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.896 179.36 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -149.61 124.48 4.8 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 120.72 0.295 . . . . 0.0 111.688 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.461 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 67.1 Cg_endo -91.66 97.91 0.21 Allowed 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 123.007 2.471 . . . . 0.0 112.284 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -113.21 143.27 44.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.814 0.34 . . . . 0.0 110.834 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.44 HG12 ' HG2' ' A' ' 34' ' ' LYS . 5.7 mt -85.66 153.02 3.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.372 -179.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -80.25 140.57 52.92 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.671 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.485 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 51.8 Cg_exo -55.34 -47.92 23.43 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.558 2.172 . . . . 0.0 112.844 -179.576 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.517 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -54.94 -58.98 5.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.35 -179.383 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.46 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 1.8 m-20 -67.99 -31.18 70.7 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.552 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.42 -50.39 59.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.573 -179.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.517 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.3 p90 -102.21 -5.29 24.53 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 -179.268 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.46 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 6.0 mtpp -74.41 -39.11 62.85 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.835 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -174.44 140.79 0.74 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.417 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.3 -22.28 22.14 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.671 2.248 . . . . 0.0 112.288 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -84.63 -36.95 21.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.169 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -94.47 41.6 1.09 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.821 179.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.2 mmtm -78.08 61.17 2.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.698 -179.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.7 mmtt -46.2 95.5 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.338 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.44 ' HG2' HG12 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -83.89 131.99 34.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.783 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.424 ' HA3' ' CD2' ' A' ' 53' ' ' HIS . . . -115.99 142.51 17.59 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.849 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.461 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 22.0 m-90 -105.82 138.35 42.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.757 0.313 . . . . 0.0 110.732 179.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.402 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 41.7 t90 -123.98 116.83 23.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.791 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.447 ' CD2' ' HG3' ' A' ' 16' ' ' ARG . 3.1 m-85 -109.73 154.53 22.77 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.413 179.693 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.487 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . . . -170.21 125.46 0.77 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.154 0.502 . . . . 0.0 112.041 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.489 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 16.8 t-160 -96.89 96.61 8.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.757 179.016 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.586 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 19.5 m-85 -83.91 122.54 28.87 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.579 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.51 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.6 OUTLIER -91.75 111.06 22.43 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 178.289 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.19 -135.6 50.09 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.018 -1.087 . . . . 0.0 110.928 -178.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.418 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 8.1 Cg_exo -72.5 -16.68 27.23 Favored 'Trans proline' 0 N--CA 1.463 -0.278 0 C-N-CA 122.444 2.096 . . . . 0.0 112.317 179.424 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' TRP . . . . . 0.418 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 0.8 OUTLIER -115.08 -170.3 1.73 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.597 -178.696 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.586 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 3.5 tt -133.07 153.65 38.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 121.172 0.51 . . . . 0.0 111.998 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.408 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -129.73 -22.21 2.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.492 -0.777 . . . . 0.0 111.959 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 3.5 mtt180 -130.22 142.3 50.57 Favored 'General case' 0 N--CA 1.46 0.04 0 CA-C-O 120.77 0.319 . . . . 0.0 111.167 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.487 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 0.1 OUTLIER -155.88 129.86 8.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.991 0.424 . . . . 0.0 111.175 179.942 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -125.47 120.53 31.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.695 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.477 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -98.53 132.85 43.63 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.071 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.423 HD13 ' CE1' ' A' ' 38' ' ' TYR . 14.1 mt -135.06 101.98 5.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.846 179.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.424 ' CD2' ' HA3' ' A' ' 35' ' ' GLY . 61.3 m170 -126.26 138.26 31.92 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.931 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -52.26 -23.64 18.62 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.439 2.092 . . . . 0.0 112.341 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -98.58 -27.45 14.01 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.233 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 1.9 mttm -118.49 125.41 27.84 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.053 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.53 177.05 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.522 2.148 . . . . 0.0 112.27 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -59.68 84.97 0.07 OUTLIER 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.642 2.228 . . . . 0.0 112.498 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.477 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 67.1 mt -66.21 98.12 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.003 0.43 . . . . 0.0 110.634 179.64 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.422 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.2 OUTLIER -72.92 107.82 5.51 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.933 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.423 ' HB3' ' HB3' ' A' ' 49' ' ' GLN . 1.1 mm? -110.15 147.46 33.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.959 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.9 p -156.53 140.51 7.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.936 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.08 170.7 0.3 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.025 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.28 -72.28 0.32 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.325 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.28 -54.0 40.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.824 0.345 . . . . 0.0 110.694 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -114.19 57.46 0.7 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.867 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -20.19 63.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.212 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -85.58 -43.3 13.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.049 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.403 ' HB3' ' CD1' ' A' ' 61' ' ' LEU . 3.2 mm-40 -68.41 -39.58 81.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.02 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -48.26 167.66 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.905 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -56.09 -30.66 62.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.864 0.364 . . . . 0.0 111.083 -179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 75.97 -61.07 0.47 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.059 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.2 mptt -53.45 161.49 0.98 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.189 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -77.59 -172.89 2.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.555 179.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.418 HD13 ' CE1' ' A' ' 15' ' ' PHE . 28.0 tp -64.47 -51.97 60.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.558 -179.542 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.16 -31.37 68.82 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.837 0.351 . . . . 0.0 111.383 -179.663 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -66.95 -37.9 85.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.611 -179.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.423 HG23 ' CE2' ' A' ' 41' ' ' PHE . 21.0 p -59.41 -74.13 0.07 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.785 0.326 . . . . 0.0 111.122 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 143.03 -17.76 2.34 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.807 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.49 -41.1 52.84 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.979 0.418 . . . . 0.0 110.756 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -73.94 -26.84 60.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.725 179.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.98 -26.91 57.22 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.975 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.86 -171.08 0.49 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.115 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.6 90.93 4.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.951 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 62.5 68.97 1.44 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.559 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -88.14 -22.0 24.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.779 0.323 . . . . 0.0 111.077 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -53.92 143.26 21.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.307 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.418 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 1.6 pt -130.16 169.66 20.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.127 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.59 147.56 49.65 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.67 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -66.02 -26.06 51.17 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.558 2.172 . . . . 0.0 112.353 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -54.37 45.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.104 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -50.91 71.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.12 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -54.22 -53.07 58.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.713 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.57 -20.8 62.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.502 179.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.15 -50.34 74.05 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.013 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 20.0 mm -75.4 -33.67 28.23 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.303 178.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.457 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 14.1 t-105 -52.75 -41.07 63.68 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.972 179.281 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.06 -29.0 23.74 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.381 179.188 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -45.92 92.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.207 -179.813 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 44.3 t -88.02 -83.45 0.21 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.976 -179.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -176.09 34.38 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.63 -179.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . 0.457 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -58.26 -54.89 33.99 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.603 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 1.8 mt -58.33 -34.69 50.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.796 0.331 . . . . 0.0 111.108 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.75 -49.16 74.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.604 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -64.18 -42.52 96.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.432 179.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.41 ' CD1' ' CD1' ' A' ' 124' ' ' LEU . 0.4 OUTLIER -64.0 -46.31 85.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.693 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -61.49 -29.72 70.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.77 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 37.7 m -68.33 -50.31 54.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.749 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.27 -33.37 69.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.362 0.601 . . . . 0.0 109.518 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.423 ' CG1' HG22 ' A' ' 121' ' ' THR . 8.6 mt -56.91 -48.92 80.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.368 179.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -67.86 -38.33 82.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.413 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 1.1 m -78.07 -4.88 49.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.235 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.8 mmt85 65.27 35.88 7.38 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.964 0.411 . . . . 0.0 110.922 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.15 -25.2 9.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.873 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -56.45 -29.93 62.26 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.161 179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 72.05 97.65 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.345 179.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_exo -52.3 87.85 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.746 2.297 . . . . 0.0 111.932 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 9.0 t -112.22 -43.48 3.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.106 -179.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.451 ' CZ ' ' HG2' ' A' ' 12' ' ' GLN . 23.0 t80 -178.89 -63.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.035 179.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.67 -36.12 61.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.995 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.423 HG22 ' CG1' ' A' ' 110' ' ' ILE . 0.8 OUTLIER -60.83 -47.09 87.96 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.06 179.467 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -65.79 -46.4 78.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.389 0.614 . . . . 0.0 109.695 178.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' MET . . . . . . . . . . . . . 1.9 tmm? -58.11 -35.81 72.0 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.251 179.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.41 ' CD1' ' CD1' ' A' ' 106' ' ' LEU . 0.6 OUTLIER -67.69 -45.97 73.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.74 178.996 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 60.7 mm-40 -50.52 -38.4 44.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.968 179.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -76.77 -34.95 58.0 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.065 179.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.2 mt -59.3 -21.13 59.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.084 178.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 1.8 mt . . . . . 0 C--N 1.332 -0.169 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.93 179.957 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 51.5 mtt-85 . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.92 0.39 . . . . 0.0 110.877 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.71 138.16 31.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.874 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.451 ' HG2' ' CZ ' ' A' ' 119' ' ' TYR . 5.7 mp0 -108.08 102.82 11.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.889 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.462 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 2.5 mtp180 -111.92 133.84 53.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.019 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.505 ' CE2' ' CG ' ' A' ' 40' ' ' HIS . 1.2 m-85 -117.7 134.96 54.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.145 179.799 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.462 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 1.4 m-85 -136.31 157.23 47.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.251 0.548 . . . . 0.0 112.003 -179.037 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.483 ' CD ' ' CZ ' ' A' ' 38' ' ' TYR . 16.4 ttp180 -149.38 145.89 27.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.785 179.428 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.418 ' N ' ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -140.84 125.01 10.48 Favored Pre-proline 0 C--N 1.328 -0.327 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.447 -179.72 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -88.19 96.75 0.4 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.009 2.473 . . . . 0.0 112.186 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.407 ' O ' ' CD1' ' A' ' 19' ' ' PHE . 10.9 p90 -120.39 142.61 49.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.912 0.387 . . . . 0.0 111.107 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.0 mt -87.9 145.41 7.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.935 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.14 129.26 93.92 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.485 179.647 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.474 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 75.8 Cg_exo -50.04 -48.96 17.59 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.431 2.087 . . . . 0.0 112.659 -179.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.523 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -54.37 -58.24 8.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.439 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.524 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 36.9 m-20 -67.38 -31.77 72.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.913 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -51.61 -55.44 19.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.493 -179.574 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.523 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.0 p90 -93.89 -14.28 26.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.728 -179.43 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.524 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 3.0 mtpp -60.97 -47.25 87.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.952 0.406 . . . . 0.0 110.6 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -164.87 142.35 5.13 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.094 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -70.66 -22.42 27.96 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.735 2.29 . . . . 0.0 112.666 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -95.09 -32.83 12.92 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.789 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 30.5 m120 -101.37 48.14 0.9 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.728 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.01 59.53 0.67 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.795 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.25 146.14 0.7 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.259 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.26 117.49 34.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.013 -179.486 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -92.17 126.33 8.46 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.228 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 8.6 m-90 -102.16 135.21 44.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.902 0.382 . . . . 0.0 111.01 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 33.7 t90 -117.01 117.21 29.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.048 -179.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.483 ' CZ ' ' CD ' ' A' ' 16' ' ' ARG . 12.0 m-85 -111.87 150.91 29.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.122 179.434 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.488 ' HB2' ' CE1' ' A' ' 41' ' ' PHE . . . -169.55 125.05 0.84 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.146 0.498 . . . . 0.0 112.042 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.505 ' CG ' ' CE2' ' A' ' 14' ' ' PHE . 14.4 t-160 -91.92 99.56 12.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.649 178.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.551 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 36.9 m-85 -85.23 118.87 25.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.776 -179.085 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.484 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.7 OUTLIER -91.59 115.17 27.82 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.28 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 57.78 -135.82 51.38 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 119.967 -1.111 . . . . 0.0 111.107 -178.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.409 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 7.8 Cg_exo -72.38 -18.77 26.05 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.436 2.091 . . . . 0.0 112.353 179.417 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' TRP . . . . . 0.418 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.6 OUTLIER -114.24 -171.56 1.94 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.969 0.414 . . . . 0.0 111.692 -178.752 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.551 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 1.7 tt -131.03 148.5 33.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.509 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -122.92 -20.58 5.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.839 -179.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.433 ' HG3' ' CB ' ' A' ' 120' ' ' ALA . 2.3 mtt180 -129.94 138.38 50.85 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.84 0.352 . . . . 0.0 111.333 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.464 ' HB3' ' HB3' ' A' ' 61' ' ' LEU . 7.2 tt0 -147.96 121.06 8.86 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.908 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 7.3 ttm -121.01 112.76 19.14 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.708 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -94.23 129.76 40.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.14 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.42 HD12 ' CD1' ' A' ' 38' ' ' TYR . 8.5 mt -129.05 112.1 13.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.854 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.8 m-70 -128.52 129.97 23.54 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.774 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -46.68 -27.11 5.05 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.515 2.143 . . . . 0.0 112.543 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -95.08 -33.97 12.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.946 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.1 mtpt -111.95 120.44 42.03 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.954 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -47.56 174.05 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.598 2.199 . . . . 0.0 112.579 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -55.95 85.38 0.04 OUTLIER 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.7 2.266 . . . . 0.0 112.341 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 84.5 mt -64.47 92.14 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.097 0.475 . . . . 0.0 110.737 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.449 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.3 OUTLIER -64.68 132.78 50.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.719 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.464 ' HB3' ' HB3' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -140.88 150.03 42.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.163 -179.52 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.3 p -153.36 148.96 13.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.121 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.26 166.92 2.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.974 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.18 -73.39 0.29 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.393 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -58.95 -57.6 12.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.845 0.355 . . . . 0.0 110.8 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -108.96 48.51 0.86 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.639 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.22 -17.88 65.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.422 -179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 17.9 mmt -82.14 -32.63 29.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.848 0.356 . . . . 0.0 110.563 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.406 ' HB3' ' CD1' ' A' ' 61' ' ' LEU . 1.2 mp0 -89.24 -40.81 12.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.799 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.407 ' N ' HD21 ' A' ' 61' ' ' LEU . 32.1 ttm -53.34 162.51 0.74 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.142 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 1.7 t -50.08 118.1 2.73 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.941 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -82.98 0.84 42.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.772 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.28 164.56 16.8 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.79 0.329 . . . . 0.0 110.997 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -83.31 -179.84 7.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.974 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.452 ' HA ' ' OG1' ' A' ' 78' ' ' THR . 4.3 mt -65.78 -34.24 77.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.444 -179.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.5 -42.11 71.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.087 -178.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -93.87 -3.75 51.25 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.303 0.482 . . . . 0.0 112.303 -178.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.452 ' OG1' ' HA ' ' A' ' 75' ' ' LEU . 0.2 OUTLIER -67.08 -64.11 0.92 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.795 0.331 . . . . 0.0 110.813 179.945 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.405 ' CA ' ' NH1' ' A' ' 82' ' ' ARG . . . 129.82 -15.83 5.63 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.763 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.1 mp -68.25 -45.07 74.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.892 0.377 . . . . 0.0 110.892 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 52.9 p -65.44 -52.16 55.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.174 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.405 ' NH1' ' CA ' ' A' ' 79' ' ' GLY . 0.0 OUTLIER -62.01 -27.59 68.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.961 -179.833 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -167.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.861 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.18 73.67 7.17 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.005 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 59.71 65.35 3.47 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.651 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.99 -14.03 62.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.8 0.333 . . . . 0.0 111.492 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.69 143.18 21.13 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.273 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.445 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 2.1 pt -127.16 -179.88 3.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.193 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 8.9 mt -81.85 137.96 46.87 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.838 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.5 -51.25 5.43 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.428 2.085 . . . . 0.0 111.986 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.87 -38.26 69.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.19 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -62.33 -52.38 63.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.935 0.398 . . . . 0.0 110.981 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 43.2 t80 -54.27 -53.0 59.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.57 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.404 ' OE2' ' NH1' ' A' ' 48' ' ' ARG . 0.1 OUTLIER -68.8 -21.23 64.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.515 179.436 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.52 -50.64 72.75 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 179.041 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.428 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 17.4 mm -71.96 -32.9 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.351 179.157 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.451 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 19.4 t-105 -55.72 -37.22 68.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.995 179.047 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.68 -27.92 25.03 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.642 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.428 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.2 OUTLIER -56.58 -54.3 47.51 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.348 -179.541 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 40.9 t -83.54 -80.18 0.19 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.025 -179.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 178.85 36.48 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.579 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . 0.451 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -54.29 -55.23 27.6 Favored Glycine 0 N--CA 1.453 -0.188 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.418 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 3.6 mp -56.69 -40.49 70.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.768 0.318 . . . . 0.0 111.292 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -59.7 -49.03 79.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.571 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 82.9 t80 -61.26 -42.16 98.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.401 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . 0.41 ' CD2' HG23 ' A' ' 121' ' ' THR . 0.4 OUTLIER -64.92 -41.56 95.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.63 179.705 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -63.11 -32.72 74.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.727 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -67.97 -50.18 57.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.514 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.4 -35.84 78.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.437 0.636 . . . . 0.0 109.456 178.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.421 ' CD1' HD22 ' A' ' 124' ' ' LEU . 3.8 mt -59.62 -48.87 85.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.357 179.012 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -67.03 -30.93 71.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.725 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 23.4 m -86.23 -7.03 58.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.206 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 22.6 mmt85 70.27 29.01 3.75 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.898 0.38 . . . . 0.0 110.88 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 84.1 mm-40 -99.44 -25.18 14.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.587 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.04 -164.93 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.933 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -140.48 89.94 10.31 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.102 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -51.31 87.91 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.705 2.27 . . . . 0.0 112.349 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 5.7 t -127.35 -45.03 1.53 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.868 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.451 ' CZ ' ' HG2' ' A' ' 12' ' ' GLN . 27.9 t80 -168.56 -61.66 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.886 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.45 ' O ' ' HG3' ' A' ' 123' ' ' MET . . . -54.09 -37.33 64.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.317 -179.73 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.414 HG23 ' CG1' ' A' ' 110' ' ' ILE . 0.2 OUTLIER -68.33 -41.06 81.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.557 179.961 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -65.53 -56.25 13.39 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.523 179.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' MET . . . . . 0.45 ' HG3' ' O ' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -55.38 -29.12 57.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.315 179.293 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.447 ' HB2' ' O ' ' A' ' 120' ' ' ALA . 0.3 OUTLIER -64.51 -52.4 58.0 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.079 0.466 . . . . 0.0 110.043 179.055 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 -53.09 -42.69 66.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.717 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -78.63 -30.63 46.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.666 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.3 tt -76.02 -7.81 55.53 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.523 179.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 7.0 mt . . . . . 0 C--N 1.332 -0.19 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.24 179.906 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.876 0.369 . . . . 0.0 111.034 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.8 mm-40 -61.48 152.72 29.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.786 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.402 ' OE1' ' CE1' ' A' ' 40' ' ' HIS . 93.1 mm-40 -123.89 102.71 7.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.907 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.452 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -112.58 123.64 50.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.023 179.977 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.46 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 2.5 m-85 -108.91 134.89 50.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.012 179.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.452 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 15.1 m-85 -132.79 148.84 52.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.234 0.54 . . . . 0.0 112.12 -178.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -147.2 138.93 24.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.605 179.597 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -149.33 123.27 4.63 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-O 120.725 0.298 . . . . 0.0 111.613 -179.582 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.445 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 91.0 Cg_endo -89.16 119.59 0.97 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.016 2.478 . . . . 0.0 111.964 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.432 ' O ' ' N ' ' A' ' 35' ' ' GLY . 11.4 p90 -139.31 154.84 47.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.883 0.373 . . . . 0.0 111.068 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.401 HD11 HG21 ' A' ' 20' ' ' ILE . 58.5 mt -105.06 142.19 18.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.769 179.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -58.76 136.99 86.87 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.47 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.457 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 15.9 Cg_endo -57.46 -46.56 26.79 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.516 2.144 . . . . 0.0 112.585 -179.624 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.504 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -55.44 -58.87 5.97 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.316 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.496 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 2.7 m-20 -66.52 -32.71 74.24 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.684 179.768 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -50.62 -51.23 50.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.48 -179.696 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.504 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.8 p90 -103.32 -1.64 28.4 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.119 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.496 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 16.0 mtpp -77.89 -40.07 41.13 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.919 -0.313 . . . . 0.0 110.949 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -172.78 143.57 1.18 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.44 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -73.03 -22.7 19.2 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.807 2.338 . . . . 0.0 112.295 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -83.97 -36.2 23.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.111 179.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -94.38 41.79 1.09 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.995 179.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.9 mmtm -80.74 59.93 3.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.779 -179.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.1 94.6 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.964 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.17 -170.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.979 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 19' ' ' PHE . . . -170.11 108.52 0.29 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.23 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.464 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 18.0 m-90 -97.58 131.57 44.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.846 0.355 . . . . 0.0 110.682 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.3 t90 -121.02 117.5 27.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.22 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.464 ' CE1' ' HB3' ' A' ' 36' ' ' TRP . 1.8 m-85 -120.2 148.02 44.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.201 179.34 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.455 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . . . -170.47 124.64 0.71 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.215 0.531 . . . . 0.0 111.69 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.465 ' HB3' ' CG ' ' A' ' 48' ' ' ARG . 10.9 t-160 -93.22 105.77 17.81 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 178.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.708 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 3.0 m-85 -85.45 134.09 34.07 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.62 -178.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.509 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 4.5 t70 -97.25 120.93 38.51 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 178.501 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 57.31 -138.65 47.62 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 119.767 -1.206 . . . . 0.0 110.889 -178.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.413 ' O ' ' ND2' ' A' ' 74' ' ' ASN . 7.4 Cg_exo -72.26 -18.67 26.55 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.351 2.034 . . . . 0.0 112.089 179.212 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' TRP . . . . . 0.405 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -113.95 -169.34 1.5 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.292 -178.921 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.708 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 8.4 tt -118.34 156.58 20.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 N-CA-C 112.643 0.608 . . . . 0.0 112.643 -179.155 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.436 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -119.78 -36.46 3.3 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.763 -179.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.465 ' CG ' ' HB3' ' A' ' 40' ' ' HIS . 6.4 ptp180 -140.07 153.44 46.76 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 120.501 -0.48 . . . . 0.0 111.406 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.455 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 30.8 tt0 -146.41 153.62 40.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.289 -179.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.417 ' HE1' ' CD2' ' A' ' 38' ' ' TYR . 20.0 ttp -142.16 111.96 6.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.566 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -95.34 126.45 40.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.957 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.434 ' HB2' ' CE2' ' A' ' 38' ' ' TYR . 1.4 mp -123.41 113.77 19.25 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.775 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 56' ' ' LYS . 0.7 OUTLIER -134.49 135.53 23.93 Favored Pre-proline 0 C--N 1.332 -0.194 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.974 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.56 -28.11 35.34 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.51 2.14 . . . . 0.0 112.319 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -102.31 -19.72 14.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.149 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 53' ' ' HIS . 5.3 mmmt -117.82 122.32 30.76 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.727 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -52.89 164.92 1.38 Allowed 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.531 2.154 . . . . 0.0 112.237 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -57.11 88.57 0.04 OUTLIER 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.641 2.227 . . . . 0.0 112.381 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.2 mt -69.59 94.54 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.147 0.498 . . . . 0.0 110.496 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.461 ' CD2' ' CZ3' ' A' ' 97' ' ' TRP . 0.8 OUTLIER -84.42 107.36 16.64 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.978 -179.626 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 29.0 mt -107.68 161.0 15.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.94 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.9 p -153.31 139.84 12.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.085 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.53 137.4 48.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.165 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 100.98 -40.46 2.41 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.438 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.87 -32.2 9.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.781 0.324 . . . . 0.0 110.853 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -132.0 44.28 2.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.886 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -59.47 -30.56 68.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.911 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 2.4 mtp -84.91 -29.8 24.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.092 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -78.3 -55.74 5.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.962 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.6 ptm -59.81 -178.12 0.07 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.032 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 2.2 t -62.29 118.25 7.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.759 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -98.91 6.41 46.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.459 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -102.74 -175.04 2.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.916 0.389 . . . . 0.0 111.114 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . 0.413 ' ND2' ' O ' ' A' ' 44' ' ' PRO . 21.0 t-20 -109.42 160.41 16.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.25 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -43.87 -37.4 2.81 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -70.77 -56.1 7.12 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.838 0.351 . . . . 0.0 111.73 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -71.37 -16.3 62.41 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -64.82 -62.15 1.74 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.79 0.329 . . . . 0.0 111.092 -179.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 122.0 -26.5 6.44 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.256 -179.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -48.92 -42.67 37.96 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.993 0.425 . . . . 0.0 110.649 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 39.0 p -70.41 -28.32 64.97 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.372 179.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 8.0 mmm-85 -96.25 6.43 48.81 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.019 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.435 ' HB3' ' HB1' ' A' ' 86' ' ' ALA . 0.4 OUTLIER -93.81 31.25 1.63 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.695 0.284 . . . . 0.0 111.277 -179.754 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 55.02 72.84 0.45 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.974 0.416 . . . . 0.0 111.263 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.72 65.42 3.56 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.888 -0.673 . . . . 0.0 113.115 179.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . 0.435 ' HB1' ' HB3' ' A' ' 83' ' ' LYS . . . -93.85 32.15 1.5 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.84 0.352 . . . . 0.0 111.009 179.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -86.87 147.36 25.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.975 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.463 ' CG1' ' N ' ' A' ' 89' ' ' LEU . 1.5 tt -130.01 159.44 42.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.802 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.463 ' N ' ' CG1' ' A' ' 88' ' ' ILE . 0.4 OUTLIER -82.0 146.4 55.39 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.018 -179.908 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -62.51 -26.5 76.25 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.526 2.151 . . . . 0.0 112.508 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.7 -50.5 73.22 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.918 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -66.4 -41.52 89.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.943 0.401 . . . . 0.0 110.943 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -57.93 -53.75 54.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.739 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.37 -20.86 62.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.48 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -60.14 -50.29 74.27 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 178.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 18.5 mm -73.02 -33.28 42.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.307 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.461 ' CZ3' ' CD2' ' A' ' 60' ' ' LEU . 4.2 t-105 -54.79 -36.56 65.05 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.881 178.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.407 ' HG3' HD13 ' A' ' 103' ' ' ILE . 1.9 mp0 -85.41 -31.16 23.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.584 179.342 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -56.78 -54.61 44.38 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.584 -179.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 42.3 t -82.37 -79.14 0.19 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.032 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 170.34 38.25 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.557 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . 0.438 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -58.97 -50.77 64.21 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.575 -0.822 . . . . 0.0 112.182 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.407 HD13 ' HG3' ' A' ' 98' ' ' GLU . 3.3 mp -56.37 -53.07 44.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.842 0.354 . . . . 0.0 111.092 179.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -56.37 -39.84 73.57 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.994 0.426 . . . . 0.0 110.336 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -65.19 -45.36 85.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.062 179.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.05 -43.31 99.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.261 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.414 ' HA ' ' HB ' ' A' ' 110' ' ' ILE . 1.4 mm-40 -63.31 -29.83 71.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.722 179.679 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 40.4 t -67.64 -50.53 57.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.705 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.81 -35.03 67.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.487 0.66 . . . . 0.0 109.503 178.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.44 ' CG1' HG23 ' A' ' 121' ' ' THR . 13.4 mt -57.57 -49.49 80.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.456 179.285 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -72.34 -37.93 68.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.6 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 3.1 m -68.88 -13.39 62.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.073 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 77.26 30.81 0.51 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.902 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -100.75 -29.43 12.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.561 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -80.88 143.05 33.0 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.927 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -99.51 118.63 61.85 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.795 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.62 88.68 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.529 2.153 . . . . 0.0 112.504 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 97.6 m -110.56 -70.3 0.82 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.557 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -147.7 -53.54 0.21 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.745 179.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.78 -44.66 95.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.875 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.44 HG23 ' CG1' ' A' ' 110' ' ' ILE . 0.7 OUTLIER -60.72 -49.1 78.85 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.466 179.702 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.8 -48.03 82.48 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.367 0.603 . . . . 0.0 110.153 179.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.57 -38.52 69.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.527 179.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.67 -44.29 86.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.988 179.163 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -50.9 -39.59 54.62 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.924 179.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -81.44 -32.55 32.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.113 179.012 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 tp -60.01 -19.74 54.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.489 179.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.4 mt . . . . . 0 C--N 1.332 -0.176 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.032 179.972 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.782 0.325 . . . . 0.0 110.878 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -70.24 130.34 41.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.072 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.445 ' HG3' ' CZ ' ' A' ' 119' ' ' TYR . 69.8 mm-40 -111.79 108.52 17.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.883 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 0.477 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 13.1 mtp180 -109.8 130.52 55.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.905 0.384 . . . . 0.0 110.915 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . 0.515 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 0.8 OUTLIER -115.67 134.85 54.63 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.996 179.879 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.477 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 5.9 m-85 -139.58 155.62 47.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.404 0.621 . . . . 0.0 112.313 -178.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.438 ' HG3' ' CD2' ' A' ' 38' ' ' TYR . 0.4 OUTLIER -149.26 144.86 26.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.519 179.122 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.423 ' CG2' ' CD ' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -136.13 125.58 15.94 Favored Pre-proline 0 C--N 1.327 -0.408 0 C-N-CA 120.893 -0.323 . . . . 0.0 111.834 -179.345 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.42 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 73.8 Cg_endo -89.2 96.92 0.34 Allowed 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.928 2.419 . . . . 0.0 111.664 179.337 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -119.17 153.81 34.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.973 0.416 . . . . 0.0 111.269 -179.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.445 HG12 ' HG2' ' A' ' 34' ' ' LYS . 11.2 mt -101.95 140.02 21.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.065 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.9 mtp180 -59.9 133.92 89.75 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.417 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.476 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 50.2 Cg_exo -53.59 -52.05 9.46 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.533 2.155 . . . . 0.0 113.0 -179.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.537 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -53.64 -58.78 5.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.522 -179.494 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.51 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 3.4 m-20 -67.71 -28.71 67.9 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.88 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.405 ' HB3' ' O ' ' A' ' 22' ' ' PRO . 0.1 OUTLIER -53.09 -57.34 10.73 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.599 -179.405 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.537 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.9 p90 -87.28 -17.19 33.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.562 -179.432 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.51 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -58.53 -53.23 60.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.899 0.381 . . . . 0.0 110.813 179.684 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -159.75 143.75 10.78 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.17 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -73.2 -7.96 21.31 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.604 2.203 . . . . 0.0 112.724 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -110.48 -36.59 5.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.901 0.382 . . . . 0.0 110.873 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -99.59 32.07 2.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.854 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.33 -30.04 61.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.935 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 42.6 mmtt 58.21 100.9 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.979 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.445 ' HG2' HG12 ' A' ' 20' ' ' ILE . 0.2 OUTLIER -85.0 119.79 25.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.917 179.966 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.415 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -105.85 143.79 15.75 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.907 -179.81 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.42 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 7.3 m-90 -108.99 137.44 46.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.811 0.338 . . . . 0.0 110.907 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 31.9 t90 -118.79 117.22 28.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.5 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.438 ' CD2' ' HG3' ' A' ' 16' ' ' ARG . 22.1 m-85 -111.61 149.29 31.69 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.778 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.433 ' HB3' ' CE1' ' A' ' 41' ' ' PHE . . . -170.37 124.85 0.73 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.088 0.471 . . . . 0.0 111.294 179.815 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.515 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 9.7 t-160 -95.27 103.78 15.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.673 179.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.589 ' CD2' ' HB ' ' A' ' 46' ' ' ILE . 4.4 m-85 -89.58 128.84 36.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.164 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.418 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 7.7 p-10 -96.65 114.43 26.07 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 178.623 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 58.23 -137.34 50.09 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.015 -1.088 . . . . 0.0 111.107 -178.505 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo -71.71 -16.46 29.95 Favored 'Trans proline' 0 CA--C 1.529 0.261 0 C-N-CA 122.503 2.135 . . . . 0.0 112.434 179.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' TRP . . . . . 0.408 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -114.73 -171.76 1.99 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.891 0.377 . . . . 0.0 111.804 -178.574 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.589 ' HB ' ' CD2' ' A' ' 41' ' ' PHE . 6.7 tt -131.24 153.86 39.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.875 -179.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.415 ' N ' HG12 ' A' ' 46' ' ' ILE . . . -132.28 -20.59 2.39 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.811 -0.631 . . . . 0.0 112.317 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.426 ' NE ' ' CB ' ' A' ' 120' ' ' ALA . 4.6 mtm180 -129.03 136.26 50.06 Favored 'General case' 0 C--N 1.334 -0.079 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.052 -179.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.97 122.92 15.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.087 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.417 ' HE1' ' CE1' ' A' ' 93' ' ' PHE . 5.2 ttm -125.07 112.59 16.69 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.7 179.732 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.49 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -95.27 133.29 39.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.099 -179.774 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.421 HD11 ' CD1' ' A' ' 38' ' ' TYR . 30.3 mt -135.13 108.77 7.96 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.735 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.415 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 1.7 m-70 -128.39 135.78 28.08 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 120.699 0.285 . . . . 0.0 111.057 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -54.21 -23.46 29.83 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.534 2.156 . . . . 0.0 112.161 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -104.5 -21.42 13.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.04 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 1.2 mmmm -119.12 125.17 27.78 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.754 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.75 167.58 0.6 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.49 2.126 . . . . 0.0 112.357 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.417 ' HA ' ' O ' ' A' ' 51' ' ' GLU . 20.0 Cg_endo -60.61 88.4 0.08 OUTLIER 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.718 2.279 . . . . 0.0 112.358 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.49 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 58.3 mt -64.97 105.83 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.814 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.454 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.2 OUTLIER -82.11 122.74 28.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.02 -179.905 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 91.1 mt -134.83 151.25 50.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.93 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.8 p -154.2 148.16 13.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.071 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.4 ' CB ' ' HA ' ' A' ' 47' ' ' ALA . . . -60.39 140.17 57.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.957 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.97 -46.78 1.56 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.381 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.32 -55.91 3.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.876 0.369 . . . . 0.0 110.69 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -109.74 37.63 2.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.775 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -54.14 -28.71 41.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.048 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -83.42 -28.91 28.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.84 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -77.45 -51.12 11.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.922 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.1 ptp -50.18 175.87 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.832 0.349 . . . . 0.0 111.179 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 0.423 ' O ' ' CB ' ' A' ' 72' ' ' GLU . 0.9 OUTLIER -55.64 -49.21 73.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.049 -179.86 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . 0.423 ' CB ' ' O ' ' A' ' 71' ' ' CYS . 20.1 tt0 83.47 -40.58 0.09 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.345 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.2 mmtt -56.28 -168.74 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.007 0.432 . . . . 0.0 111.13 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -109.78 -174.99 2.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.969 179.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.408 ' CD2' ' HB2' ' A' ' 41' ' ' PHE . 0.1 OUTLIER -60.1 -53.96 51.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.708 0.289 . . . . 0.0 111.643 -179.406 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -71.03 -53.39 14.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.812 0.339 . . . . 0.0 111.846 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -49.08 -36.8 19.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.186 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' THR . . . . . 0.405 ' HB ' ' CD2' ' A' ' 80' ' ' LEU . 0.9 OUTLIER -62.26 -65.86 0.63 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.755 0.312 . . . . 0.0 111.22 -179.569 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 130.43 -5.47 5.92 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.901 -179.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.457 ' HG ' ' HB2' ' A' ' 15' ' ' PHE . 3.8 mm? -53.26 -40.32 64.55 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.142 0.496 . . . . 0.0 110.23 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 11.4 p -81.05 -33.09 33.74 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.599 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -56.06 -32.26 63.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.558 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.423 ' CD ' ' CG2' ' A' ' 17' ' ' ILE . 1.9 tttp -72.27 179.81 3.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.732 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -96.73 75.25 2.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.893 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 80.42 67.47 1.55 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.631 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -97.93 20.15 12.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.771 0.32 . . . . 0.0 111.217 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -89.18 151.14 22.34 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.157 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.424 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 1.5 pt -133.83 159.44 42.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.11 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.69 151.71 91.32 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.861 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -72.5 -24.72 18.7 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.765 2.31 . . . . 0.0 112.815 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.72 -46.78 80.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.75 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -67.68 -38.45 83.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.768 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.417 ' CE1' ' HE1' ' A' ' 50' ' ' MET . 25.2 t80 -57.98 -53.23 60.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.817 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -72.28 -21.86 61.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.644 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.26 -50.49 73.82 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.061 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.412 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 17.2 mm -73.0 -33.73 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.168 178.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' TRP . . . . . 0.45 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 10.3 t-105 -53.78 -39.28 65.29 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.097 179.071 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -85.92 -27.2 25.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.8 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.412 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 5.8 mtm180 -56.59 -43.97 80.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.098 -179.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 42.5 t -93.89 -79.61 0.41 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.871 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 176.12 36.77 0.05 OUTLIER Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.569 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . 0.454 ' HA2' ' CD2' ' A' ' 60' ' ' LEU . . . -59.33 -50.73 64.6 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.391 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.438 HG12 ' CD2' ' A' ' 127' ' ' LEU . 3.3 mp -57.66 -50.01 78.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 120.761 0.315 . . . . 0.0 111.13 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -56.29 -44.41 79.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.933 0.397 . . . . 0.0 110.51 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -62.13 -46.29 89.68 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.14 179.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.02 -40.48 95.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.338 179.486 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.05 -29.75 70.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.687 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 35.7 t -69.28 -50.31 48.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.658 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.54 -35.33 68.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.452 0.644 . . . . 0.0 109.567 178.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.448 ' CG1' HG23 ' A' ' 121' ' ' THR . 13.1 mt -58.26 -49.4 81.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.426 179.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -72.56 -38.6 67.91 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.597 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 1.7 m -66.6 -15.67 63.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.184 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 77.16 34.97 0.37 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.972 0.415 . . . . 0.0 110.89 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 49.6 mm-40 -107.16 -28.19 10.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.626 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.67 151.25 39.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.029 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -107.38 108.98 62.49 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.95 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -46.29 92.18 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.68 2.253 . . . . 0.0 112.699 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 14.2 m -112.72 -55.69 2.49 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.742 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' TYR . . . . . 0.445 ' CZ ' ' HG3' ' A' ' 12' ' ' GLN . 51.0 t80 -166.55 -57.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.909 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.426 ' CB ' ' NE ' ' A' ' 48' ' ' ARG . . . -54.51 -43.08 71.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.054 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.448 HG23 ' CG1' ' A' ' 110' ' ' ILE . 9.2 p -58.41 -49.0 78.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.425 179.644 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.98 -49.95 75.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.38 0.61 . . . . 0.0 109.6 178.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -55.95 -30.85 62.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.069 178.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.404 ' CD2' HG21 ' A' ' 103' ' ' ILE . 0.2 OUTLIER -70.02 -46.52 64.91 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.852 178.979 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 59.6 mm-40 -51.45 -38.65 54.79 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.027 179.142 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -77.82 -36.03 50.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.05 179.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.438 ' CD2' HG12 ' A' ' 103' ' ' ILE . 0.4 OUTLIER -61.34 -18.2 57.51 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.408 178.937 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.162 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.953 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.842 0.353 . . . . 0.0 111.092 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.402 ' O ' ' CD1' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -54.22 -56.91 13.7 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.703 179.813 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.16 -36.77 78.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.052 179.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.406 ' NE2' ' HA ' ' A' ' 4' ' ' GLN . 5.4 tp60 -56.31 -33.84 65.96 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.334 179.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.1 -57.15 4.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.059 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.402 ' CD1' ' O ' ' A' ' 2' ' ' ARG . 3.6 mp -56.49 -62.27 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.942 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 24.1 t0 48.15 93.53 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.217 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 2.0 mtm -78.78 65.39 3.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.61 0.719 . . . . 0.0 110.676 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.5 mttm -146.45 36.88 1.0 Allowed 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.777 -1.101 . . . . 0.0 110.955 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.47 -175.78 3.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.792 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.49 138.43 35.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.784 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.453 ' CG ' ' CE2' ' A' ' 119' ' ' TYR . 7.7 mp0 -124.5 115.76 21.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.994 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.45 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 8.1 mmt85 -134.58 130.79 37.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.002 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.519 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 0.2 OUTLIER -121.58 137.61 54.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.133 179.792 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.464 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -144.09 167.01 23.39 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.292 0.567 . . . . 0.0 112.007 -179.824 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.426 ' HB2' ' CD2' ' A' ' 38' ' ' TYR . 7.2 ptm180 -149.09 153.47 37.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.525 178.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -153.47 113.39 2.62 Favored Pre-proline 0 C--N 1.328 -0.365 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.612 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.422 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 75.5 Cg_endo -87.65 98.97 0.45 Allowed 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 123.026 2.484 . . . . 0.0 112.214 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -118.53 141.83 48.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.96 0.409 . . . . 0.0 111.076 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.421 HG23 ' N ' ' A' ' 21' ' ' ARG . 14.6 mt -87.1 147.41 5.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.217 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.426 ' HD2' ' CE1' ' A' ' 53' ' ' HIS . 5.4 mtt180 -69.17 133.47 89.64 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.985 179.259 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.502 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 12.0 Cg_endo -55.76 -49.27 16.31 Favored 'Trans proline' 0 N--CA 1.464 -0.215 0 C-N-CA 122.524 2.15 . . . . 0.0 112.462 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.532 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -51.17 -58.69 5.48 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.307 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.493 ' HA ' ' CG ' ' A' ' 27' ' ' LYS . 1.2 m-20 -69.68 -30.29 67.91 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.094 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.17 -46.15 68.81 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.668 -179.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.532 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.3 p90 -98.85 -36.45 9.78 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -177.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 23' ' ' ALA . 6.5 ptmt -60.95 -32.23 71.77 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.537 -0.465 . . . . 0.0 111.303 -178.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.416 ' CB ' ' HB2' ' A' ' 31' ' ' ASN . 43.4 m-20 -155.56 117.13 2.32 Favored Pre-proline 0 C--N 1.329 -0.316 0 C-N-CA 121.014 -0.274 . . . . 0.0 111.426 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -66.69 -24.4 47.76 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.418 2.078 . . . . 0.0 112.187 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.1 mp0 -94.58 -43.17 8.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.636 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.416 ' HB2' ' CB ' ' A' ' 28' ' ' ASP . 27.3 m-80 -88.16 53.96 2.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.439 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.429 ' HD3' ' O ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -119.62 70.19 0.85 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.253 -179.563 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.9 mmpt? -40.9 133.27 2.17 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.246 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.404 ' HD2' HG12 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -97.52 124.21 41.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.719 -179.773 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -99.68 129.35 9.87 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.586 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.453 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 21.3 m-90 -102.03 124.79 48.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.955 0.407 . . . . 0.0 110.728 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 82.6 t90 -114.69 117.01 29.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.149 -179.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.468 ' HB2' ' HG3' ' A' ' 50' ' ' MET . 1.0 OUTLIER -117.84 148.89 41.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.087 179.216 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.431 ' HB3' ' NE2' ' A' ' 49' ' ' GLN . . . -157.31 124.68 5.23 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.126 0.489 . . . . 0.0 111.723 -179.104 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.519 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 9.5 t-160 -97.64 93.38 6.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.066 178.75 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.555 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 21.7 m-85 -77.53 149.36 34.92 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.535 -179.025 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.472 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 86.8 m-20 -122.83 110.81 15.91 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.08 178.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 61.9 -134.01 46.54 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 119.921 -1.133 . . . . 0.0 111.074 -178.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.423 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.4 Cg_exo -73.68 -14.65 24.51 Favored 'Trans proline' 0 CA--C 1.53 0.294 0 C-N-CA 122.448 2.099 . . . . 0.0 112.644 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' TRP . . . . . 0.423 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 0.6 OUTLIER -121.93 -162.89 1.02 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.665 -178.413 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.555 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 2.2 tt -135.21 154.45 35.85 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.129 0 CA-C-O 121.028 0.442 . . . . 0.0 111.688 -179.661 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.423 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -126.55 -19.14 4.65 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.267 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.427 ' HB3' ' CZ ' ' A' ' 93' ' ' PHE . 7.2 mtm180 -128.73 133.56 48.17 Favored 'General case' 0 C--O 1.23 0.055 0 CA-C-O 120.951 0.405 . . . . 0.0 111.084 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.431 ' NE2' ' HB3' ' A' ' 39' ' ' ALA . 0.0 OUTLIER -142.08 137.53 31.08 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.924 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.468 ' HG3' ' HB2' ' A' ' 38' ' ' TYR . 0.6 OUTLIER -146.82 128.5 15.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.614 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -117.36 138.76 51.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.196 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.7 mt -135.12 120.77 19.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.055 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.426 ' CE1' ' HD2' ' A' ' 21' ' ' ARG . 0.3 OUTLIER -133.61 131.62 21.37 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.5 179.701 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -48.21 -27.05 8.93 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.639 2.226 . . . . 0.0 112.697 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -106.66 -13.87 15.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.27 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.62 120.97 30.25 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.797 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -49.83 168.21 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.585 2.19 . . . . 0.0 112.506 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -60.32 96.96 0.11 Allowed 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.552 2.168 . . . . 0.0 112.405 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 7.8 mt -79.1 96.04 2.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.079 0.466 . . . . 0.0 110.755 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.484 ' CD2' ' CZ3' ' A' ' 97' ' ' TRP . 1.0 OUTLIER -86.83 116.37 24.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.797 -179.903 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.411 ' HB2' ' HB3' ' A' ' 49' ' ' GLN . 20.1 mt -119.76 151.89 38.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.952 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.433 ' CG2' ' CE2' ' A' ' 105' ' ' TYR . 16.1 m -143.42 158.5 17.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.114 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.47 148.22 52.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.126 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.51 -55.6 4.18 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.526 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.4 mttm -80.28 -67.02 0.81 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.864 0.364 . . . . 0.0 110.871 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -97.24 39.82 1.17 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.819 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.85 -28.63 61.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.016 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -82.88 -27.18 30.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.901 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -82.45 -54.39 5.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.102 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.0 ptp -56.59 174.32 0.15 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.096 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.83 128.12 35.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.989 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.17 43.18 1.41 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.798 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.31 131.45 16.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.801 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -53.96 167.82 0.25 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.017 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.446 HD21 ' CD2' ' A' ' 41' ' ' PHE . 2.6 mm? -44.04 -53.57 6.2 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.155 -179.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -70.38 -32.03 69.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.966 -179.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -80.09 -11.17 59.79 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.82 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.433 HG22 ' CZ ' ' A' ' 41' ' ' PHE . 0.1 OUTLIER -74.41 -67.19 0.65 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.88 0.372 . . . . 0.0 111.054 -179.947 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 124.84 -27.94 5.3 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.287 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.445 HD11 ' CG ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -59.55 -35.0 73.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.999 0.428 . . . . 0.0 110.382 179.684 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.47 -40.97 89.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.56 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 13.8 mtt180 -67.35 -28.86 68.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.857 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.7 mtpt -55.28 -176.41 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.972 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.44 76.74 5.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.206 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 72.56 66.83 1.97 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.968 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -83.83 -17.62 40.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.764 0.316 . . . . 0.0 110.954 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.433 ' HA ' ' O ' ' A' ' 14' ' ' PHE . 0.6 OUTLIER -52.27 160.16 0.84 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.932 0.396 . . . . 0.0 111.645 -179.708 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.424 HG22 ' CG ' ' A' ' 16' ' ' ARG . 1.5 pp -149.73 -179.72 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.899 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.2 mp -98.69 148.18 34.2 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.668 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -65.64 -22.0 58.4 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.62 2.213 . . . . 0.0 112.443 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.33 -40.32 93.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.046 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -69.85 -45.57 67.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.905 0.383 . . . . 0.0 110.936 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.427 ' CZ ' ' HB3' ' A' ' 48' ' ' ARG . 14.0 t80 -57.38 -51.59 68.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.746 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.03 -22.83 63.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.78 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.11 -50.45 71.85 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.123 0.487 . . . . 0.0 109.793 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 20.6 mm -76.98 -33.97 21.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.757 179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.484 ' CZ3' ' CD2' ' A' ' 60' ' ' LEU . 3.4 t-105 -52.42 -41.13 62.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.997 179.464 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -86.33 -30.55 22.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.633 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.83 -29.88 63.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.341 -179.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 16.2 m -107.23 -77.9 0.59 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.201 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 172.85 33.57 0.03 OUTLIER Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.621 -0.799 . . . . 0.0 112.743 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.465 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -60.08 -48.54 85.61 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.311 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.414 ' HA ' ' CD1' ' A' ' 124' ' ' LEU . 3.6 mp -52.86 -42.53 43.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.816 0.341 . . . . 0.0 111.102 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.91 -44.86 96.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.018 0.437 . . . . 0.0 110.282 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.433 ' CE2' ' CG2' ' A' ' 62' ' ' VAL . 10.6 t80 -62.58 -43.12 99.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.359 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.406 ' HB3' ' CD2' ' A' ' 124' ' ' LEU . 0.5 OUTLIER -66.0 -44.6 84.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.89 179.883 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -61.11 -29.92 70.05 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.987 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.61 -50.44 30.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.894 -179.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.41 -31.66 65.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.443 0.64 . . . . 0.0 109.746 179.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.463 ' CD1' HD21 ' A' ' 124' ' ' LEU . 9.3 mt -57.91 -49.01 82.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-N 115.063 -0.972 . . . . 0.0 110.448 179.263 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -70.61 -36.71 73.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.605 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 6.4 p -77.45 -6.61 54.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.214 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 27.6 mmt85 67.89 31.54 5.65 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.864 0.364 . . . . 0.0 110.9 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -107.94 -28.85 9.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.665 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.12 -21.54 59.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.329 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 65.35 82.09 0.21 Allowed Pre-proline 0 C--N 1.332 -0.171 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.851 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.424 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 1.1 Cg_endo -45.36 97.48 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.854 2.37 . . . . 0.0 112.46 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 19.3 m -117.34 -55.81 2.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.91 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.453 ' CE2' ' CG ' ' A' ' 12' ' ' GLN . 8.2 t80 -160.32 -52.26 0.05 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.189 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.404 ' CB ' ' NE ' ' A' ' 48' ' ' ARG . . . -56.87 -41.88 78.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.313 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.424 ' OG1' ' HA ' ' A' ' 117' ' ' PRO . 80.6 p -57.93 -49.25 77.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.559 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.24 -49.02 78.8 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.353 0.597 . . . . 0.0 109.56 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -57.49 -32.56 67.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.855 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.463 HD21 ' CD1' ' A' ' 110' ' ' ILE . 0.4 OUTLIER -68.6 -46.1 70.22 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.026 179.035 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -51.47 -39.54 57.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.804 -0.634 . . . . 0.0 109.974 179.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 43.2 m-20 -78.94 -32.1 45.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.292 179.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.2 tp -74.14 -7.34 52.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.925 179.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 38.6 mt -75.34 -25.13 57.52 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.098 -179.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.158 -0.925 . . . . 0.0 111.007 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.883 0.373 . . . . 0.0 110.953 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -64.27 1.0 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.679 179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.503 ' HA ' HD11 ' A' ' 6' ' ' ILE . 3.0 tp60 -53.38 -41.49 65.95 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.727 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -59.76 -32.07 70.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.588 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.411 ' HG3' ' HB2' ' A' ' 117' ' ' PRO . 1.5 tp10 -76.41 -50.75 13.35 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.837 179.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.503 HD11 ' HA ' ' A' ' 3' ' ' GLN . 3.0 mp -58.67 -63.06 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.407 0.622 . . . . 0.0 109.987 178.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.6 t70 46.75 91.12 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.503 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.431 ' HG2' ' CD2' ' A' ' 119' ' ' TYR . 0.0 OUTLIER -67.02 -80.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.787 179.921 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.2 mmtp 48.11 43.67 18.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.274 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 84.8 mtt-85 -151.34 162.87 40.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.996 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -76.44 163.67 26.73 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.818 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.5 mp0 -121.43 103.0 8.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.041 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.489 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -116.99 122.09 43.25 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.613 -179.88 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.506 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 2.2 m-85 -108.51 148.71 29.84 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.677 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.489 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 1.8 m-85 -146.74 149.57 33.65 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.38 0.609 . . . . 0.0 112.186 -179.449 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.45 ' HG3' ' CE2' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -148.69 136.67 20.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.229 179.198 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -141.67 131.91 12.86 Favored Pre-proline 0 C--N 1.329 -0.305 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -90.52 115.52 0.52 Allowed 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 123.183 2.589 . . . . 0.0 111.722 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.438 ' N ' ' CD1' ' A' ' 19' ' ' PHE . 2.1 p90 -134.08 149.56 51.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.89 0.376 . . . . 0.0 110.908 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.402 ' CG2' ' HB2' ' A' ' 32' ' ' LYS . 12.3 mt -98.77 140.59 18.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.122 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.5 mtp180 -65.01 124.53 86.96 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.296 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.487 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 86.2 Cg_exo -46.43 -50.36 10.41 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.523 2.149 . . . . 0.0 112.853 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.544 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -50.24 -58.46 5.56 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.118 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.506 ' HA ' ' CG ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -68.66 -31.37 70.45 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.161 179.838 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.07 -45.48 68.14 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.757 -178.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.544 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.2 p90 -98.08 -36.6 10.04 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -177.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.527 ' HG2' ' O ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -59.88 -31.88 70.2 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.353 -179.068 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.427 ' CB ' ' HB2' ' A' ' 31' ' ' ASN . 28.0 m-20 -153.59 125.67 3.84 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 120.835 -0.346 . . . . 0.0 111.475 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -72.97 -28.73 12.77 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.487 2.125 . . . . 0.0 112.014 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.4 mm-40 -94.02 -44.04 8.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.449 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.427 ' HB2' ' CB ' ' A' ' 28' ' ' ASP . 44.5 m-20 -85.67 55.14 3.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.409 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.443 ' HD3' ' O ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -122.33 68.77 0.95 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.089 -179.707 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.5 mmpt? -41.5 135.72 2.0 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.123 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.15 109.84 22.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.856 -179.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.407 ' O ' ' CD1' ' A' ' 19' ' ' PHE . . . -83.76 123.63 6.26 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.332 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 8.1 m-90 -98.13 132.57 43.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.796 0.331 . . . . 0.0 110.784 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 27.2 t90 -114.06 117.86 32.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.259 -179.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.45 ' CE2' ' HG3' ' A' ' 16' ' ' ARG . 3.3 m-85 -110.1 149.72 29.63 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.006 179.345 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.537 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . . . -170.34 124.81 0.73 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.162 0.506 . . . . 0.0 112.132 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.506 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 20.1 t-160 -96.9 99.62 11.17 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.623 178.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.569 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 18.3 m-85 -85.65 119.95 26.54 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.497 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.431 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 12.1 p-10 -88.18 110.86 21.03 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.38 -136.29 49.48 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 119.954 -1.117 . . . . 0.0 110.842 -178.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.406 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 8.9 Cg_exo -72.09 -16.46 28.69 Favored 'Trans proline' 0 CA--C 1.531 0.33 0 C-N-CA 122.407 2.071 . . . . 0.0 112.335 179.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' TRP . . . . . 0.414 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.8 OUTLIER -115.81 -173.51 2.36 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.773 0.32 . . . . 0.0 111.795 -178.491 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.569 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 3.6 tt -131.02 153.04 38.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 121.227 0.537 . . . . 0.0 112.211 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.4 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -130.33 -22.6 2.76 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.739 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 -127.88 140.3 52.1 Favored 'General case' 0 N--CA 1.461 0.084 0 CA-C-O 120.778 0.323 . . . . 0.0 111.159 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.537 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 18.0 tt0 -153.44 136.39 15.45 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.003 0.43 . . . . 0.0 111.136 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.412 ' HG2' ' CZ3' ' A' ' 97' ' ' TRP . 0.0 OUTLIER -136.61 132.65 35.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.63 179.724 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.476 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 0.3 OUTLIER -119.32 125.91 50.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.815 179.865 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.447 ' CD1' ' CE1' ' A' ' 38' ' ' TYR . 0.8 OUTLIER -125.54 113.53 17.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.965 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 14.6 m80 -122.23 133.89 24.56 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.703 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -50.69 -24.35 12.87 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.405 2.07 . . . . 0.0 112.518 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -106.38 -22.15 12.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.244 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 4.9 mmtt -115.18 125.95 28.34 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.985 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -49.49 167.55 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.425 2.083 . . . . 0.0 112.614 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -60.89 84.07 0.08 OUTLIER 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.715 2.277 . . . . 0.0 112.418 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.476 ' HB ' ' HB2' ' A' ' 51' ' ' GLU . 21.5 mt -60.44 106.73 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.679 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.456 ' HG ' ' CH2' ' A' ' 97' ' ' TRP . 0.9 OUTLIER -83.86 117.31 23.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.949 -179.78 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.452 ' HB3' ' HB3' ' A' ' 49' ' ' GLN . 1.5 mm? -117.14 146.86 42.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.786 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.5 p -155.11 156.66 4.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.338 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -72.66 138.79 46.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.758 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.21 -62.74 2.82 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.242 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.441 ' HB2' ' HA ' ' A' ' 115' ' ' ALA . 2.2 tmtp? -67.4 -35.16 78.74 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.992 0.425 . . . . 0.0 110.512 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.411 ' HB3' ' HB2' ' A' ' 69' ' ' GLU . 71.9 m-20 -134.43 58.23 1.78 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.776 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -66.91 -21.6 65.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.35 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -85.34 -38.79 18.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.838 0.352 . . . . 0.0 110.871 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.411 ' HB2' ' HB3' ' A' ' 66' ' ' ASP . 0.3 OUTLIER -80.13 -33.82 38.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.896 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.405 ' N ' HD12 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -48.66 170.09 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.021 -179.997 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 9.3 t -64.47 -40.75 96.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.184 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 77.09 -66.44 0.24 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.947 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.43 171.7 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.314 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -96.78 -169.67 1.92 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.668 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.443 HD22 ' CE1' ' A' ' 15' ' ' PHE . 64.9 mt -66.28 -44.75 82.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.585 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -70.06 -31.21 68.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.462 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -85.31 -24.35 27.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.613 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.451 HG23 ' CE2' ' A' ' 41' ' ' PHE . 0.7 OUTLIER -63.81 -77.04 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.758 0.313 . . . . 0.0 111.196 -179.781 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.401 ' HA2' ' CG ' ' A' ' 82' ' ' ARG . . . 140.49 -18.17 2.85 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.55 -0.833 . . . . 0.0 113.104 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.82 -51.21 60.86 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.929 0.395 . . . . 0.0 110.828 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.442 HG21 ' CE2' ' A' ' 15' ' ' PHE . 54.8 p -56.02 -52.69 63.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.153 -179.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.401 ' CG ' ' HA2' ' A' ' 79' ' ' GLY . 1.4 ppt_? -62.29 -27.71 69.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.67 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 10.7 tttt -59.95 -168.56 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.796 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -90.91 77.79 6.12 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.536 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 55.04 69.12 1.36 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.327 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -89.6 22.54 2.97 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.98 179.51 4.91 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.761 0.315 . . . . 0.0 110.721 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.459 ' CG1' ' N ' ' A' ' 89' ' ' LEU . 3.8 tt -159.58 159.07 2.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.074 0.464 . . . . 0.0 111.103 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.459 ' N ' ' CG1' ' A' ' 88' ' ' ILE . 4.2 mp -73.42 146.41 86.37 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.811 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.5 -30.8 14.62 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.533 2.155 . . . . 0.0 112.309 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.71 -38.48 73.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.935 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -69.23 -48.28 62.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.845 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.404 ' CZ ' ' CG ' ' A' ' 50' ' ' MET . 14.2 t80 -55.23 -52.97 61.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.549 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -22.68 64.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.478 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -50.37 73.97 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.172 0.511 . . . . 0.0 109.687 179.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.403 ' HB ' ' CE ' ' A' ' 50' ' ' MET . 18.2 mm -71.47 -32.96 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.323 179.24 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.456 ' CH2' ' HG ' ' A' ' 60' ' ' LEU . 16.9 t-105 -57.69 -36.74 72.35 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.752 178.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.42 ' CG ' HD13 ' A' ' 103' ' ' ILE . 1.0 OUTLIER -85.11 -25.69 27.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.227 179.136 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 25.0 ttt85 -61.56 -53.62 53.98 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.272 -179.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -81.2 -84.66 0.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.084 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -173.44 36.39 0.13 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.444 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.403 ' HA3' ' CE2' ' A' ' 97' ' ' TRP . . . -54.31 -61.3 7.35 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.538 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.42 HD13 ' CG ' ' A' ' 98' ' ' GLU . 3.1 mp -55.31 -46.31 78.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.695 0.283 . . . . 0.0 111.681 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -58.99 -49.26 78.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.941 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -60.76 -50.91 71.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.411 179.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.65 -44.79 85.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.787 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.401 ' HG2' ' CD2' ' A' ' 124' ' ' LEU . 1.8 mm100 -61.43 -29.93 70.25 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.844 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 32.6 t -68.31 -50.67 51.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.968 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -75.13 -32.37 61.33 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.307 0.575 . . . . 0.0 109.784 179.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.417 ' CG1' HG23 ' A' ' 121' ' ' THR . 7.0 mt -57.71 -48.68 82.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.264 179.353 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -72.42 -36.06 68.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.72 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.5 -8.31 56.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.327 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 15.6 mmt85 72.0 46.6 0.34 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.005 0.431 . . . . 0.0 110.958 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 9.2 mm-40 -122.37 -40.41 2.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.67 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.441 ' HA ' ' HB2' ' A' ' 65' ' ' LYS . . . -59.3 -19.88 49.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.413 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 62.96 118.1 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.577 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.411 ' HB2' ' HG3' ' A' ' 5' ' ' GLU . 72.3 Cg_exo -49.22 90.9 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.409 2.073 . . . . 0.0 112.625 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 10.8 t -119.35 -165.07 1.11 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.513 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.431 ' CD2' ' HG2' ' A' ' 8' ' ' MET . 13.9 t80 -64.45 -47.62 78.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.733 0.302 . . . . 0.0 110.778 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -60.06 -52.08 66.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.273 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.417 HG23 ' CG1' ' A' ' 110' ' ' ILE . 80.3 p -57.83 -49.13 77.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.594 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.25 -54.02 51.47 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.525 0.679 . . . . 0.0 109.721 179.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' MET . . . . . 0.441 ' O ' ' HB2' ' A' ' 127' ' ' LEU . 0.0 OUTLIER -56.25 -35.41 67.37 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.778 178.663 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.403 HD22 ' CD1' ' A' ' 110' ' ' ILE . 0.3 OUTLIER -65.47 -44.95 85.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.825 178.763 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 60.8 mm-40 -49.97 -44.21 50.61 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.279 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -83.86 -23.71 31.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.782 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.441 ' HB2' ' O ' ' A' ' 123' ' ' MET . 4.4 tp -65.73 -19.68 65.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.743 0.306 . . . . 0.0 110.502 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -126.54 75.82 1.58 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.133 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 8.4 mmtp . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.934 179.951 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.879 0.371 . . . . 0.0 110.978 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.65 -67.16 0.46 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.878 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.414 ' HA ' HD12 ' A' ' 6' ' ' ILE . 4.6 tp60 -53.68 -42.42 67.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.719 179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.9 mm-40 -59.05 -35.6 73.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.692 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.03 -52.29 14.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.255 -0.429 . . . . 0.0 109.919 179.525 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.504 HG13 ' HB3' ' A' ' 117' ' ' PRO . 2.7 mp -58.26 -63.69 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.071 178.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.4 t0 44.65 91.08 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.214 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.23 -81.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.931 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.9 mmtt 47.71 44.8 17.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.318 179.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -155.01 176.47 12.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.175 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.51 156.73 21.55 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.994 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 67.2 mm-40 -131.22 107.46 9.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.027 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.492 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 3.0 mtp180 -127.49 139.53 52.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.847 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.515 ' CE2' ' CG ' ' A' ' 40' ' ' HIS . 0.7 OUTLIER -122.47 135.03 54.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.3 -179.652 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.492 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 0.6 OUTLIER -138.9 154.93 48.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.288 0.566 . . . . 0.0 111.926 -179.218 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.489 ' HB3' ' CG2' ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.22 144.16 26.37 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.608 179.525 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.416 ' N ' ' HG2' ' A' ' 16' ' ' ARG . 0.5 OUTLIER -148.97 132.17 8.22 Favored Pre-proline 0 C--N 1.329 -0.301 0 C-N-CA 120.851 -0.34 . . . . 0.0 111.784 -179.693 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.47 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 64.6 Cg_endo -91.65 111.54 0.31 Allowed 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 123.11 2.54 . . . . 0.0 112.25 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.0 p90 -131.11 140.74 50.05 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.795 0.331 . . . . 0.0 110.83 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.518 HG12 ' HG3' ' A' ' 34' ' ' LYS . 9.3 mt -84.7 143.4 11.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.051 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.77 124.73 87.2 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.5 179.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.572 ' CA ' ' HG3' ' A' ' 25' ' ' GLN . 72.1 Cg_exo -39.5 -55.13 1.68 Allowed 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.956 2.437 . . . . 0.0 112.938 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.65 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -44.83 -58.16 3.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.636 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.485 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -63.73 -34.65 78.35 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.969 -178.907 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.572 ' HG3' ' CA ' ' A' ' 22' ' ' PRO . 0.9 OUTLIER -54.99 -51.29 66.67 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -178.393 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.65 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 0.9 OUTLIER -88.23 -40.52 13.6 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -177.862 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.547 ' HG2' ' O ' ' A' ' 23' ' ' ALA . 12.3 ptmt -58.74 -33.01 69.77 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.716 -178.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -160.52 123.31 1.85 Allowed Pre-proline 0 C--N 1.328 -0.338 0 C-N-CA 120.766 -0.373 . . . . 0.0 111.606 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -73.13 -25.67 15.72 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.571 2.18 . . . . 0.0 112.206 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -93.06 -44.34 8.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.461 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -88.0 54.44 3.09 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.443 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.452 ' HA ' ' HB3' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -123.5 64.64 1.02 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.489 -179.384 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.84 143.01 5.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.618 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.518 ' HG3' HG12 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -97.06 157.97 15.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.085 0.469 . . . . 0.0 111.592 -179.352 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -130.07 132.23 6.91 Favored Glycine 0 N--CA 1.451 -0.326 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.966 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.47 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 22.1 m-90 -97.75 131.09 44.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.879 0.371 . . . . 0.0 111.228 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 39.2 t90 -115.35 117.65 31.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.085 -179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.47 ' CZ ' ' HD2' ' A' ' 16' ' ' ARG . 1.6 m-85 -109.91 156.9 19.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.055 179.371 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.492 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . . . -170.37 124.49 0.72 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.126 0.489 . . . . 0.0 111.906 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.515 ' CG ' ' CE2' ' A' ' 14' ' ' PHE . 11.0 t-160 -97.0 92.41 6.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.288 178.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.553 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 8.8 m-85 -74.47 155.76 37.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.077 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.544 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.7 OUTLIER -125.08 110.91 14.72 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.812 -0.811 . . . . 0.0 108.812 178.957 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 59.06 -133.84 52.52 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 119.706 -1.235 . . . . 0.0 110.678 -177.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.413 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 7.3 Cg_exo -72.53 -19.6 24.58 Favored 'Trans proline' 0 CA--C 1.532 0.394 0 C-N-CA 122.359 2.039 . . . . 0.0 112.133 179.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' TRP . . . . . 0.439 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.7 OUTLIER -113.17 -160.12 0.71 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.567 -178.756 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.553 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 7.6 tt -140.75 155.74 22.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-O 121.084 0.469 . . . . 0.0 111.849 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.411 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -128.65 -16.08 4.33 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.712 -0.676 . . . . 0.0 112.197 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.415 ' CB ' ' HB3' ' A' ' 40' ' ' HIS . 4.2 mtt180 -137.06 137.86 39.79 Favored 'General case' 0 C--O 1.231 0.085 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.192 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.492 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 19.4 tt0 -151.56 125.7 9.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.255 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -125.02 111.97 16.0 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.154 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.418 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 4.2 mt-10 -99.76 132.33 45.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.662 -179.256 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.442 HD13 ' CE1' ' A' ' 38' ' ' TYR . 3.6 mt -127.17 101.68 6.62 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.254 179.244 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -125.49 150.04 66.62 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 120.872 0.368 . . . . 0.0 111.332 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -61.69 -31.52 86.31 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.645 2.23 . . . . 0.0 112.198 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -94.7 -8.65 37.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.177 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.25 114.45 10.65 Favored Pre-proline 0 C--N 1.331 -0.204 0 CA-C-N 116.687 -0.233 . . . . 0.0 110.785 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -50.96 -176.57 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.459 2.106 . . . . 0.0 112.311 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -59.15 85.2 0.06 OUTLIER 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 122.416 2.077 . . . . 0.0 112.398 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.418 ' HB ' ' HB2' ' A' ' 51' ' ' GLU . 87.7 mt -76.03 97.47 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.807 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.483 ' CD2' ' CZ3' ' A' ' 97' ' ' TRP . 4.3 mt -83.74 100.53 10.96 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.487 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.43 HD13 ' CB ' ' A' ' 66' ' ' ASP . 0.3 OUTLIER -95.98 152.57 18.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.346 -179.461 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.445 HG11 ' HB3' ' A' ' 65' ' ' LYS . 11.5 p -152.56 161.64 2.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.656 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.8 158.58 28.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.818 0.342 . . . . 0.0 111.502 -179.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.17 -66.8 0.7 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.459 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.445 ' HB3' HG11 ' A' ' 62' ' ' VAL . 7.5 tptm -62.89 -41.3 99.36 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.836 0.351 . . . . 0.0 110.821 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.43 ' CB ' HD13 ' A' ' 61' ' ' LEU . 24.8 m-20 -132.56 56.99 1.81 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.788 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.27 -17.74 62.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.487 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 3.6 mtm -83.12 -30.45 27.91 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.713 0.292 . . . . 0.0 111.147 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.419 ' CB ' HD12 ' A' ' 61' ' ' LEU . 6.0 mm-40 -97.88 -23.75 15.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.242 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 3.1 ttm -57.44 163.79 2.19 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.863 0.364 . . . . 0.0 111.108 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 8.8 t -46.99 -49.76 20.3 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.332 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 77.2 -57.49 0.51 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.987 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.7 mmtm -55.88 158.84 3.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.018 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -90.81 176.28 6.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.254 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.458 ' CD1' ' CD2' ' A' ' 41' ' ' PHE . 0.9 OUTLIER -54.75 -51.17 66.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.873 0.368 . . . . 0.0 111.56 -179.617 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -31.52 69.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.283 -179.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -81.42 -10.15 59.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.752 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.4 p -91.51 -73.96 0.52 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.77 0.319 . . . . 0.0 111.143 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 139.09 -20.91 3.0 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.785 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.454 ' CD1' ' CE1' ' A' ' 41' ' ' PHE . 3.8 mt -49.29 -30.04 6.8 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.991 0.424 . . . . 0.0 110.813 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 63.0 p -80.56 -31.92 36.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.362 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -94.48 7.87 44.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.046 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.2 mptt -92.69 32.05 1.29 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.726 0.298 . . . . 0.0 111.216 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 58.46 63.07 1.79 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.964 0.411 . . . . 0.0 111.053 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 62.76 60.38 7.82 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.627 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -77.32 -3.65 41.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.65 0.262 . . . . 0.0 111.576 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -51.51 168.13 0.08 Allowed 'General case' 0 CA--C 1.528 0.129 0 CA-C-O 120.839 0.352 . . . . 0.0 111.358 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.489 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 1.0 OUTLIER -151.23 179.94 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.151 179.872 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.82 145.82 30.39 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.717 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.78 -10.48 28.64 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.591 2.194 . . . . 0.0 112.532 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.05 -51.93 19.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.56 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -67.45 -42.91 82.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.039 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -56.98 -53.28 59.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.879 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.88 -19.34 61.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.732 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -62.37 -50.52 71.24 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 179.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 19.3 mm -75.95 -33.79 25.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.59 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.483 ' CZ3' ' CD2' ' A' ' 60' ' ' LEU . 12.9 t-105 -52.45 -40.98 62.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.007 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -86.24 -31.56 21.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.584 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.71 -52.91 63.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.385 -179.637 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 95.0 m -79.77 -82.47 0.11 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.225 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -178.3 37.89 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.622 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.41 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -72.02 -41.25 55.1 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.542 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 29.4 mm -64.68 -46.65 91.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.799 0.333 . . . . 0.0 110.897 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -60.17 -49.12 78.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.492 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -57.61 -49.11 77.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.286 179.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.407 HD11 HG13 ' A' ' 110' ' ' ILE . 0.2 OUTLIER -59.03 -45.02 91.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.361 179.355 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.409 ' HG2' ' CD2' ' A' ' 124' ' ' LEU . 0.9 OUTLIER -61.14 -29.75 69.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.997 179.615 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.36 -50.5 45.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.972 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -74.0 -31.72 63.08 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.333 0.587 . . . . 0.0 109.716 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.419 ' CG1' HG22 ' A' ' 121' ' ' THR . 11.7 mt -59.0 -49.23 83.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.517 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -72.39 -37.18 68.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.783 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 5.8 m -76.0 -8.33 56.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.358 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 72.11 28.59 2.46 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.806 0.336 . . . . 0.0 110.867 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -98.55 -29.73 12.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.652 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.71 -163.92 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.886 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.5 tpt180 -133.76 91.74 24.56 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.195 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.504 ' HB3' HG13 ' A' ' 6' ' ' ILE . 75.1 Cg_exo -50.04 90.25 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.578 2.185 . . . . 0.0 111.849 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 2.4 p -136.12 -50.46 0.7 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.553 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -162.23 -61.6 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.339 . . . . 0.0 111.576 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.469 ' O ' ' HB2' ' A' ' 124' ' ' LEU . . . -53.59 -38.59 64.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.558 -179.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.419 HG22 ' CG1' ' A' ' 110' ' ' ILE . 17.7 p -69.3 -35.64 76.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.786 0.327 . . . . 0.0 110.679 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -70.22 -55.44 9.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.279 0.562 . . . . 0.0 110.532 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' MET . . . . . 0.438 ' HE2' ' N ' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -56.44 -29.22 61.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.374 179.207 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.469 ' HB2' ' O ' ' A' ' 120' ' ' ALA . 0.3 OUTLIER -69.47 -44.61 70.82 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.095 0.474 . . . . 0.0 109.937 178.96 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 42.5 mm-40 -54.03 -44.84 71.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.584 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.07 -30.11 31.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.707 179.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.418 ' HB3' ' HA ' ' A' ' 124' ' ' LEU . 1.2 tt -66.61 -16.05 63.9 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.282 179.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 10.0 mt -74.59 -31.12 61.94 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.953 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.918 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.306 0 CA-C-O 120.844 0.354 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.403 ' O ' ' CD1' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -63.99 -66.14 0.58 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.673 179.949 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.49 ' HA ' HD13 ' A' ' 6' ' ' ILE . 0.1 OUTLIER -53.33 -40.66 65.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.693 179.77 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.5 mm-40 -61.54 -32.68 72.75 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.703 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.4 -50.08 12.37 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.888 179.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.49 HD13 ' HA ' ' A' ' 3' ' ' GLN . 2.7 mp -58.9 -64.25 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.054 178.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.3 p30 36.73 31.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.031 -0.986 . . . . 0.0 112.327 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 46.62 94.53 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.049 0.452 . . . . 0.0 111.226 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -86.17 -77.9 0.29 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.423 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -100.16 -178.31 3.79 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.36 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -69.01 177.6 2.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.921 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.433 ' HG3' ' CZ ' ' A' ' 119' ' ' TYR . 12.5 mm100 -127.74 111.91 14.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.948 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.471 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -116.43 135.51 53.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.749 179.882 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.523 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 0.0 OUTLIER -126.85 149.74 49.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.55 -179.524 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.471 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 0.2 OUTLIER -154.67 162.46 41.12 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.226 0.536 . . . . 0.0 111.653 179.981 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.43 ' CG ' HG22 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.29 154.08 38.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.627 178.843 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -151.93 127.64 5.0 Favored Pre-proline 0 C--N 1.328 -0.361 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.891 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.452 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 75.3 Cg_endo -87.43 94.73 0.46 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.953 2.435 . . . . 0.0 111.981 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.0 p90 -111.76 155.08 24.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.87 0.366 . . . . 0.0 110.907 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.583 HG12 ' CG ' ' A' ' 34' ' ' LYS . 1.4 mt -100.0 153.11 4.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.344 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 -82.47 134.9 47.32 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.526 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.518 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 72.9 Cg_exo -39.96 -60.25 0.59 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.956 2.438 . . . . 0.0 113.051 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.598 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -46.11 -54.01 9.33 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.826 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.405 ' HB3' ' HA ' ' A' ' 32' ' ' LYS . 0.2 OUTLIER -61.02 -37.53 82.89 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.213 -178.93 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.515 ' HG3' ' CA ' ' A' ' 22' ' ' PRO . 0.9 OUTLIER -55.7 -57.35 12.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.913 0.387 . . . . 0.0 111.805 -178.965 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.598 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.6 p90 -86.47 -9.0 57.14 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.87 -179.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.9 mtpp -70.25 -44.49 68.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.948 0.404 . . . . 0.0 110.366 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -174.18 138.85 0.7 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.867 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -67.96 -23.44 40.71 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.549 2.166 . . . . 0.0 112.449 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.5 mm100 -95.76 -40.5 9.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.005 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -93.73 48.32 1.28 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.962 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.405 ' HA ' ' HB3' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -110.0 61.88 0.6 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.671 179.785 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.01 135.62 0.88 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.663 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.583 ' CG ' HG12 ' A' ' 20' ' ' ILE . 8.4 mtmt -104.82 141.15 37.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.519 -179.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -112.95 135.75 12.91 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.524 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.452 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 15.6 m-90 -100.47 111.67 23.95 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.929 0.395 . . . . 0.0 110.845 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 39.0 t90 -95.04 117.66 30.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.808 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.426 ' CE2' ' HD2' ' A' ' 16' ' ' ARG . 14.5 m-85 -105.58 152.43 23.09 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.372 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -163.43 123.46 2.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.267 0.556 . . . . 0.0 111.445 179.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.52 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 3.5 t-160 -99.39 86.89 3.48 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.401 -0.818 . . . . 0.0 108.796 178.801 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.671 ' CG ' ' HB ' ' A' ' 46' ' ' ILE . 7.6 m-85 -71.81 156.41 39.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.747 -178.479 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.513 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 4.3 t70 -130.38 118.25 20.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.317 -0.856 . . . . 0.0 108.81 178.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 58.63 -136.46 51.1 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 119.732 -1.223 . . . . 0.0 110.828 -178.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.427 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.4 Cg_exo -73.71 -15.46 24.16 Favored 'Trans proline' 0 CA--C 1.53 0.292 0 C-N-CA 122.495 2.13 . . . . 0.0 112.332 179.425 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' TRP . . . . . 0.427 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 0.8 OUTLIER -119.83 -157.68 0.71 Allowed 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.714 -178.467 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.671 ' HB ' ' CG ' ' A' ' 41' ' ' PHE . 5.8 tt -137.81 156.54 31.96 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.104 0 CA-C-O 121.149 0.5 . . . . 0.0 112.094 -179.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.424 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -129.94 -15.15 3.88 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.521 -0.763 . . . . 0.0 112.166 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.481 ' CB ' ' HB3' ' A' ' 40' ' ' HIS . 11.2 mtt180 -136.28 138.64 41.98 Favored 'General case' 0 C--O 1.23 0.053 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.753 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -146.43 130.81 17.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.226 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -127.46 112.81 15.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.608 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.477 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -89.93 118.94 29.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.053 -179.753 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.423 HD12 ' CD1' ' A' ' 38' ' ' TYR . 43.3 mt -120.38 102.73 8.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.806 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -130.82 136.22 28.57 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.914 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -52.25 -25.95 25.41 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.354 2.036 . . . . 0.0 112.28 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -94.87 -28.26 15.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.14 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.3 mttp -119.79 119.5 31.19 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.086 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.45 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 72.6 Cg_exo -48.79 171.0 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.565 2.177 . . . . 0.0 112.121 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.45 ' HD2' ' HB3' ' A' ' 57' ' ' PRO . 19.1 Cg_endo -59.02 83.42 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.462 2.108 . . . . 0.0 112.367 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.477 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 63.8 mt -61.39 104.87 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.776 179.845 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.438 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.2 OUTLIER -79.92 100.8 8.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.848 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.0 mt -109.51 145.09 36.86 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.735 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 8.5 t -141.66 147.2 22.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.085 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.53 151.74 23.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.01 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.04 -58.87 4.99 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.406 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.12 -31.64 39.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.92 0.39 . . . . 0.0 110.802 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -123.62 54.13 1.31 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.74 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.38 -30.21 71.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.891 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.24 -40.48 16.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.826 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -73.13 -54.94 7.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.902 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 46.0 ttm -52.24 163.23 0.41 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.842 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 3.0 t -51.39 136.67 24.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.844 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -119.93 47.25 1.77 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.0 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.52 134.21 10.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.015 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -55.28 164.95 0.82 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.885 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.2 tp -50.78 -45.5 59.18 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.721 -179.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.21 -31.79 69.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.602 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.26 -21.58 28.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.699 -179.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -74.51 0.09 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.85 0.357 . . . . 0.0 111.177 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 138.67 -25.19 2.85 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.326 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -53.5 -36.21 61.47 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.972 0.415 . . . . 0.0 110.661 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.5 p -74.21 -30.64 62.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.66 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.3 mmm180 -72.68 -31.95 65.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.609 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.4 mptt -60.9 -168.22 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.812 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.52 73.81 2.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.994 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 72.03 66.38 2.12 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.535 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.0 -10.04 59.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.569 0.223 . . . . 0.0 111.349 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -52.55 154.7 2.47 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.896 0.379 . . . . 0.0 111.415 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.43 HG22 ' CG ' ' A' ' 16' ' ' ARG . 1.2 pt -144.78 168.28 9.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.198 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.413 ' HA ' ' HD3' ' A' ' 90' ' ' PRO . 2.3 mt -78.81 144.75 64.94 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.554 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 89' ' ' LEU . 11.5 Cg_exo -69.02 -35.4 14.91 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.369 2.046 . . . . 0.0 111.387 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 6.9 mtm180 -55.35 -54.4 44.14 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.344 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -57.62 -45.18 85.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.279 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 14.0 t80 -55.29 -53.09 60.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.824 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.64 -21.15 60.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.825 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -50.77 71.56 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.261 0.553 . . . . 0.0 109.649 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.443 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 16.7 mm -72.9 -34.93 47.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.246 179.032 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.434 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 11.9 t-105 -54.08 -39.08 66.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.142 179.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -85.67 -25.96 26.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.604 179.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.443 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -56.36 -54.3 47.18 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.393 -179.759 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 8.3 t -83.68 -67.52 0.78 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.061 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 160.62 40.91 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.563 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.438 ' HA2' ' CD2' ' A' ' 60' ' ' LEU . . . -60.76 -52.93 49.38 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.349 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.44 ' HA ' ' CD1' ' A' ' 124' ' ' LEU . 3.7 mp -53.86 -42.12 51.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.72 0.295 . . . . 0.0 111.136 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.64 -43.9 97.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.013 0.435 . . . . 0.0 110.2 179.38 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -63.88 -40.97 97.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.132 179.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.431 ' CD1' HD11 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -68.21 -38.52 82.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.659 179.69 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -65.58 -30.07 70.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.516 179.607 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.3 m -70.62 -50.05 41.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.342 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.76 -33.5 68.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.33 0.586 . . . . 0.0 109.747 179.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 5.1 mt -56.93 -49.18 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.48 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -72.27 -38.08 68.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.598 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 59.0 m -66.39 -15.86 63.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.124 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.0 mmm180 76.81 30.43 0.59 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.892 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 42.2 mm-40 -102.76 -28.69 11.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.586 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.86 158.09 22.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.046 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.1 mtt85 -110.15 95.32 21.03 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.782 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -47.91 129.64 18.26 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.72 2.28 . . . . 0.0 112.588 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.414 ' CG2' ' CB ' ' A' ' 47' ' ' ALA . 1.1 t -161.1 -54.38 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.004 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.433 ' CZ ' ' HG3' ' A' ' 12' ' ' GLN . 68.5 t80 -159.59 -62.17 0.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.081 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.417 ' CB ' ' HG3' ' A' ' 48' ' ' ARG . . . -53.99 -44.18 70.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.276 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -62.15 -34.89 77.24 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.912 0.387 . . . . 0.0 110.465 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -71.37 -58.7 3.28 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.675 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' MET . . . . . 0.416 ' HG3' ' O ' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -58.22 -29.41 65.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.325 179.397 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.44 ' CD1' ' HA ' ' A' ' 103' ' ' ILE . 7.4 tt -68.23 -48.87 63.97 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.146 0.498 . . . . 0.0 109.971 179.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -53.15 -36.39 60.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.159 179.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 18.5 m-20 -86.65 -29.28 22.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.536 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.439 ' HB3' ' HA ' ' A' ' 124' ' ' LEU . 1.3 tt -72.83 -10.0 59.3 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.879 179.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 4.0 pp -111.55 25.51 11.6 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.763 0.316 . . . . 0.0 111.165 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 16.5 mmtp . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.279 -0.867 . . . . 0.0 111.01 179.992 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.722 0.296 . . . . 0.0 111.061 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.466 ' O ' ' HG2' ' A' ' 5' ' ' GLU . 2.3 ttm180 -67.18 -69.05 0.33 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.992 0.425 . . . . 0.0 110.548 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -53.26 -30.76 40.13 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.062 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.0 tp60 -67.17 -39.2 86.43 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.874 179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.531 ' HG3' ' N ' ' A' ' 6' ' ' ILE . 6.4 pt-20 -75.19 -43.02 54.42 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.688 0.28 . . . . 0.0 110.764 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.531 ' N ' ' HG3' ' A' ' 5' ' ' GLU . 3.7 mp -70.93 -58.76 4.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.575 0.702 . . . . 0.0 109.692 178.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.7 t0 43.34 80.06 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 114.515 -1.22 . . . . 0.0 111.376 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 5.2 mtm -64.06 -81.05 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.149 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 51.97 30.45 7.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.052 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.4 mtt85 -138.26 -172.56 3.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.916 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.27 158.99 16.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.931 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.428 ' HG3' ' CE2' ' A' ' 119' ' ' TYR . 89.3 mm-40 -130.14 102.9 6.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.806 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.549 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -122.26 127.95 50.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.097 -179.579 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.498 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 0.4 OUTLIER -115.46 151.34 34.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.296 179.772 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.549 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 0.8 OUTLIER -151.51 159.09 44.3 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-O 121.289 0.566 . . . . 0.0 112.041 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.492 ' HB3' ' CG2' ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.29 145.67 27.17 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.961 179.332 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.401 ' N ' ' HG2' ' A' ' 16' ' ' ARG . 0.6 OUTLIER -153.07 124.69 3.71 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.684 0.278 . . . . 0.0 111.745 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.462 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 68.3 Cg_endo -89.27 103.61 0.38 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.063 2.509 . . . . 0.0 111.914 179.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.2 p90 -116.87 138.25 51.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.957 0.408 . . . . 0.0 111.076 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.467 HG12 ' HG3' ' A' ' 34' ' ' LYS . 37.4 mt -78.87 134.42 27.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.117 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.5 ttp180 -58.19 139.88 83.54 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.643 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.462 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 14.3 Cg_endo -56.59 -45.38 37.46 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.395 2.063 . . . . 0.0 112.434 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.517 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -55.92 -58.35 8.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.173 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.545 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 0.6 OUTLIER -68.35 -29.85 68.67 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.765 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.39 -57.08 10.94 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.319 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.517 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.8 p90 -91.74 -13.56 31.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.747 -179.485 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.545 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 0.1 OUTLIER -62.31 -46.31 89.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.844 0.354 . . . . 0.0 110.554 179.785 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -166.39 142.94 4.08 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.244 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -69.75 -26.1 27.98 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.636 2.224 . . . . 0.0 112.258 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -94.95 -36.17 11.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.627 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -98.3 49.88 1.0 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.687 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.414 ' HD3' ' O ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -109.66 63.36 0.6 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.826 179.999 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.98 142.81 0.64 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.368 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.467 ' HG3' HG12 ' A' ' 20' ' ' ILE . 0.4 OUTLIER -113.42 152.18 30.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.32 -179.618 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.421 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -127.94 138.28 10.32 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.289 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.462 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 28.3 m-90 -97.73 128.32 44.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.887 0.375 . . . . 0.0 110.708 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.416 ' CZ2' ' OE1' ' A' ' 49' ' ' GLN . 23.2 t90 -113.91 117.36 31.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.309 -179.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.454 ' CE2' ' HD2' ' A' ' 16' ' ' ARG . 1.3 m-85 -111.72 155.34 23.62 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.031 179.189 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.435 ' HB3' ' CE1' ' A' ' 41' ' ' PHE . . . -170.53 126.74 0.77 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.043 0.449 . . . . 0.0 111.884 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.498 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 17.0 t-160 -98.1 99.12 10.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.608 178.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.567 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 34.1 m-85 -85.25 114.52 22.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.629 -179.117 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.453 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 51.9 t0 -88.39 113.89 24.45 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 59.67 -136.04 50.6 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 119.966 -1.111 . . . . 0.0 111.062 -178.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.425 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.4 Cg_exo -73.53 -15.25 24.74 Favored 'Trans proline' 0 N--CA 1.463 -0.28 0 C-N-CA 122.527 2.151 . . . . 0.0 112.266 179.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' TRP . . . . . 0.425 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 0.9 OUTLIER -118.05 -173.99 2.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.965 0.412 . . . . 0.0 111.765 -178.527 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.567 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 1.5 tt -129.62 147.1 33.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.59 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -122.5 -21.03 5.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.98 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.424 ' HD2' ' CE2' ' A' ' 93' ' ' PHE . 5.3 ttm180 -127.17 139.23 53.1 Favored 'General case' 0 C--N 1.334 -0.089 0 C-N-CA 120.868 -0.333 . . . . 0.0 111.253 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.437 ' HB3' ' HB3' ' A' ' 61' ' ' LEU . 1.1 tt0 -154.51 139.24 17.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.786 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 1.2 ttm -140.44 116.75 10.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.9 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.432 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -95.95 136.83 35.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.002 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.416 HD13 ' CE1' ' A' ' 38' ' ' TYR . 81.0 mt -134.46 119.13 18.14 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.075 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.421 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 1.7 m-70 -143.24 135.0 12.95 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.915 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -52.65 -26.86 31.11 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.565 2.177 . . . . 0.0 112.181 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -98.9 -24.46 14.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.968 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -118.01 120.61 32.34 Favored Pre-proline 0 C--O 1.234 0.275 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.84 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_endo -54.15 168.89 0.78 Allowed 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.456 2.104 . . . . 0.0 112.204 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.52 86.77 0.04 OUTLIER 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.577 2.185 . . . . 0.0 112.38 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.432 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 88.6 mt -67.44 95.56 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.099 0.476 . . . . 0.0 110.62 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.439 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.1 OUTLIER -71.65 127.63 33.18 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.913 -179.774 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.437 ' HB3' ' HB3' ' A' ' 49' ' ' GLN . 0.3 OUTLIER -132.67 147.18 52.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.085 -179.764 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.5 p -156.24 142.1 10.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.837 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.27 164.03 1.46 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.285 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.24 -70.02 2.17 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.324 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -57.21 6.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.862 0.363 . . . . 0.0 110.654 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -110.08 45.61 1.09 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.58 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.59 -21.71 65.82 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.399 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 5.5 ptp -81.26 -31.81 33.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.89 0.376 . . . . 0.0 110.625 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.4 ' HB2' HD23 ' A' ' 61' ' ' LEU . 27.2 mp0 -85.29 -36.8 20.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.897 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.412 ' N ' HD23 ' A' ' 61' ' ' LEU . 0.8 OUTLIER -46.0 170.07 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.518 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 3.8 m -51.51 -26.6 8.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.109 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 68.16 -78.11 0.04 OUTLIER 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.971 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.51 -178.63 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.22 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -95.4 -164.72 1.19 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.691 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.419 HD11 ' CD2' ' A' ' 41' ' ' PHE . 3.8 mm? -69.48 -49.36 55.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.508 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -62.46 -31.59 72.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.688 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -83.31 -27.94 29.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.505 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.436 HG23 ' CE2' ' A' ' 41' ' ' PHE . 0.6 OUTLIER -67.2 -78.42 0.06 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.835 0.35 . . . . 0.0 111.085 -179.763 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 144.44 -21.97 2.04 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.76 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.412 ' CD1' ' CE1' ' A' ' 41' ' ' PHE . 2.5 mt -51.88 -33.13 35.32 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.91 0.386 . . . . 0.0 111.075 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 68.1 p -83.55 -31.45 26.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.789 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 46.7 mtm-85 -66.45 -29.78 69.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.886 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -166.5 0.12 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.854 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -100.61 92.21 5.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.008 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 53.81 74.13 0.34 Allowed Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.803 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -85.41 4.44 35.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.592 0.234 . . . . 0.0 111.56 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -59.98 158.09 11.55 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.813 0.339 . . . . 0.0 111.4 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.492 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 0.9 OUTLIER -147.38 -179.95 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.177 179.985 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.03 146.59 33.21 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.626 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -68.18 -16.85 44.96 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.6 2.2 . . . . 0.0 112.69 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.07 -54.58 39.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.147 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -70.36 -41.32 73.28 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.916 0.389 . . . . 0.0 110.992 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.424 ' CE2' ' HD2' ' A' ' 48' ' ' ARG . 9.4 t80 -57.8 -53.01 63.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.941 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.65 -21.22 60.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.849 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -60.68 -50.34 73.88 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.283 0.563 . . . . 0.0 109.616 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 19.9 mm -75.44 -34.9 31.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.636 179.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.447 ' CE2' ' HA3' ' A' ' 102' ' ' GLY . 41.4 t-105 -52.92 -40.46 63.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.915 179.307 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -85.94 -28.22 24.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.717 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.75 -44.08 81.38 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.251 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 50.2 t -90.09 -76.91 0.41 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.01 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 173.95 37.45 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.573 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.447 ' HA3' ' CE2' ' A' ' 97' ' ' TRP . . . -68.76 -44.27 70.82 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.499 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 4.3 mt -60.88 -39.9 83.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.935 0.397 . . . . 0.0 110.922 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -63.39 -45.81 89.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.12 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 21.9 t80 -62.05 -36.22 80.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.174 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.413 ' CD2' HG22 ' A' ' 121' ' ' THR . 0.3 OUTLIER -71.47 -40.23 70.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.58 179.605 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -64.73 -29.9 70.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.597 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 5.1 m -71.95 -50.06 32.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.475 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.94 -34.07 72.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.5 0.667 . . . . 0.0 109.622 178.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.43 ' CG1' HG22 ' A' ' 121' ' ' THR . 5.9 mt -56.95 -49.18 80.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.512 179.278 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -72.13 -34.17 68.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.642 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.414 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 12.3 t -75.79 -8.97 58.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.303 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.414 ' HB2' ' O ' ' A' ' 112' ' ' SER . 5.3 mmm180 68.41 27.66 6.32 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.855 0.359 . . . . 0.0 110.909 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -109.62 -24.11 11.11 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.761 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . 0.418 ' HB1' ' CG2' ' A' ' 121' ' ' THR . . . -56.96 -21.96 34.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.32 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 75.2 ttt180 67.68 92.95 0.06 OUTLIER Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.316 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.472 ' HB3' HG13 ' A' ' 6' ' ' ILE . 82.3 Cg_exo -46.66 90.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.877 2.385 . . . . 0.0 112.305 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -114.06 -63.41 1.45 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.183 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.428 ' CE2' ' HG3' ' A' ' 12' ' ' GLN . 9.5 t80 -161.8 -55.75 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.037 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.461 ' O ' ' HB2' ' A' ' 124' ' ' LEU . . . -53.73 -30.12 42.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.18 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.43 HG22 ' CG1' ' A' ' 110' ' ' ILE . 22.2 p -69.79 -37.9 76.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.747 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -68.48 -54.06 19.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.011 0.434 . . . . 0.0 110.704 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' MET . . . . . 0.453 ' HG3' ' O ' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -57.92 -29.63 65.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.564 179.519 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.461 ' HB2' ' O ' ' A' ' 120' ' ' ALA . 0.2 OUTLIER -67.08 -50.13 62.71 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.084 0.469 . . . . 0.0 110.312 179.012 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 44.8 mm-40 -53.42 -41.62 66.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.618 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -80.95 -31.13 35.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.39 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.36 -12.04 61.31 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.534 179.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 8.7 mt -91.33 -10.53 40.93 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.382 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.19 -0.909 . . . . 0.0 111.008 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.909 0.385 . . . . 0.0 111.051 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.405 ' HA ' ' HG2' ' A' ' 5' ' ' GLU . 0.4 OUTLIER -69.11 -62.49 1.36 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.101 -179.889 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -53.63 -30.27 42.02 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.573 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -69.26 -43.37 74.07 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.892 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.467 ' HG3' ' N ' ' A' ' 6' ' ' ILE . 5.2 pt-20 -70.1 -39.71 75.35 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.87 0.367 . . . . 0.0 110.934 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.467 ' N ' ' HG3' ' A' ' 5' ' ' GLU . 2.9 mp -76.51 -58.98 3.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 121.774 0.797 . . . . 0.0 109.67 178.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.1 t70 41.88 70.59 0.26 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.319 -1.31 . . . . 0.0 111.553 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.7 ptp -58.02 -53.61 56.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.191 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 51.2 49.2 21.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.24 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.86 -169.25 3.32 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.05 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -95.18 170.46 9.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.098 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.458 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 4.3 mp0 -131.25 102.81 6.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.936 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.509 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 3.2 mtt-85 -122.08 126.6 48.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.002 0.43 . . . . 0.0 111.015 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.511 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 2.7 m-85 -108.77 134.84 50.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.811 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.509 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 2.9 m-85 -131.43 153.49 49.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.38 0.61 . . . . 0.0 112.542 -178.307 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.461 ' HB3' ' CG2' ' A' ' 88' ' ' ILE . 0.8 OUTLIER -145.99 142.78 28.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.622 179.21 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -151.35 114.68 3.08 Favored Pre-proline 0 C--N 1.328 -0.362 0 C-N-CA 120.759 -0.377 . . . . 0.0 111.628 -179.456 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.442 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 74.7 Cg_endo -87.49 98.12 0.45 Allowed 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.894 2.396 . . . . 0.0 111.956 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 42.9 p90 -116.72 137.9 51.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.925 0.393 . . . . 0.0 111.059 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.519 HG12 ' HG3' ' A' ' 34' ' ' LYS . 24.2 mt -78.92 145.72 9.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.325 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.16 142.32 94.86 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.429 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.446 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 19.1 Cg_endo -58.68 -50.78 8.45 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.508 2.139 . . . . 0.0 112.22 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.489 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -55.25 -58.23 8.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.066 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.493 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 1.1 m-20 -65.37 -30.25 71.06 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.0 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.51 -56.05 20.3 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.393 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.489 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.7 p90 -94.52 -5.0 47.03 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.976 -179.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.493 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 5.3 mtpp -73.02 -46.58 51.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.885 0.374 . . . . 0.0 110.818 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -162.59 141.48 6.87 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.287 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -73.18 -9.28 23.16 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.686 2.258 . . . . 0.0 112.543 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 78.5 mm-40 -110.83 -33.8 6.43 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.958 0.409 . . . . 0.0 110.814 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -97.44 37.07 1.39 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.761 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.4 ' HB2' ' CG2' ' A' ' 20' ' ' ILE . 0.0 OUTLIER -71.36 -35.02 70.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.412 -179.753 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 46.96 93.35 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.196 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.519 ' HG3' HG12 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -77.9 149.9 34.17 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.479 -179.763 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.424 ' HA3' ' CD2' ' A' ' 53' ' ' HIS . . . -121.79 132.94 9.18 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.247 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.442 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 21.5 m-90 -98.26 124.23 42.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.894 0.378 . . . . 0.0 110.957 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.412 ' CD1' ' HG2' ' A' ' 51' ' ' GLU . 63.4 t90 -107.64 117.13 33.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.973 -179.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.433 ' CE1' HD12 ' A' ' 52' ' ' LEU . 22.5 m-85 -111.54 151.43 28.7 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.432 179.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.405 ' HB3' HD12 ' A' ' 46' ' ' ILE . . . -169.99 124.07 0.75 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.078 0.466 . . . . 0.0 111.343 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.511 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 16.8 t-160 -99.83 96.17 7.4 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.73 179.307 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.592 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 5.1 m-85 -79.09 143.39 35.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.225 -179.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.539 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.3 OUTLIER -113.37 111.71 22.44 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.822 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.87 -133.21 49.5 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 119.907 -1.139 . . . . 0.0 111.224 -178.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.413 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.9 Cg_exo -73.36 -16.78 24.53 Favored 'Trans proline' 0 CA--C 1.531 0.325 0 C-N-CA 122.509 2.139 . . . . 0.0 112.517 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' TRP . . . . . 0.425 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.5 OUTLIER -119.06 -163.48 0.97 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.751 -178.501 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.592 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 4.9 tt -134.85 155.53 38.49 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.693 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.413 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -131.59 -20.88 2.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.427 -179.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 14.5 mtt180 -128.9 134.8 48.39 Favored 'General case' 0 C--O 1.23 0.064 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.764 -179.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.98 122.61 12.54 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.971 0.415 . . . . 0.0 111.466 -179.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.432 ' HE1' ' CE1' ' A' ' 93' ' ' PHE . 24.2 ttp -122.77 115.6 22.3 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.038 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.412 ' HG2' ' CD1' ' A' ' 37' ' ' TRP . 1.4 mt-10 -105.2 129.61 53.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.005 0.431 . . . . 0.0 111.69 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.433 HD12 ' CE1' ' A' ' 38' ' ' TYR . 5.2 mt -128.75 106.43 8.93 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.312 179.456 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.424 ' CD2' ' HA3' ' A' ' 35' ' ' GLY . 0.2 OUTLIER -131.7 138.7 33.17 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.543 -0.298 . . . . 0.0 111.13 -179.635 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.43 -23.91 26.09 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.381 2.054 . . . . 0.0 112.202 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -88.46 -32.85 18.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.129 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.12 125.74 24.17 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.09 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.421 ' CB ' ' CD ' ' A' ' 58' ' ' PRO . 76.9 Cg_exo -50.81 -175.66 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.692 2.261 . . . . 0.0 112.485 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.421 ' CD ' ' CB ' ' A' ' 57' ' ' PRO . 33.3 Cg_exo -58.7 81.3 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.584 2.189 . . . . 0.0 112.498 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.406 ' HB ' ' HB2' ' A' ' 51' ' ' GLU . 94.6 mt -65.56 95.29 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.092 0.472 . . . . 0.0 110.441 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.447 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.4 OUTLIER -78.0 117.55 19.43 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.108 -179.608 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 53.9 mt -121.52 151.37 40.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.732 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.8 p -151.63 145.74 16.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.091 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.38 139.89 58.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.916 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 98.83 -47.43 1.4 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.394 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.67 -42.46 9.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.901 0.381 . . . . 0.0 110.685 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -121.32 47.9 1.76 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.699 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.53 -29.84 70.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.045 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -85.38 -30.33 23.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.201 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -79.41 -50.11 11.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.196 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.1 ptp -52.93 -177.47 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.157 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.48 -50.92 61.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.764 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 75.17 -57.8 0.59 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.311 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -46.26 154.77 0.25 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.326 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -74.83 174.11 9.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.922 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.442 HD12 ' CE1' ' A' ' 15' ' ' PHE . 4.0 mm? -58.19 -45.99 86.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.473 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -69.71 -40.84 76.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.925 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -65.82 -22.63 66.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.547 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.45 -69.94 0.5 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.722 0.296 . . . . 0.0 110.921 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 126.11 -19.83 6.39 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.684 -0.769 . . . . 0.0 112.671 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.14 -53.11 37.58 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.851 0.358 . . . . 0.0 110.713 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' THR . . . . . 0.439 HG23 ' CE2' ' A' ' 15' ' ' PHE . 11.6 p -58.06 -49.88 75.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.665 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -58.17 -27.15 63.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.456 179.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -163.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.578 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -99.71 82.22 2.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.792 0.33 . . . . 0.0 110.81 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.67 70.27 1.03 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.565 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -95.93 32.62 1.85 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.602 0.239 . . . . 0.0 111.164 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.463 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 0.7 OUTLIER -113.07 141.38 46.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.35 -179.891 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.461 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 0.1 OUTLIER -124.67 157.28 32.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.78 179.545 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.429 HD12 ' CB ' ' A' ' 91' ' ' ARG . 0.3 OUTLIER -61.52 145.63 90.93 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.506 179.747 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -60.6 -23.38 75.54 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.599 2.199 . . . . 0.0 112.51 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.429 ' CB ' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -62.26 -53.3 57.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.22 -179.921 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.1 mm-40 -57.71 -56.34 23.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.28 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.432 ' CE1' ' HE1' ' A' ' 50' ' ' MET . 52.4 t80 -50.18 -53.35 28.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.806 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.36 -20.45 62.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.525 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.401 ' HB2' ' O ' ' A' ' 91' ' ' ARG . 0.4 OUTLIER -60.59 -50.01 75.23 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 109.541 -0.541 . . . . 0.0 109.541 179.089 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 15.0 mm -72.38 -35.41 51.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.579 179.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.426 ' CZ3' ' HG ' ' A' ' 60' ' ' LEU . 12.7 t-105 -52.58 -41.93 64.05 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.125 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -85.99 -26.46 25.43 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.655 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.17 -53.24 60.45 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.449 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 70.9 m -86.85 -87.16 0.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.341 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -167.23 48.64 0.25 Allowed Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.543 -0.837 . . . . 0.0 112.683 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.447 ' HA2' ' CD2' ' A' ' 60' ' ' LEU . . . -69.37 -39.56 80.87 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.565 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 16.7 mm -70.08 -44.95 77.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.799 0.333 . . . . 0.0 111.288 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.03 -49.21 78.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.813 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 94.0 t80 -59.5 -50.45 73.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.053 0.454 . . . . 0.0 110.407 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.439 ' CD1' HG22 ' A' ' 121' ' ' THR . 0.2 OUTLIER -57.29 -46.53 83.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.393 179.508 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -59.67 -29.82 68.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.663 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 15.1 m -67.11 -50.32 61.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.777 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.32 -33.78 71.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.564 0.697 . . . . 0.0 109.436 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.43 ' CG1' HG22 ' A' ' 121' ' ' THR . 9.5 mt -56.31 -48.73 79.25 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.258 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -72.0 -32.56 67.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.245 179.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.451 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 0.3 OUTLIER -74.71 -9.28 58.41 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.062 179.491 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.451 ' HB2' ' O ' ' A' ' 112' ' ' SER . 15.7 mmm180 69.66 31.37 3.63 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.966 0.413 . . . . 0.0 110.998 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -108.9 -29.97 8.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.555 179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -71.38 102.15 2.56 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.866 179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 39.2 mtt85 -58.04 109.78 2.06 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.191 -179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.548 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 75.6 Cg_exo -50.5 89.82 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.676 2.25 . . . . 0.0 112.187 179.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.5 t -141.58 81.77 1.79 Allowed 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.834 0.349 . . . . 0.0 111.822 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.458 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 7.8 t80 65.13 -64.34 0.17 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 179.003 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.54 -52.22 60.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.921 0.391 . . . . 0.0 111.397 -179.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.548 ' OG1' ' HA ' ' A' ' 117' ' ' PRO . 0.6 OUTLIER -65.26 -46.58 79.95 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.677 179.669 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.401 ' CB ' HD12 ' A' ' 6' ' ' ILE . . . -54.85 -56.27 21.24 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.387 0.613 . . . . 0.0 110.256 179.372 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' MET . . . . . 0.401 ' CE ' ' C ' ' A' ' 123' ' ' MET . 0.0 OUTLIER -53.69 -33.66 56.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.335 179.17 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.72 -49.04 74.64 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.15 0.5 . . . . 0.0 109.818 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 40.7 mm-40 -50.79 -40.2 54.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.909 178.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -79.3 -32.0 43.38 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.068 178.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.31 -21.43 59.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.118 178.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -143.01 77.93 1.59 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.952 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 6.9 mmmt . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.941 -179.996 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.767 0.318 . . . . 0.0 111.058 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.14 -60.1 4.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.987 0.423 . . . . 0.0 110.546 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -53.84 -35.57 61.63 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.654 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -61.63 -36.63 81.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.365 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -73.86 -56.47 4.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.093 179.224 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 3.1 mp -57.72 -61.74 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.188 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 39.37 30.26 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.908 -1.042 . . . . 0.0 112.24 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 51.48 99.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.004 0.43 . . . . 0.0 111.166 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.9 mttt -53.31 -58.15 8.1 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.939 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.42 ' HD2' ' HA2' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -177.43 -157.71 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.023 179.925 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -44.76 147.4 0.63 Allowed 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.951 0.405 . . . . 0.0 111.705 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 74.2 mm-40 -118.91 112.64 19.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.952 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.569 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 1.1 mtp180 -115.4 132.36 56.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.006 0.432 . . . . 0.0 110.767 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.498 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 1.3 m-85 -115.59 135.21 54.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.399 -179.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.569 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 0.6 OUTLIER -136.76 154.17 50.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.289 0.566 . . . . 0.0 112.007 -178.759 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.478 ' HD2' ' CE2' ' A' ' 38' ' ' TYR . 0.6 OUTLIER -149.21 147.16 28.08 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.767 179.872 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.509 HG12 HD11 ' A' ' 80' ' ' LEU . 0.4 OUTLIER -153.28 127.63 4.58 Favored Pre-proline 0 C--O 1.233 0.213 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.781 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.409 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 66.2 Cg_endo -91.87 114.83 0.37 Allowed 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 123.222 2.614 . . . . 0.0 111.573 179.17 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.7 p90 -131.31 142.95 50.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.955 0.407 . . . . 0.0 111.573 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.475 HG12 ' HG3' ' A' ' 34' ' ' LYS . 23.4 mt -88.03 134.2 28.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.801 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -56.21 122.84 51.29 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.571 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.467 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 84.5 Cg_exo -44.5 -46.82 11.73 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.568 2.178 . . . . 0.0 112.787 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.513 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -54.74 -58.24 8.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.109 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.511 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 7.0 m-20 -67.96 -29.39 68.43 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.853 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.67 -55.04 25.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.273 -179.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.513 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.1 p90 -94.03 -14.31 25.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.91 -179.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.511 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 3.3 mtpt -62.98 -50.95 68.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.797 0.332 . . . . 0.0 110.768 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 179.07 144.53 0.34 Allowed Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.347 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -73.55 -2.29 11.94 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.756 2.304 . . . . 0.0 112.824 179.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.38 -46.55 8.65 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.026 0.441 . . . . 0.0 110.575 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -95.33 33.55 1.56 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.195 179.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.8 mmtt -45.83 -76.59 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.518 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 61.83 93.87 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.727 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.475 ' HG3' HG12 ' A' ' 20' ' ' ILE . 1.2 ttmt -91.06 138.28 31.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.375 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -107.66 134.63 12.31 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.269 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.409 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 11.4 m-90 -98.61 134.58 41.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.879 0.371 . . . . 0.0 110.82 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.414 ' CZ3' HD23 ' A' ' 80' ' ' LEU . 26.2 t90 -113.39 117.27 31.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.06 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.478 ' CE2' ' HD2' ' A' ' 16' ' ' ARG . 53.2 m-85 -116.28 142.74 46.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.053 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.502 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . . . -164.97 124.22 1.8 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.279 0.561 . . . . 0.0 111.883 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.504 ' HB3' ' HG3' ' A' ' 48' ' ' ARG . 5.5 t-160 -90.81 95.75 10.29 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.341 -0.845 . . . . 0.0 108.733 178.403 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.622 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 7.7 m-85 -76.98 158.57 30.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.544 -178.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.596 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 3.5 t70 -126.32 115.09 19.14 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.42 ' HA2' ' HD2' ' A' ' 10' ' ' ARG . . . 57.65 -135.61 51.55 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 119.804 -1.189 . . . . 0.0 111.124 -178.452 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_exo -71.7 -18.26 28.86 Favored 'Trans proline' 0 CA--C 1.53 0.289 0 C-N-CA 122.53 2.154 . . . . 0.0 112.278 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' TRP . . . . . 0.402 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.7 OUTLIER -116.15 -159.34 0.72 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.391 -178.83 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.622 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 4.7 tt -131.62 157.73 43.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 CA-C-O 121.304 0.573 . . . . 0.0 112.255 -179.287 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.446 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -112.45 -37.3 5.0 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.013 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.504 ' HG3' ' HB3' ' A' ' 40' ' ' HIS . 0.1 OUTLIER -146.38 160.32 42.2 Favored 'General case' 0 CA--C 1.523 -0.084 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.964 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.502 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 9.1 tt0 -149.9 150.55 32.06 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.158 0.504 . . . . 0.0 111.646 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.408 ' HB2' ' CZ3' ' A' ' 97' ' ' TRP . 3.3 ttm -138.85 122.51 17.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.134 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -111.44 139.75 46.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.043 0.449 . . . . 0.0 111.583 -179.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.429 HD11 ' CD1' ' A' ' 38' ' ' TYR . 0.7 OUTLIER -135.08 101.77 4.98 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.364 179.652 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -116.68 138.05 24.21 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.096 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -52.06 -26.6 26.19 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.662 2.241 . . . . 0.0 112.331 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -98.89 -25.04 14.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.968 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -117.06 118.98 35.53 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.774 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.403 ' O ' ' N ' ' A' ' 59' ' ' ILE . 73.1 Cg_exo -48.72 177.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.405 2.07 . . . . 0.0 112.261 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -56.75 82.4 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.536 2.157 . . . . 0.0 112.345 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.403 ' N ' ' O ' ' A' ' 57' ' ' PRO . 5.8 mt -65.01 107.05 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.861 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.447 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.3 OUTLIER -83.28 136.96 34.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.893 -179.93 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.449 ' HB3' ' HB3' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -132.68 145.79 51.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.024 -179.804 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.0 p -150.37 131.91 5.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.982 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.67 164.7 1.02 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.414 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.79 -70.71 1.15 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.407 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.62 -55.67 18.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.948 0.404 . . . . 0.0 110.788 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.432 ' CB ' HD13 ' A' ' 61' ' ' LEU . 66.6 m-20 -99.13 59.33 1.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.864 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -69.04 -23.97 64.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.203 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 7.1 mmt -85.25 -37.87 19.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.994 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -81.69 -36.59 28.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.202 -179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 63.4 tpp -52.11 158.62 1.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.18 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 5.4 t -49.1 -58.7 4.51 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.105 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 66.03 19.36 11.19 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.216 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.405 ' HB2' ' CG2' ' A' ' 78' ' ' THR . 15.6 mmtt -123.69 131.67 53.66 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.782 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -58.64 166.4 1.85 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.41 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.429 HD23 ' CZ ' ' A' ' 15' ' ' PHE . 12.2 mt -58.8 -53.11 62.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.682 0.277 . . . . 0.0 111.432 -179.458 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -62.87 -31.93 73.07 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.275 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -77.82 -36.67 49.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.322 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.405 ' CG2' ' HB2' ' A' ' 73' ' ' LYS . 0.7 OUTLIER -62.8 -73.27 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.118 -179.808 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 140.23 -6.6 2.81 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.532 -0.842 . . . . 0.0 113.101 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.54 HD13 ' HB3' ' A' ' 15' ' ' PHE . 2.6 mm? -63.12 -38.15 90.02 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.249 0.547 . . . . 0.0 110.161 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 69.0 p -87.56 -28.52 21.91 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.978 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.04 -36.11 82.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.612 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -80.24 -164.61 0.71 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.753 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -109.86 112.88 25.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.911 0.386 . . . . 0.0 111.302 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.82 82.6 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.954 -0.641 . . . . 0.0 113.227 179.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.412 ' CB ' ' O ' ' A' ' 80' ' ' LEU . . . -118.63 15.19 13.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.718 0.294 . . . . 0.0 111.163 179.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.404 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 14.6 mt-10 -87.02 166.4 15.07 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.895 0.378 . . . . 0.0 111.286 -179.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.449 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 0.8 OUTLIER -146.98 168.11 5.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.008 179.688 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -90.01 140.82 27.61 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.742 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.13 -16.47 54.62 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.632 2.221 . . . . 0.0 112.649 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -71.76 -54.06 11.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.205 -179.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.409 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 0.0 OUTLIER -66.95 -39.83 87.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.972 -179.803 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -58.5 -53.21 60.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.477 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.75 -19.32 62.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.411 179.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.409 ' HB2' ' HA ' ' A' ' 92' ' ' GLN . 0.1 OUTLIER -61.82 -50.18 73.35 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.117 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 14.0 mm -72.23 -37.76 60.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.405 179.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.456 ' O ' ' N ' ' A' ' 102' ' ' GLY . 41.2 t-105 -52.88 -42.15 65.01 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.152 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -85.72 -21.9 28.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.699 179.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 4.9 tpt180 -58.24 -54.07 51.1 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.356 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 41.6 t -86.12 -83.01 0.19 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.29 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -165.84 31.45 0.22 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.601 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.456 ' N ' ' O ' ' A' ' 97' ' ' TRP . . . -52.64 -48.06 56.73 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.65 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.461 ' HA ' ' CD1' ' A' ' 124' ' ' LEU . 24.2 mm -66.29 -43.13 91.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.742 0.306 . . . . 0.0 111.056 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.86 -39.43 74.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.97 0.415 . . . . 0.0 110.552 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -64.2 -53.48 48.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.637 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.454 ' CD1' HD13 ' A' ' 124' ' ' LEU . 1.5 mt -61.59 -37.66 84.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.632 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.36 -31.05 72.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.702 179.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 14.7 m -70.14 -50.33 41.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.642 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.06 -31.91 66.57 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.246 0.546 . . . . 0.0 109.729 179.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 4.6 mt -56.89 -47.14 83.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.247 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -69.59 -39.31 77.35 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.436 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.57 -14.1 62.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.111 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.405 ' NH1' ' HB3' ' A' ' 113' ' ' ARG . 3.6 mmm180 72.45 29.47 2.11 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.817 0.341 . . . . 0.0 111.004 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -111.81 -21.32 11.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.05 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -56.68 -26.36 56.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.443 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 56.7 mtt180 60.74 96.56 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.631 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -47.11 92.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.592 2.195 . . . . 0.0 112.566 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 23.8 m -106.24 -59.54 1.77 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.59 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -165.59 -56.26 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.151 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.8 -40.85 66.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.191 -179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 6.6 p -60.79 -40.68 93.5 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.164 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -63.99 -54.26 37.17 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.42 0.628 . . . . 0.0 109.424 178.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' MET . . . . . 0.443 ' HE1' ' C ' ' A' ' 123' ' ' MET . 2.5 tmm? -56.35 -33.63 65.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.662 178.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.461 ' CD1' ' HA ' ' A' ' 103' ' ' ILE . 1.2 tt -67.55 -44.81 77.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.04 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 46.3 mm-40 -52.88 -38.73 61.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.014 179.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 49.9 m-20 -80.99 -34.28 33.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.345 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 tp -68.98 -11.25 60.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.823 179.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 14.5 mt -77.6 -17.59 57.67 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.224 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.989 179.888 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.829 0.347 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -65.11 0.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.721 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -53.94 -39.36 65.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.753 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -60.96 -34.01 74.09 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.751 179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.54 -49.39 14.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.266 179.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.433 HG23 ' CE ' ' A' ' 8' ' ' MET . 2.8 mp -62.38 -62.91 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.195 179.096 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.404 ' C ' ' O ' ' A' ' 6' ' ' ILE . 6.4 p-10 29.49 76.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.18 -0.918 . . . . 0.0 112.118 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.433 ' CE ' HG23 ' A' ' 6' ' ' ILE . 16.1 mmt -79.93 -78.97 0.15 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.051 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.3 mttp 53.88 28.98 9.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.017 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.6 ttm-85 -103.54 54.58 0.75 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.01 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 63.67 133.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.108 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.422 ' HG3' ' CZ ' ' A' ' 119' ' ' TYR . 90.6 mm-40 -125.0 102.82 7.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.69 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.465 ' CB ' ' CZ ' ' A' ' 15' ' ' PHE . 18.3 mtp180 -117.53 129.35 55.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.159 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.504 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 1.3 m-85 -113.46 134.64 54.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.982 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.465 ' CZ ' ' CB ' ' A' ' 13' ' ' ARG . 2.2 m-85 -134.67 153.49 51.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.215 0.531 . . . . 0.0 112.019 -178.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.447 ' HB3' ' CG2' ' A' ' 88' ' ' ILE . 0.6 OUTLIER -149.17 146.11 27.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.803 179.486 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.431 ' N ' ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -143.06 122.31 7.56 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 120.656 0.265 . . . . 0.0 111.359 -179.589 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.466 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 74.3 Cg_endo -88.44 89.49 0.47 Allowed 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.938 2.425 . . . . 0.0 112.354 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 29.1 p90 -109.15 144.78 36.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.819 0.342 . . . . 0.0 110.878 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 4.8 mt -90.77 144.96 8.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.045 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.409 ' O ' ' CG ' ' A' ' 25' ' ' GLN . 7.5 mtt180 -70.12 134.4 87.41 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.503 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.511 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 85.3 Cg_exo -41.26 -60.81 0.58 Allowed 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.949 2.432 . . . . 0.0 113.19 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.62 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -46.22 -53.89 9.77 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.899 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.507 ' HB3' ' HA ' ' A' ' 32' ' ' LYS . 1.4 m-20 -60.34 -36.79 78.79 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.651 -0.704 . . . . 0.0 112.072 -178.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.503 ' HG3' ' CA ' ' A' ' 22' ' ' PRO . 1.3 mt-30 -56.92 -57.59 11.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.723 -179.147 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.62 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.8 p90 -86.36 -3.03 58.92 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.71 -179.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.85 -43.69 35.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.865 0.364 . . . . 0.0 110.424 179.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.421 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 3.4 t70 -168.39 148.69 4.29 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.121 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 2.8 Cg_exo -73.44 -30.38 10.14 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.758 2.305 . . . . 0.0 111.781 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -94.6 -41.97 9.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.802 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -87.35 53.59 2.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.642 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.507 ' HA ' ' HB3' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -122.34 62.09 0.97 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.859 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.02 148.7 0.24 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.313 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.92 117.65 34.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.332 -179.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -85.39 124.34 6.75 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.793 -0.718 . . . . 0.0 111.948 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.466 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 24.2 m-90 -97.88 131.31 44.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.038 0.447 . . . . 0.0 111.258 -179.518 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 33.2 t90 -116.2 117.15 29.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.636 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.446 ' CE2' ' HG3' ' A' ' 16' ' ' ARG . 11.7 m-85 -110.11 152.08 26.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.622 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.45 ' HB3' ' CE1' ' A' ' 41' ' ' PHE . . . -170.3 124.26 0.72 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.013 0.435 . . . . 0.0 111.319 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.504 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 14.1 t-160 -97.11 101.0 12.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.75 179.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.578 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 7.7 m-85 -87.96 123.38 32.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.495 -179.263 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.427 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 38.3 m-20 -95.87 121.45 37.62 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 56.09 -137.77 46.36 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 119.944 -1.122 . . . . 0.0 111.042 -178.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.42 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 7.2 Cg_exo -73.33 -16.06 24.93 Favored 'Trans proline' 0 CA--C 1.531 0.355 0 C-N-CA 122.38 2.053 . . . . 0.0 112.28 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' TRP . . . . . 0.42 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 0.9 OUTLIER -117.26 -170.25 1.81 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.943 0.401 . . . . 0.0 111.89 -178.434 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.578 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 3.9 tt -128.28 154.65 39.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.878 -179.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.413 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -131.97 -19.37 2.58 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.132 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.415 ' HB2' ' HB3' ' A' ' 40' ' ' HIS . 5.9 mtm180 -130.27 142.65 50.54 Favored 'General case' 0 C--N 1.337 0.054 0 CA-C-O 120.85 0.357 . . . . 0.0 111.039 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.38 132.88 18.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.207 -179.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 14.1 ttp -133.4 120.71 21.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.331 179.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.4 ' HB3' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -105.24 135.0 47.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.267 -179.648 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.426 HD11 ' CE1' ' A' ' 38' ' ' TYR . 54.7 mt -135.15 101.88 5.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.71 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -120.75 155.4 57.19 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.015 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.16 -30.03 81.53 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.757 2.305 . . . . 0.0 112.457 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -109.82 9.67 24.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.478 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -142.3 113.12 6.16 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.792 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -50.92 -179.9 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.432 2.088 . . . . 0.0 112.336 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.25 82.69 0.07 OUTLIER 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.665 2.244 . . . . 0.0 112.488 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.4 ' HB ' ' HB3' ' A' ' 51' ' ' GLU . 7.1 mt -64.8 98.48 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.991 0.424 . . . . 0.0 110.709 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.426 HD11 ' CZ3' ' A' ' 97' ' ' TRP . 0.2 OUTLIER -76.1 112.69 12.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.773 -179.74 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -115.74 152.6 32.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.847 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.1 p -158.79 146.47 7.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.048 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.22 162.03 2.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.026 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.09 -65.75 2.26 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.065 -179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.3 -36.4 66.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.034 0.445 . . . . 0.0 110.342 179.489 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -119.49 54.83 0.98 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.505 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.44 -34.22 77.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.203 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 36.5 mmm -85.71 -38.94 17.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.881 0.372 . . . . 0.0 110.777 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.58 -44.9 61.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.976 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 21.3 ttm -52.32 163.51 0.4 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.927 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 0.425 ' O ' ' CB ' ' A' ' 72' ' ' GLU . 1.8 t -46.7 -55.07 8.36 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.208 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.425 ' CB ' ' O ' ' A' ' 71' ' ' CYS . 2.7 tt0 84.04 -21.89 0.24 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.786 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.47 -179.69 5.87 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.922 0.391 . . . . 0.0 111.163 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -99.26 -171.58 2.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.463 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.413 HD12 ' CE1' ' A' ' 15' ' ' PHE . 3.6 mm? -67.3 -49.99 61.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.568 -179.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.27 -41.72 73.08 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.854 0.359 . . . . 0.0 111.338 -179.394 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -61.81 -38.4 88.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.684 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -59.82 -72.42 0.11 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.146 -179.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 132.88 -19.4 4.42 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.551 -179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 mp -52.79 -42.83 65.4 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.032 0.444 . . . . 0.0 110.765 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 28.3 p -71.2 -39.63 71.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.649 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -60.87 -30.41 70.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.557 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.6 mtpp -60.11 -177.11 0.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.691 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.54 68.88 2.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.767 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.56 64.55 1.68 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.638 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -92.6 26.25 2.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.709 0.29 . . . . 0.0 111.233 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.99 155.65 16.65 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.85 0.357 . . . . 0.0 110.928 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.447 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 1.0 OUTLIER -133.56 178.69 5.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.072 179.818 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -93.75 158.45 36.51 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.828 179.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo -73.0 -35.81 4.98 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.736 2.291 . . . . 0.0 112.107 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.96 -54.26 41.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.223 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -64.3 -45.87 86.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.18 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -55.33 -53.25 58.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.014 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -72.6 -20.22 61.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.679 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -59.93 -49.63 76.93 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 16.7 mm -73.76 -35.06 42.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.366 179.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.432 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 5.8 t-105 -54.65 -39.7 68.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.991 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.63 -25.59 26.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.531 179.272 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.8 -53.7 54.8 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.085 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 52.3 t -83.96 -76.65 0.29 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.026 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 175.01 39.0 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.598 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.432 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -58.9 -62.22 6.48 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.429 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 3.7 mp -52.93 -38.37 28.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.784 0.326 . . . . 0.0 111.258 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.96 -40.13 87.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.982 0.42 . . . . 0.0 110.515 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -69.72 -41.55 75.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.496 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.428 ' CD1' HD12 ' A' ' 110' ' ' ILE . 0.3 OUTLIER -68.22 -50.31 54.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.876 179.888 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -29.68 70.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.037 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 4.0 m -68.52 -50.51 51.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.793 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.29 -35.1 71.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.645 0.736 . . . . 0.0 109.389 178.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.428 HD12 ' CD1' ' A' ' 106' ' ' LEU . 15.9 mt -56.24 -45.23 81.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.534 179.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -70.34 -41.16 73.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.031 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.502 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 21.6 p -76.55 -4.63 43.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.424 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.502 ' HB2' ' O ' ' A' ' 112' ' ' SER . 24.2 mmm180 75.38 24.12 1.43 Allowed 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.79 0.329 . . . . 0.0 111.332 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.38 -24.19 20.87 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.386 179.082 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -102.11 107.7 18.87 Favored 'General case' 0 N--CA 1.456 -0.136 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.873 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . 0.42 ' O ' ' N ' ' A' ' 118' ' ' THR . 0.2 OUTLIER -56.17 135.15 74.92 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.937 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_exo -52.42 84.95 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.596 2.197 . . . . 0.0 112.517 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.42 ' N ' ' O ' ' A' ' 116' ' ' ARG . 3.6 p -107.62 -176.59 3.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.413 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.422 ' CZ ' ' HG3' ' A' ' 12' ' ' GLN . 40.2 t80 -59.17 -36.35 75.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.87 0.367 . . . . 0.0 110.77 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -69.15 -52.08 31.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.116 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.413 ' HA ' HD12 ' A' ' 110' ' ' ILE . 60.5 p -58.63 -49.28 78.09 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.835 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.97 -48.54 79.69 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.244 0.545 . . . . 0.0 109.826 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' MET . . . . . 0.413 ' O ' ' HE1' ' A' ' 123' ' ' MET . 0.0 OUTLIER -62.14 -33.37 74.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.883 178.785 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.97 -50.26 69.28 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.168 179.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 86.6 mm-40 -52.92 -42.57 65.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.359 179.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -79.06 -29.84 43.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.638 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.413 ' CB ' ' HE1' ' A' ' 123' ' ' MET . 1.3 tt -76.73 -7.02 54.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.647 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 20.3 mt -75.71 -35.34 60.3 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.896 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.188 -0.91 . . . . 0.0 111.113 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.964 0.411 . . . . 0.0 111.026 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.409 ' O ' ' CD1' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -60.67 -66.63 0.5 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.55 179.88 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.74 -36.73 62.62 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.549 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.5 tp60 -58.31 -36.31 73.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.668 179.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.521 ' HG2' ' HB2' ' A' ' 117' ' ' PRO . 0.3 OUTLIER -73.02 -55.68 6.18 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.901 179.403 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.409 ' CD1' ' O ' ' A' ' 2' ' ' ARG . 4.5 mp -52.91 -64.61 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.48 0.657 . . . . 0.0 109.61 178.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 29.4 t70 49.58 96.94 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.057 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.1 ptp -87.53 20.22 3.0 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.575 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.48 -31.27 63.66 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.849 0.356 . . . . 0.0 110.999 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 18.6 mtt180 -57.0 173.18 0.22 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.029 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.2 134.14 42.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.943 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 89.7 mm-40 -119.1 102.68 8.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.941 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.477 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -122.34 143.23 49.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.787 179.868 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.543 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 0.7 OUTLIER -124.34 134.74 53.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.709 -179.621 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.477 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 0.2 OUTLIER -143.56 155.53 44.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.236 0.541 . . . . 0.0 111.881 -179.695 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.512 ' HG3' ' CE2' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -149.6 153.4 37.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.897 178.71 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -148.79 133.09 8.82 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.757 0.313 . . . . 0.0 111.535 -179.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.424 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 70.7 Cg_endo -91.97 120.25 0.54 Allowed 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.183 2.589 . . . . 0.0 111.777 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.7 p90 -144.59 155.99 43.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.99 0.424 . . . . 0.0 111.154 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 2.2 mt -108.9 150.53 11.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.812 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -69.23 123.22 87.82 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.25 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.578 ' CA ' ' HG3' ' A' ' 25' ' ' GLN . 67.2 Cg_exo -40.0 -50.79 3.3 Favored 'Trans proline' 0 C--O 1.239 0.554 0 C-N-CA 122.952 2.435 . . . . 0.0 112.996 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.649 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -47.6 -59.09 3.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.879 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.441 ' HA ' ' HG2' ' A' ' 27' ' ' LYS . 0.8 OUTLIER -62.63 -33.59 75.33 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.505 -0.77 . . . . 0.0 112.833 -178.831 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.578 ' HG3' ' CA ' ' A' ' 22' ' ' PRO . 0.5 OUTLIER -55.89 -53.89 51.28 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -178.314 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.649 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.9 p90 -88.88 -40.72 12.91 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -178.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.561 ' HG2' ' O ' ' A' ' 23' ' ' ALA . 11.0 ptmt -58.34 -36.26 73.17 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 -178.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -156.91 116.67 2.06 Favored Pre-proline 0 C--N 1.33 -0.28 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.893 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.27 -7.01 19.85 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.617 2.212 . . . . 0.0 112.366 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -95.8 -36.14 11.26 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.947 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -88.99 46.02 1.35 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.441 178.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.9 mmtp -78.86 59.65 2.64 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.948 -179.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 12.2 mmtm -53.8 100.7 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.025 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.92 121.35 31.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.949 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -113.66 144.48 18.18 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.727 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.426 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 11.2 m-90 -106.21 132.73 51.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.843 0.354 . . . . 0.0 110.745 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.494 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 22.4 t90 -115.05 117.56 30.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.222 -179.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.512 ' CE2' ' HG3' ' A' ' 16' ' ' ARG . 0.4 OUTLIER -117.24 152.28 35.16 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.32 179.146 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.44 ' HB3' ' CE1' ' A' ' 41' ' ' PHE . . . -170.58 130.29 0.86 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.203 0.525 . . . . 0.0 111.807 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.532 ' HB3' ' HG3' ' A' ' 48' ' ' ARG . 8.4 t-160 -96.68 103.68 15.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.496 -0.775 . . . . 0.0 108.997 178.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.645 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 7.1 m-85 -90.3 127.42 36.16 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.589 -179.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.424 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 1.1 m-20 -93.88 113.36 25.36 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 178.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 57.48 -136.51 50.6 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.025 -1.084 . . . . 0.0 110.959 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -71.17 -19.2 29.89 Favored 'Trans proline' 0 N--CA 1.465 -0.192 0 C-N-CA 122.385 2.056 . . . . 0.0 112.08 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' TRP . . . . . 0.404 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -111.4 -174.0 2.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.505 -178.864 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.645 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 1.4 tt -121.44 149.33 24.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.172 0.51 . . . . 0.0 112.198 -179.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -105.42 -40.33 5.84 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.832 -179.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.532 ' HG3' ' HB3' ' A' ' 40' ' ' HIS . 1.6 ptp180 -149.58 153.24 36.8 Favored 'General case' 0 CA--C 1.523 -0.084 0 C-N-CA 120.542 -0.463 . . . . 0.0 111.512 -179.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -148.23 156.11 42.17 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.896 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.452 ' CG ' ' HB2' ' A' ' 38' ' ' TYR . 22.8 ptm -142.61 122.64 13.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.297 179.523 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.408 ' O ' ' HA ' ' A' ' 58' ' ' PRO . 0.0 OUTLIER -98.78 126.51 44.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.324 -179.405 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 20.4 mt -128.21 112.05 14.09 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.752 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -140.02 134.63 15.87 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.2 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -50.99 -26.19 17.95 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.399 2.066 . . . . 0.0 112.234 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -96.68 -28.76 14.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.949 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.408 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 5.5 mttp -116.26 121.68 33.23 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.79 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 56' ' ' LYS . 9.5 Cg_endo -50.94 169.63 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.341 2.028 . . . . 0.0 112.111 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.408 ' HA ' ' O ' ' A' ' 51' ' ' GLU . 19.2 Cg_endo -60.84 78.54 0.07 OUTLIER 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.536 2.157 . . . . 0.0 112.477 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 11.8 mt -65.46 89.96 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 121.075 0.464 . . . . 0.0 110.7 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.448 ' CD2' ' CZ3' ' A' ' 97' ' ' TRP . 7.2 mt -68.68 113.72 6.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.558 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.509 ' CD2' ' HB3' ' A' ' 69' ' ' GLU . 5.7 mt -101.96 155.72 17.98 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.399 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.428 HG22 ' CE2' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -164.52 140.08 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.867 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.12 161.2 7.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.928 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.39 -69.86 2.92 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.84 -179.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -45.12 73.12 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.043 0.449 . . . . 0.0 110.426 179.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.435 ' CB ' ' CD2' ' A' ' 61' ' ' LEU . 21.9 m-20 -114.35 52.64 0.83 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.569 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -62.46 -38.22 88.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.107 -179.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 75.7 mmm -85.64 -31.08 22.75 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.949 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.509 ' HB3' ' CD2' ' A' ' 61' ' ' LEU . 0.3 OUTLIER -75.52 -36.54 60.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.049 -179.754 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.416 ' HA ' ' CD1' ' A' ' 61' ' ' LEU . 0.2 OUTLIER -47.42 172.45 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.244 179.861 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 0.424 ' O ' ' CB ' ' A' ' 72' ' ' GLU . 21.5 p -45.88 -41.55 11.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.181 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.424 ' CB ' ' O ' ' A' ' 71' ' ' CYS . 10.5 tt0 82.19 -13.78 0.83 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.84 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.88 -176.41 3.05 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.908 0.385 . . . . 0.0 110.864 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -106.4 174.07 6.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.463 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.426 HD11 ' CZ ' ' A' ' 15' ' ' PHE . 32.4 tp -56.21 -44.21 79.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.461 -179.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -70.96 -46.18 62.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.714 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.48 -28.88 65.33 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -178.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.427 HG22 ' CZ ' ' A' ' 41' ' ' PHE . 0.9 OUTLIER -56.49 -67.28 0.32 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.736 0.303 . . . . 0.0 111.243 -179.589 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 131.46 -20.28 4.69 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.876 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 6.7 mt -53.22 -29.91 34.95 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.977 0.418 . . . . 0.0 110.822 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 11.2 p -86.24 -43.36 13.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.737 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.53 -30.18 69.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.703 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 43.6 mttt -67.45 -177.25 0.69 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.978 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 20.5 mmt85 -81.62 73.75 8.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.1 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.92 65.05 3.81 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.65 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -76.82 -5.35 47.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.573 0.225 . . . . 0.0 111.501 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -55.03 150.03 11.02 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.973 0.416 . . . . 0.0 111.147 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.458 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 9.8 pt -136.46 169.45 20.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.135 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -82.58 146.17 52.79 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.757 179.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -67.34 -24.78 42.92 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.557 2.171 . . . . 0.0 112.534 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -54.1 49.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.992 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -58.61 -49.0 79.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.006 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -55.66 -53.32 58.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.714 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.83 -21.82 65.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.791 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.74 -50.59 68.48 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.059 0.457 . . . . 0.0 109.862 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 18.8 mm -77.85 -34.48 19.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.71 179.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.448 ' CZ3' ' CD2' ' A' ' 60' ' ' LEU . 28.0 t-105 -52.59 -40.68 62.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.909 179.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -86.12 -30.91 22.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.425 179.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -57.34 -54.23 49.19 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.424 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 73.7 m -74.69 -75.85 0.15 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.162 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 171.25 38.32 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.619 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.435 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -69.21 -41.7 78.61 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.342 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.433 HD13 HG21 ' A' ' 103' ' ' ILE . 37.1 mm -65.15 -44.08 95.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.757 0.313 . . . . 0.0 110.824 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -49.09 78.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.328 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.428 ' CE2' HG22 ' A' ' 62' ' ' VAL . 2.2 t80 -62.6 -37.89 88.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.065 179.36 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.1 -35.72 76.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.442 179.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.91 -33.24 75.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.306 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 2.6 m -68.78 -49.92 54.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.3 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -69.07 -34.79 75.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.398 0.618 . . . . 0.0 109.772 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.407 HG12 ' HB ' ' A' ' 121' ' ' THR . 2.6 mt -56.94 -47.13 83.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.61 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -72.15 -33.1 67.47 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.562 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.419 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 10.0 t -77.57 -8.94 58.6 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.23 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.419 ' HB2' ' O ' ' A' ' 112' ' ' SER . 74.1 mmt-85 68.81 26.83 5.9 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 120.907 0.384 . . . . 0.0 111.105 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -108.92 -21.9 12.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.774 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -56.81 -22.62 37.64 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.365 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.2 ttt180 68.49 81.83 0.2 Allowed Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.835 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.521 ' HB2' ' HG2' ' A' ' 5' ' ' GLU . 68.7 Cg_exo -51.85 89.42 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.654 2.236 . . . . 0.0 112.489 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 71.5 p -117.9 -36.64 3.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.889 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 12.0 t80 -176.3 -49.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.126 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -55.02 -52.14 64.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.215 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.498 ' OG1' ' HA ' ' A' ' 117' ' ' PRO . 70.5 p -59.58 -45.21 92.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.629 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.94 -55.48 30.18 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 121.662 0.744 . . . . 0.0 109.627 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' MET . . . . . 0.429 ' HA ' ' OD1' ' A' ' 126' ' ' ASN . 0.0 OUTLIER -57.58 -32.75 67.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.784 178.492 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.82 -41.98 82.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.079 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -52.66 -44.53 66.25 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.329 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . 0.429 ' OD1' ' HA ' ' A' ' 123' ' ' MET . 0.9 OUTLIER -81.08 -27.73 35.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.66 179.465 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.423 ' HB2' ' O ' ' A' ' 123' ' ' MET . 1.0 OUTLIER -64.82 -19.26 65.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.851 0.358 . . . . 0.0 110.344 178.958 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 17.8 mt -73.23 -19.93 60.97 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.241 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 3.2 mptt . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.002 -179.992 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.806 0.336 . . . . 0.0 111.008 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.422 ' O ' ' CG ' ' A' ' 5' ' ' GLU . 88.0 mtm-85 -58.37 -59.0 6.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.056 0.455 . . . . 0.0 110.994 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.416 ' O ' ' N ' ' A' ' 7' ' ' ASP . 0.3 OUTLIER -54.13 -34.48 60.44 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.117 0.484 . . . . 0.0 110.065 179.831 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -66.34 -38.9 88.7 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.184 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.422 ' CG ' ' O ' ' A' ' 2' ' ' ARG . 16.7 pt-20 -79.14 -44.28 22.31 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.785 0.326 . . . . 0.0 110.904 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.412 ' CD1' ' O ' ' A' ' 2' ' ' ARG . 2.8 mp -72.68 -58.82 4.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.531 0.681 . . . . 0.0 109.898 178.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.416 ' N ' ' O ' ' A' ' 3' ' ' GLN . 4.6 t70 38.4 83.13 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.575 -1.193 . . . . 0.0 111.738 -179.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -76.24 0.07 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.877 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.9 29.73 0.77 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.397 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -140.73 -168.36 2.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.003 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.84 153.36 17.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.023 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.419 ' HG2' ' CZ ' ' A' ' 119' ' ' TYR . 13.5 mp0 -122.1 102.94 8.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.888 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.481 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -108.99 136.99 47.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.007 0.432 . . . . 0.0 110.833 -179.822 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.508 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 0.4 OUTLIER -119.55 138.87 52.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.189 -179.701 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.481 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 5.5 m-85 -142.3 152.15 42.69 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.463 0.649 . . . . 0.0 112.685 -178.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.494 ' HG3' ' CD2' ' A' ' 38' ' ' TYR . 8.2 ttp180 -149.59 147.41 28.11 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 114.836 -1.074 . . . . 0.0 109.59 179.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.452 ' N ' ' HG2' ' A' ' 16' ' ' ARG . 0.6 OUTLIER -153.4 129.53 5.35 Favored Pre-proline 0 C--N 1.331 -0.235 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.451 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 52.8 Cg_endo -91.88 117.57 0.45 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 123.23 2.62 . . . . 0.0 111.621 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -135.76 160.03 39.81 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.12 0.486 . . . . 0.0 111.558 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.603 HG12 ' HD3' ' A' ' 34' ' ' LYS . 1.9 mt -102.18 147.24 9.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.186 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.9 mtp180 -75.25 141.51 74.03 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.118 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.476 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 11.5 Cg_endo -55.13 -52.36 8.07 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.584 2.189 . . . . 0.0 112.702 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.549 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -53.46 -58.83 5.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.377 -179.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.527 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 20.2 m-20 -67.09 -30.7 70.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.109 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.59 -56.54 14.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.469 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.549 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.3 p90 -91.39 -16.85 26.74 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.659 -179.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.527 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 0.6 OUTLIER -59.51 -45.16 92.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.794 0.331 . . . . 0.0 110.784 179.668 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -168.11 133.18 1.51 Allowed Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.267 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -67.43 -13.49 39.38 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.57 2.18 . . . . 0.0 112.271 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -98.1 -34.29 10.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.383 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -98.54 26.63 5.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.823 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 40.9 mttt -57.98 -67.18 0.37 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.457 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.1 mmmm 60.06 116.4 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.925 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.603 ' HD3' HG12 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -108.38 143.49 37.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.002 0.429 . . . . 0.0 110.964 179.788 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -95.45 139.01 14.27 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.21 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.452 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 12.8 m-90 -97.68 111.08 23.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.112 0.482 . . . . 0.0 110.495 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.478 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 12.1 t90 -95.7 117.5 30.63 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.551 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.494 ' CD2' ' HG3' ' A' ' 16' ' ' ARG . 1.0 OUTLIER -117.86 144.8 45.08 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.153 179.001 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.487 ' HB3' ' CE1' ' A' ' 41' ' ' PHE . . . -170.32 124.5 0.72 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.122 0.487 . . . . 0.0 111.696 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.496 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 8.8 t-160 -92.64 104.34 16.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.341 178.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.622 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 3.5 m-85 -86.86 153.02 21.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.179 0.514 . . . . 0.0 111.658 -178.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.445 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 28.1 p-10 -123.19 114.06 19.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.073 178.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 59.23 -135.49 51.61 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 119.892 -1.147 . . . . 0.0 111.151 -178.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.416 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 7.6 Cg_exo -72.7 -17.61 25.92 Favored 'Trans proline' 0 N--CA 1.464 -0.227 0 C-N-CA 122.506 2.137 . . . . 0.0 112.469 179.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' TRP . . . . . 0.421 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.7 OUTLIER -116.02 -165.91 1.09 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.514 -178.584 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.622 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 2.4 tt -128.1 151.87 35.47 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-O 121.122 0.487 . . . . 0.0 111.927 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -103.03 -40.78 6.34 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.531 -0.758 . . . . 0.0 111.816 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.483 ' HG3' ' HB3' ' A' ' 40' ' ' HIS . 0.3 OUTLIER -144.85 154.28 42.49 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 120.7 -0.4 . . . . 0.0 111.396 -179.535 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.42 ' HB2' HD12 ' A' ' 46' ' ' ILE . 7.9 tt0 -141.13 141.73 34.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.362 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 5.3 ttm -135.99 111.64 9.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.178 179.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.467 ' HB3' ' HB ' ' A' ' 59' ' ' ILE . 4.5 tt0 -102.82 137.41 41.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.892 0.377 . . . . 0.0 111.523 -179.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.46 ' CD1' ' CE1' ' A' ' 38' ' ' TYR . 3.2 mt -133.79 124.78 27.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.8 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 25.6 m-70 -139.33 134.61 16.61 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.537 -0.302 . . . . 0.0 111.1 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -50.64 -25.71 15.45 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.54 2.16 . . . . 0.0 112.245 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -99.53 -27.37 13.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.006 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -114.47 118.99 40.8 Favored Pre-proline 0 C--O 1.234 0.262 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.826 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -49.7 177.37 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.565 2.177 . . . . 0.0 112.559 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -58.67 85.74 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.699 2.266 . . . . 0.0 112.216 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.467 ' HB ' ' HB3' ' A' ' 51' ' ' GLU . 44.4 mt -71.34 101.28 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.77 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.423 ' HG ' ' CZ3' ' A' ' 97' ' ' TRP . 1.1 mp -78.66 144.66 35.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.096 -179.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.405 HD22 ' CB ' ' A' ' 66' ' ' ASP . 84.5 mt -146.21 151.17 37.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.966 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.5 p -156.48 149.88 10.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.987 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.69 140.47 58.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.209 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.56 -49.46 1.46 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.332 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.08 -63.03 1.36 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.885 0.374 . . . . 0.0 110.727 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.405 ' CB ' HD22 ' A' ' 61' ' ' LEU . 18.6 m-20 -101.24 55.01 0.83 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.8 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.06 -27.26 63.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.971 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 50.0 mtp -84.77 -28.9 25.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.991 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -87.49 -42.08 13.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.09 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.8 ptm -57.25 -166.92 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.074 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 17.0 t -81.52 104.5 11.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.087 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -73.77 -17.96 61.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.935 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -78.84 177.12 8.96 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.018 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -105.37 -173.59 2.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.857 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.444 ' O ' ' OG1' ' A' ' 78' ' ' THR . 0.7 OUTLIER -54.72 -53.08 59.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.744 -179.462 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -71.58 -54.36 10.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.871 0.367 . . . . 0.0 111.787 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.03 -38.2 36.57 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.444 ' OG1' ' O ' ' A' ' 75' ' ' LEU . 2.0 p -48.12 -61.56 1.92 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.777 0.322 . . . . 0.0 111.543 -179.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 125.15 -28.68 5.04 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.703 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.425 ' CD2' ' CD1' ' A' ' 17' ' ' ILE . 1.1 mt -49.05 -45.55 43.07 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.998 0.428 . . . . 0.0 110.737 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.89 -32.26 61.8 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.46 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 5.9 mmm180 -61.74 -32.07 72.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.493 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.3 -174.65 5.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.631 179.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 8.4 mpt_? -102.47 119.48 38.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.946 0.403 . . . . 0.0 111.123 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 60.65 85.25 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.749 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -130.92 19.79 5.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.639 0.257 . . . . 0.0 111.244 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.464 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 30.5 mt-10 -99.83 160.0 14.64 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.959 0.409 . . . . 0.0 111.239 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.445 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 0.8 OUTLIER -138.16 174.51 10.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.042 179.916 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.44 HD11 ' CB ' ' A' ' 91' ' ' ARG . 0.4 OUTLIER -98.06 147.99 33.85 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.545 179.584 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -66.97 -22.98 47.43 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.483 2.122 . . . . 0.0 112.7 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.44 ' CB ' HD11 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -61.02 -54.79 40.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.786 0.327 . . . . 0.0 111.082 -179.767 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.451 ' HG3' ' N ' ' A' ' 93' ' ' PHE . 0.0 OUTLIER -70.51 -34.84 72.78 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.03 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.454 ' CE1' ' HD3' ' A' ' 48' ' ' ARG . 21.8 t80 -62.64 -53.23 57.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.482 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.81 -22.05 63.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.548 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.11 -50.82 71.67 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 179.157 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.431 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 17.5 mm -71.53 -35.93 58.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.259 178.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.423 ' CZ3' ' HG ' ' A' ' 60' ' ' LEU . 18.4 t-105 -53.45 -40.49 65.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.029 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -85.72 -23.93 27.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.816 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.431 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 7.4 mtt-85 -56.85 -54.1 50.28 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.053 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 43.1 t -81.51 -81.32 0.14 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.037 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -173.98 39.64 0.13 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.553 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.416 ' HA2' ' CD2' ' A' ' 60' ' ' LEU . . . -61.33 -55.23 30.36 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.634 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.1 mm -57.18 -42.95 80.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.769 0.318 . . . . 0.0 111.173 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -65.25 -49.28 70.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.681 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -60.57 -40.07 90.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.514 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.38 -45.93 65.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.87 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -61.88 -29.95 70.54 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.988 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 54.6 p -72.55 -50.32 26.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.805 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.93 -35.9 77.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.579 0.704 . . . . 0.0 109.161 178.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.414 ' CD1' HD22 ' A' ' 124' ' ' LEU . 13.6 mt -58.59 -44.3 89.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.912 178.772 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.96 -43.13 83.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.535 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.436 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 5.9 m -72.58 -10.09 59.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.246 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 112' ' ' SER . 16.3 mmt180 75.39 27.28 1.07 Allowed 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.909 0.385 . . . . 0.0 110.987 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -92.31 -28.67 16.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.384 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -82.95 94.66 7.78 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.749 179.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.8 ptt180 -53.29 118.37 14.1 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.218 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -52.96 88.53 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.519 2.146 . . . . 0.0 112.124 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 5.2 t -110.2 -46.29 3.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.052 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.419 ' CZ ' ' HG2' ' A' ' 12' ' ' GLN . 9.8 t80 -177.36 -54.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.187 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.462 ' O ' ' HG3' ' A' ' 123' ' ' MET . . . -53.82 -40.31 66.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.863 0.363 . . . . 0.0 111.177 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 62.6 p -69.27 -43.74 73.29 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.481 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.57 -58.12 9.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.172 0.511 . . . . 0.0 110.239 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' MET . . . . . 0.462 ' HG3' ' O ' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -55.36 -29.93 59.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.046 179.119 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.436 ' N ' ' HE1' ' A' ' 123' ' ' MET . 0.1 OUTLIER -67.17 -48.94 66.46 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 121.022 0.439 . . . . 0.0 109.852 178.805 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -50.01 -39.62 41.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.796 179.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -80.09 -35.16 37.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.059 178.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.81 -20.29 34.63 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.652 179.046 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 9.6 mt -82.51 -23.02 34.82 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.141 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 12.2 mmtp . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.164 -0.922 . . . . 0.0 110.927 179.906 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.832 0.349 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -55.5 -57.45 11.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.832 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.82 -40.55 66.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.851 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -58.08 -37.41 74.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.613 179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -71.49 -56.85 5.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.987 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.408 HG22 ' CB ' ' A' ' 122' ' ' ALA . 2.8 mp -54.05 -62.69 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.349 179.025 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.0 t70 47.72 92.19 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.083 -179.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.0 mtm -87.51 67.2 9.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.565 0.698 . . . . 0.0 110.715 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.3 mttp -148.69 34.25 0.77 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.791 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -121.58 -166.61 1.4 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.012 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -93.04 125.25 37.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.986 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.432 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 7.9 mp0 -111.96 102.8 11.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.974 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.512 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 2.9 mtt180 -113.92 126.8 55.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.977 0.418 . . . . 0.0 110.953 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.493 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 2.2 m-85 -109.0 134.99 50.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.884 179.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.512 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 2.6 m-85 -131.25 152.65 50.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.29 0.567 . . . . 0.0 112.335 -178.374 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.486 ' HB3' ' CG2' ' A' ' 88' ' ' ILE . 41.3 ttp85 -149.28 148.06 29.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.92 179.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -152.08 121.73 3.45 Favored Pre-proline 0 C--N 1.329 -0.286 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.646 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -86.15 88.41 0.78 Allowed 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.93 2.42 . . . . 0.0 112.32 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.7 p90 -116.0 139.66 50.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.931 0.396 . . . . 0.0 111.02 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.423 HG12 ' HD2' ' A' ' 34' ' ' LYS . 13.2 mt -86.85 142.58 12.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.927 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.8 110.22 2.35 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.118 179.369 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.499 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 76.4 Cg_exo -39.76 -51.84 2.83 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.795 2.33 . . . . 0.0 112.863 -179.393 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.534 ' O ' ' HG2' ' A' ' 27' ' ' LYS . . . -50.07 -58.76 4.83 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.871 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.517 ' HA ' ' HG2' ' A' ' 27' ' ' LYS . 6.1 m-20 -67.07 -33.05 74.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.24 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.07 -43.55 63.89 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.736 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.528 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.7 p90 -104.59 -34.93 8.02 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -178.031 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.534 ' HG2' ' O ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -61.84 -32.31 72.63 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.664 -0.415 . . . . 0.0 111.601 -178.774 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -150.2 120.32 3.83 Favored Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 120.844 -0.343 . . . . 0.0 111.523 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -72.67 -7.84 21.47 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.539 2.159 . . . . 0.0 112.321 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -109.81 -32.41 7.08 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.937 0.399 . . . . 0.0 110.394 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -97.72 28.18 3.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.658 179.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.5 mttt -59.83 -59.05 6.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.918 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.8 mmtt 70.54 113.78 0.05 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.599 -179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.423 ' HD2' HG12 ' A' ' 20' ' ' ILE . 0.3 OUTLIER -83.01 110.86 18.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.489 -179.938 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.432 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -91.34 117.59 5.22 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.833 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 10.1 m-90 -97.84 126.24 43.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.853 0.359 . . . . 0.0 110.431 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 11.2 t90 -113.65 119.87 38.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.614 -179.192 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.48 ' CE2' ' CD ' ' A' ' 16' ' ' ARG . 4.1 m-85 -115.96 150.46 37.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.941 178.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.518 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . . . -170.45 123.75 0.68 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.161 0.505 . . . . 0.0 111.61 179.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.493 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 18.0 t-160 -93.17 98.28 11.19 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.451 178.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.65 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 20.4 m-85 -85.93 127.31 34.58 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.426 -179.146 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.562 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 25.0 p-10 -93.7 110.99 22.59 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 178.53 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 58.93 -134.53 52.44 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.053 -1.07 . . . . 0.0 111.122 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.402 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 8.8 Cg_exo -71.66 -19.64 27.62 Favored 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 122.489 2.126 . . . . 0.0 112.204 179.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' TRP . . . . . 0.423 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.6 OUTLIER -112.82 -170.11 1.61 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.274 -178.851 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.65 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 3.2 tt -127.35 151.69 34.49 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-O 121.263 0.554 . . . . 0.0 112.114 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -111.6 -32.64 6.61 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.917 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.47 ' CZ ' ' CE2' ' A' ' 93' ' ' PHE . 4.2 ptm180 -157.19 154.97 30.11 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.46 -179.678 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.518 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 0.3 OUTLIER -161.55 159.02 27.26 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.242 179.801 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 11.3 ttp -134.46 154.84 51.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.852 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.453 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.2 OUTLIER -129.49 117.67 20.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.897 179.694 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.3 mt -120.35 106.18 11.62 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.876 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.432 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 6.8 m170 -127.54 134.12 25.84 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.698 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -51.94 -23.44 16.58 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.342 2.028 . . . . 0.0 112.262 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -100.34 -26.95 13.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.113 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.408 ' HB2' ' HB2' ' A' ' 53' ' ' HIS . 7.9 mttt -117.84 126.02 27.61 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.977 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -54.9 173.46 0.27 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.767 2.312 . . . . 0.0 112.463 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -60.25 88.02 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.714 2.276 . . . . 0.0 112.383 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.453 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 75.0 mt -70.4 100.57 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.799 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.425 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.3 OUTLIER -77.97 123.99 27.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.693 -179.966 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.439 HD12 ' CB ' ' A' ' 69' ' ' GLU . 2.8 mm? -121.02 139.55 53.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.25 -179.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.2 p -149.14 139.26 16.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.951 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.16 155.95 13.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.988 -179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 85.76 -63.49 4.25 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.112 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.19 -67.93 0.6 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.997 0.427 . . . . 0.0 110.483 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.403 ' HB3' ' CD1' ' A' ' 61' ' ' LEU . 5.6 m-20 -97.11 47.16 1.04 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.404 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.447 ' HA ' ' HG2' ' A' ' 70' ' ' MET . 1.4 t0 -63.31 -25.35 68.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.438 -179.601 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -85.56 -35.73 20.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.753 0.311 . . . . 0.0 111.151 -179.696 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.439 ' CB ' HD12 ' A' ' 61' ' ' LEU . 1.1 mp0 -80.18 -36.22 35.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.256 -179.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.447 ' HG2' ' HA ' ' A' ' 67' ' ' ASP . 0.7 OUTLIER -56.0 -169.36 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.876 0.37 . . . . 0.0 111.146 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 3.5 m -68.19 -44.38 76.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.571 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 69.23 -64.65 0.33 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.101 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 11.0 mptt -54.3 178.91 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.113 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -94.67 -168.69 1.88 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.604 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.45 HD23 ' CE1' ' A' ' 15' ' ' PHE . 7.8 mt -71.99 -53.38 13.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.386 -179.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -31.69 70.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.219 -179.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -80.5 -36.37 33.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.327 -179.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -61.54 -80.06 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.051 -179.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 147.53 -16.43 1.45 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.507 -0.854 . . . . 0.0 113.038 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.3 mt -53.89 -35.24 61.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.905 0.383 . . . . 0.0 110.915 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 22.6 p -81.81 -39.92 23.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.594 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.5 mmm180 -63.97 -30.54 71.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.545 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -165.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.728 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -102.23 83.48 2.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.778 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.15 71.26 0.78 Allowed Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.336 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.431 ' O ' ' HA ' ' A' ' 15' ' ' PHE . . . -98.17 34.42 1.96 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.666 0.269 . . . . 0.0 110.978 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -90.9 147.81 22.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.224 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.486 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 1.3 pt -139.09 179.46 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.057 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -106.33 149.9 38.81 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.648 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -61.98 -30.7 83.67 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.506 2.137 . . . . 0.0 112.215 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.51 -54.0 50.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.351 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -64.02 -53.84 43.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.418 -179.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.47 ' CE2' ' CZ ' ' A' ' 48' ' ' ARG . 6.2 t80 -52.65 -53.23 50.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.189 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.402 ' OE2' ' NH1' ' A' ' 48' ' ' ARG . 1.2 tt0 -66.58 -22.75 66.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.39 179.562 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.09 -50.36 73.56 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.161 0.505 . . . . 0.0 109.756 179.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 17.0 mm -71.48 -34.5 53.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.662 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.45 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 25.5 t-105 -54.33 -38.14 65.67 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.031 179.27 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -85.55 -27.85 25.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.659 179.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.3 mtp85 -56.82 -50.65 71.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.13 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 76.6 m -84.97 -80.79 0.2 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.153 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -178.99 37.55 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.614 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.45 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -59.66 -59.59 10.27 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.492 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.402 HG22 ' CD2' ' A' ' 124' ' ' LEU . 3.8 mp -52.8 -30.39 15.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.808 0.337 . . . . 0.0 111.477 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.83 -45.34 74.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.003 0.43 . . . . 0.0 110.578 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -68.23 -39.44 82.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.42 179.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.45 ' HB3' ' CD2' ' A' ' 124' ' ' LEU . 0.4 OUTLIER -69.68 -50.97 38.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.03 -179.852 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -29.59 69.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.87 0.366 . . . . 0.0 110.789 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 6.1 m -69.01 -50.12 51.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.653 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.64 -32.73 68.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.507 0.67 . . . . 0.0 109.854 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.478 ' CG1' HG23 ' A' ' 121' ' ' THR . 9.3 mt -58.97 -48.48 86.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 114.869 -1.059 . . . . 0.0 110.584 179.428 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -70.57 -35.78 73.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.578 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.5 -15.39 62.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.055 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 9.5 mmm180 74.97 35.27 0.62 Allowed 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.876 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -108.67 -27.35 9.87 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.792 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.14 -172.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.149 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 3.2 ttt180 -129.66 93.7 34.11 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.906 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -50.41 89.47 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.532 2.155 . . . . 0.0 112.323 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 6.5 p -129.07 -51.97 1.21 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.878 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.432 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 13.4 t80 -165.56 -55.49 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.265 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.428 ' O ' ' HG3' ' A' ' 123' ' ' MET . . . -53.96 -42.61 69.1 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.273 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.478 HG23 ' CG1' ' A' ' 110' ' ' ILE . 10.2 p -66.6 -38.74 87.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.686 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.408 ' CB ' HG22 ' A' ' 6' ' ' ILE . . . -67.73 -58.41 4.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.145 0.498 . . . . 0.0 110.688 179.727 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' MET . . . . . 0.436 ' HE3' ' N ' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -53.04 -29.6 30.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.414 179.521 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.45 ' CD2' ' HB3' ' A' ' 106' ' ' LEU . 0.4 OUTLIER -66.39 -52.74 43.62 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.02 0.438 . . . . 0.0 109.944 178.961 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -49.87 -37.04 29.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.012 179.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -80.99 -34.19 33.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.227 179.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.06 -18.85 60.08 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.398 179.082 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.9 mt -86.34 -30.25 22.35 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.88 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.146 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.853 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 121.006 0.431 . . . . 0.0 110.966 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.417 ' O ' ' CD1' ' A' ' 6' ' ' ILE . 0.1 OUTLIER -56.25 -59.4 4.99 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.741 -179.998 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.431 ' HA ' HD12 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -53.29 -39.63 64.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.731 179.774 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -57.87 -36.74 72.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.358 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.436 ' HB2' ' HB2' ' A' ' 117' ' ' PRO . 1.0 OUTLIER -70.97 -57.04 4.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.099 179.443 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.431 HD12 ' HA ' ' A' ' 3' ' ' GLN . 3.7 mp -52.45 -61.03 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.498 0.665 . . . . 0.0 109.996 178.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 53.8 t0 43.65 88.31 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.524 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.8 ptp -89.94 50.69 1.92 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.811 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.0 mttm -87.66 -35.24 18.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.904 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -180.0 3.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.93 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -82.42 158.14 23.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.015 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.43 ' HG2' ' CZ ' ' A' ' 119' ' ' TYR . 8.2 mp0 -122.02 103.45 8.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.907 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.49 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -110.79 130.0 55.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.948 0.404 . . . . 0.0 110.893 179.829 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.518 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 0.9 OUTLIER -115.27 135.15 54.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.307 -179.946 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.544 ' HA ' ' HA ' ' A' ' 87' ' ' GLU . 0.3 OUTLIER -140.4 153.57 46.38 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.365 0.602 . . . . 0.0 112.219 -179.713 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.481 ' HB3' ' CG2' ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.58 143.0 25.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.393 179.112 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.425 HD11 HD11 ' A' ' 80' ' ' LEU . 0.3 OUTLIER -141.05 135.63 15.42 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 120.857 0.36 . . . . 0.0 111.919 -179.376 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.488 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 61.7 Cg_endo -92.07 103.28 0.21 Allowed 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 123.301 2.667 . . . . 0.0 112.296 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 15.1 p90 -123.31 148.79 45.6 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.937 0.398 . . . . 0.0 110.934 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 3.8 mt -94.3 149.25 4.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.016 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -71.86 131.13 86.01 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.678 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.524 ' CA ' ' HG3' ' A' ' 25' ' ' GLN . 77.6 Cg_exo -40.21 -60.16 0.62 Allowed 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.974 2.449 . . . . 0.0 113.138 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.608 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -45.85 -53.8 9.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.866 -179.596 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.432 ' HB3' ' HA ' ' A' ' 32' ' ' LYS . 4.3 m-20 -62.96 -34.49 77.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.257 -178.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.524 ' HG3' ' CA ' ' A' ' 22' ' ' PRO . 1.1 mt-30 -58.12 -57.49 12.59 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.703 0.287 . . . . 0.0 111.631 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.608 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.6 p90 -84.71 -7.5 59.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.641 -179.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.0 mtpp -74.1 -42.93 59.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.843 0.354 . . . . 0.0 110.56 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -173.07 139.0 0.85 Allowed Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.037 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.81 -21.54 33.11 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.6 2.2 . . . . 0.0 112.366 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -97.97 -31.72 12.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.715 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -100.25 42.63 1.1 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.778 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.432 ' HA ' ' HB3' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -102.26 60.44 0.84 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.508 179.703 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.402 ' HB3' ' HG2' ' A' ' 54' ' ' PRO . 13.9 mmtp -36.92 115.82 0.4 Allowed 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.679 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -85.22 134.04 34.16 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.207 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.417 ' HA2' ' HD3' ' A' ' 54' ' ' PRO . . . -120.93 138.58 12.76 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.648 -0.786 . . . . 0.0 112.531 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.488 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 29.3 m-90 -97.91 148.05 23.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.905 0.383 . . . . 0.0 110.82 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.413 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 86.4 t90 -130.93 117.36 19.14 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.909 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.452 ' CE2' ' HD2' ' A' ' 16' ' ' ARG . 2.2 m-85 -112.67 152.81 28.56 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.847 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.45 ' HB2' ' CE1' ' A' ' 41' ' ' PHE . . . -170.77 124.74 0.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.302 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.518 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 12.1 t-160 -93.92 101.74 13.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.151 179.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.574 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 11.0 m-85 -85.86 126.19 33.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.513 -179.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.461 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 4.2 m-20 -100.09 116.92 33.24 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 178.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 59.63 -140.09 48.18 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 119.986 -1.102 . . . . 0.0 111.014 -178.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -72.1 -12.68 28.25 Favored 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.489 2.126 . . . . 0.0 112.208 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' TRP . . . . . . . . . . . . . 1.2 m95 -118.22 -168.25 1.49 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.936 0.398 . . . . 0.0 111.95 -178.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.574 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 4.3 tt -134.73 156.12 39.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.576 -179.429 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.404 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -132.45 -28.32 1.67 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.123 -179.472 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.455 ' CB ' ' HB3' ' A' ' 40' ' ' HIS . 6.5 ttm180 -115.57 133.53 55.94 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.828 0.347 . . . . 0.0 111.107 -179.559 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.423 ' HB3' ' HB3' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -137.63 134.14 35.15 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.853 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 3.1 ttm -141.16 111.77 6.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.724 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.76 135.76 38.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.997 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.432 HD11 ' CE1' ' A' ' 38' ' ' TYR . 38.3 mt -131.13 102.14 5.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.744 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -121.66 138.4 28.4 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.918 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.417 ' HD3' ' HA2' ' A' ' 35' ' ' GLY . 50.3 Cg_exo -54.44 -29.4 58.87 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.45 2.1 . . . . 0.0 112.388 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 37.2 p30 -95.75 -20.71 18.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.193 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.8 mttt -124.2 115.16 27.5 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.834 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -47.17 173.34 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.512 2.141 . . . . 0.0 112.451 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -54.53 88.5 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.489 2.126 . . . . 0.0 112.356 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 5.4 mt -65.77 104.6 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.906 179.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.61 ' HG ' ' HA2' ' A' ' 102' ' ' GLY . 0.0 OUTLIER -76.43 133.22 39.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.804 -179.995 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.423 ' HB3' ' HB3' ' A' ' 49' ' ' GLN . 0.7 OUTLIER -141.32 154.43 45.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.087 -179.928 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.5 p -157.63 144.09 9.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.826 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.433 ' N ' ' CE ' ' A' ' 70' ' ' MET . . . -55.68 151.63 10.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.855 0.359 . . . . 0.0 111.198 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.08 -63.3 4.46 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.217 -179.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.95 -31.54 63.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.939 0.399 . . . . 0.0 110.573 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.414 ' CB ' ' HG ' ' A' ' 61' ' ' LEU . 9.3 m-20 -119.56 56.72 0.93 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.664 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.05 -32.22 73.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.071 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.57 -34.33 21.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.274 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.421 ' HB3' ' CD2' ' A' ' 61' ' ' LEU . 11.9 mp0 -81.15 -51.65 8.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.123 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.433 ' CE ' ' N ' ' A' ' 63' ' ' ALA . 28.0 tpp -38.36 152.1 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.415 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 0.42 ' O ' ' CB ' ' A' ' 72' ' ' GLU . 0.5 OUTLIER -42.04 -60.15 1.52 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.221 179.97 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.42 ' CB ' ' O ' ' A' ' 71' ' ' CYS . 0.0 OUTLIER 83.51 -21.79 0.26 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.934 179.647 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -94.74 122.48 37.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.644 0.259 . . . . 0.0 110.834 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.411 ' N ' ' CG ' ' A' ' 77' ' ' GLU . 7.2 m120 -50.83 176.09 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.886 0.374 . . . . 0.0 111.053 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.425 HD21 ' CD2' ' A' ' 41' ' ' PHE . 0.6 OUTLIER -50.65 -46.71 58.52 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.2 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.92 -56.31 12.4 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.537 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.411 ' CG ' ' N ' ' A' ' 74' ' ' ASN . 1.1 pm0 -61.45 -18.08 57.34 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.458 ' HB ' HD21 ' A' ' 80' ' ' LEU . 0.3 OUTLIER -74.81 -63.62 1.21 Allowed 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.917 179.843 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 122.83 -12.85 8.67 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.586 -0.816 . . . . 0.0 113.101 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.471 HD12 ' HB3' ' A' ' 15' ' ' PHE . 3.4 mm? -54.13 -36.67 63.51 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.267 0.556 . . . . 0.0 110.387 179.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 45.9 p -83.94 -21.51 31.8 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.912 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 7.7 mtt180 -84.52 -11.89 55.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.592 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.464 ' HB3' ' HB1' ' A' ' 86' ' ' ALA . 0.3 OUTLIER -93.34 24.7 3.75 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.958 0.409 . . . . 0.0 111.34 -179.849 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.5 mmt85 37.73 93.94 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 77.64 46.53 9.66 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.764 -0.732 . . . . 0.0 113.585 178.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.464 ' HB1' ' HB3' ' A' ' 83' ' ' LYS . . . -101.82 16.6 25.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.79 0.295 . . . . 0.0 111.011 179.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.544 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -89.27 167.08 13.36 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.898 0.38 . . . . 0.0 111.353 -179.673 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.481 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 0.9 OUTLIER -143.45 -179.95 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.999 179.843 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.76 155.77 36.01 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.743 179.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.29 -22.87 24.85 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.499 2.132 . . . . 0.0 112.404 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.91 -54.04 51.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.116 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -66.4 -38.28 87.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.903 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.43 ' CE1' ' HD2' ' A' ' 48' ' ' ARG . 15.3 t80 -58.28 -53.15 61.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.919 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.411 ' OE1' ' NH1' ' A' ' 48' ' ' ARG . 0.2 OUTLIER -70.13 -23.56 63.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.782 179.852 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.27 -50.95 72.03 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 179.04 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 20.5 mm -74.8 -30.79 24.89 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.954 178.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.426 ' CD1' ' HA3' ' A' ' 102' ' ' GLY . 24.2 t-105 -57.6 -36.4 71.7 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.737 178.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -85.41 -29.4 24.42 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.289 179.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 7.7 mtm180 -56.66 -52.97 62.87 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.108 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 42.6 t -83.5 -82.02 0.16 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.3 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -177.02 37.47 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.525 -0.845 . . . . 0.0 112.791 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.61 ' HA2' ' HG ' ' A' ' 60' ' ' LEU . . . -56.08 -64.39 4.43 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.416 179.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.406 ' CG2' ' CD2' ' A' ' 128' ' ' LEU . 3.7 mp -52.94 -33.54 19.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.974 0.416 . . . . 0.0 111.181 179.682 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -68.17 -45.42 73.53 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.514 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -68.03 -41.69 81.75 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.424 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.409 ' HB3' ' CD2' ' A' ' 124' ' ' LEU . 0.3 OUTLIER -66.91 -51.13 59.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.83 179.86 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.411 ' HA ' ' HB ' ' A' ' 110' ' ' ILE . 0.0 OUTLIER -60.39 -29.23 68.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.846 179.919 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' SER . . . . . 0.41 ' N ' ' HG3' ' A' ' 107' ' ' GLN . 12.3 t -68.23 -50.69 52.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.735 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.99 -33.94 70.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.5 0.667 . . . . 0.0 109.35 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.42 ' CD1' HD21 ' A' ' 124' ' ' LEU . 10.3 mt -56.61 -46.11 82.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.009 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -68.63 -37.7 79.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.147 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' SER . . . . . 0.446 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 5.2 t -72.27 -10.51 59.88 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.9 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 112' ' ' SER . 3.6 mpp_? 69.65 32.51 3.29 Favored 'General case' 0 C--O 1.23 0.079 0 CA-C-O 121.015 0.436 . . . . 0.0 111.097 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.5 mt-30 -106.3 -25.92 11.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.398 179.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -75.99 90.57 3.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.078 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 12.2 mtt180 -48.86 105.57 0.52 Allowed Pre-proline 0 C--N 1.331 -0.198 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.833 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.436 ' HB2' ' HB2' ' A' ' 5' ' ' GLU . 50.0 Cg_exo -53.44 98.84 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.392 2.061 . . . . 0.0 112.566 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 79.5 m -112.63 -43.86 3.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.609 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.43 ' CZ ' ' HG2' ' A' ' 12' ' ' GLN . 14.8 t80 -178.23 -47.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.951 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.454 ' O ' ' HG3' ' A' ' 123' ' ' MET . . . -56.31 -39.21 72.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.265 -179.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.423 ' OG1' ' HA ' ' A' ' 117' ' ' PRO . 37.7 p -68.98 -37.26 78.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.506 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.96 -58.35 8.93 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.214 0.53 . . . . 0.0 110.332 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' MET . . . . . 0.473 ' HE2' ' N ' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -58.17 -29.4 65.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.167 178.934 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.473 ' N ' ' HE2' ' A' ' 123' ' ' MET . 0.3 OUTLIER -70.28 -46.93 63.35 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.145 0.498 . . . . 0.0 109.875 178.982 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 17.8 mm-40 -50.73 -40.98 55.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.652 -0.703 . . . . 0.0 109.807 179.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 28.4 m-20 -76.1 -34.35 59.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.857 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.14 -20.0 56.36 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.374 178.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.406 ' CD2' ' CG2' ' A' ' 103' ' ' ILE . 1.0 OUTLIER -148.5 81.82 1.46 Allowed 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.938 179.991 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.988 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.914 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.989 0.423 . . . . 0.0 111.015 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.417 ' O ' HD13 ' A' ' 6' ' ' ILE . 0.1 OUTLIER -58.44 -59.2 5.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.951 179.999 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.541 ' HA ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -52.58 -38.28 59.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.738 179.959 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -57.51 -47.36 82.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.885 0.374 . . . . 0.0 110.29 179.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -55.82 -53.54 55.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.134 -0.485 . . . . 0.0 109.931 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.541 HD13 ' HA ' ' A' ' 3' ' ' GLN . 3.3 mp -56.24 -58.79 4.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.231 179.009 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.404 ' C ' ' O ' ' A' ' 6' ' ' ILE . 1.0 OUTLIER 30.79 72.91 0.06 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.904 -1.044 . . . . 0.0 111.853 -179.923 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.9 mtm -66.58 -72.8 0.15 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.163 -179.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.0 mtmm 50.27 29.72 3.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.137 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.6 176.12 8.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.997 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -81.59 137.28 35.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.995 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.436 ' HG3' ' CE2' ' A' ' 119' ' ' TYR . 33.7 mm-40 -100.72 102.74 13.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.751 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.568 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -110.27 124.75 52.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.031 -179.45 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.502 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 1.1 m-85 -110.77 152.91 26.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.473 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.568 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 4.4 m-85 -152.2 152.73 32.61 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.367 0.603 . . . . 0.0 112.178 -179.559 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.458 ' HG3' ' CE2' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -148.96 139.43 22.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.394 179.217 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -142.25 125.72 9.6 Favored Pre-proline 0 C--N 1.329 -0.295 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.731 -179.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.498 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 67.9 Cg_endo -89.86 101.71 0.32 Allowed 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 123.065 2.51 . . . . 0.0 112.155 179.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.1 p90 -120.02 145.42 46.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.856 0.36 . . . . 0.0 110.912 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.46 HG12 ' HG3' ' A' ' 34' ' ' LYS . 3.0 mt -89.63 150.34 3.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.925 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -72.15 126.65 91.1 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.719 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.543 ' CA ' ' HG3' ' A' ' 25' ' ' GLN . 70.3 Cg_exo -39.83 -60.33 0.57 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.043 2.495 . . . . 0.0 113.097 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.641 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -44.87 -52.71 8.33 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.837 -179.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.487 ' HB3' ' HA ' ' A' ' 32' ' ' LYS . 2.1 m-20 -65.62 -37.06 85.52 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.508 -178.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.543 ' HG3' ' CA ' ' A' ' 22' ' ' PRO . 1.0 OUTLIER -54.91 -57.53 11.27 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -178.866 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.641 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.0 p90 -83.75 -16.75 43.6 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.706 -179.22 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.405 ' CD ' ' O ' ' A' ' 23' ' ' ALA . 1.0 OUTLIER -60.98 -47.1 88.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.755 0.312 . . . . 0.0 110.286 179.564 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 177.08 141.28 0.24 Allowed Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.124 179.378 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.42 -19.01 66.08 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.621 2.214 . . . . 0.0 112.289 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -86.34 -39.43 16.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.589 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -105.87 57.83 0.66 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.69 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.487 ' HA ' ' HB3' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -111.7 54.76 0.68 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.607 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -41.58 138.46 1.35 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.549 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.46 ' HG3' HG12 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -107.93 144.03 35.75 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.046 0.451 . . . . 0.0 111.862 -179.42 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -121.28 129.44 7.76 Favored Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.807 179.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.498 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 28.9 m-90 -98.08 133.99 41.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.013 0.435 . . . . 0.0 111.146 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 15.6 t90 -113.48 117.27 31.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.965 -179.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.458 ' CE2' ' HG3' ' A' ' 16' ' ' ARG . 10.9 m-85 -110.38 147.57 33.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.219 179.534 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.405 ' CB ' ' NE2' ' A' ' 49' ' ' GLN . . . -170.13 124.71 0.75 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.059 0.457 . . . . 0.0 111.992 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.502 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 12.7 t-160 -97.68 98.04 9.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.375 178.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.605 ' CG ' ' HB ' ' A' ' 46' ' ' ILE . 11.8 m-85 -85.32 119.34 25.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.715 -178.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.448 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 3.3 p-10 -91.21 114.8 27.43 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 178.451 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 57.69 -135.95 51.23 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 119.908 -1.139 . . . . 0.0 111.153 -178.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.41 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 7.9 Cg_exo -72.62 -17.31 26.44 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 122.536 2.158 . . . . 0.0 112.444 179.585 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' TRP . . . . . 0.41 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 0.7 OUTLIER -115.36 -172.67 2.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.946 0.403 . . . . 0.0 111.8 -178.595 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.605 ' HB ' ' CG ' ' A' ' 41' ' ' PHE . 2.8 tt -131.98 153.67 38.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.726 -179.567 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.409 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -127.24 -26.77 3.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.646 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.487 ' CB ' ' HB3' ' A' ' 40' ' ' HIS . 2.1 ttp180 -117.5 136.77 53.0 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-O 120.817 0.341 . . . . 0.0 111.295 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.405 ' NE2' ' CB ' ' A' ' 39' ' ' ALA . 0.7 OUTLIER -145.12 132.48 20.65 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.887 179.967 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 2.5 ttm -143.48 129.45 19.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.677 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.469 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -114.11 140.71 48.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.165 -179.61 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.419 HD11 ' CE1' ' A' ' 38' ' ' TYR . 31.1 mt -135.29 108.53 7.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.811 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 -135.85 138.2 27.29 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.858 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -52.8 -23.88 22.03 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.602 2.201 . . . . 0.0 112.254 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -96.18 -28.71 14.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.999 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 1.8 mtpp -118.3 122.14 30.51 Favored Pre-proline 0 C--O 1.233 0.229 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.844 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.36 -179.99 0.07 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.582 2.188 . . . . 0.0 112.237 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -56.75 85.08 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.545 2.163 . . . . 0.0 112.332 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.469 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 91.1 mt -65.42 98.06 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.8 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.421 HD11 ' CZ3' ' A' ' 97' ' ' TRP . 0.4 OUTLIER -82.2 112.83 19.58 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.703 -179.975 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.403 ' CD1' ' HB3' ' A' ' 69' ' ' GLU . 71.9 mt -123.6 148.24 46.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.071 0.462 . . . . 0.0 111.324 -179.64 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.4 p -149.43 150.66 13.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.787 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.38 145.81 36.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.846 0.355 . . . . 0.0 111.305 -179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.92 -61.41 4.05 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.159 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -72.23 -68.38 0.47 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.896 0.379 . . . . 0.0 110.603 179.735 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -98.91 36.56 1.66 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.607 179.753 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.5 -21.28 36.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.284 -179.746 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 3.6 mpp? -82.13 -31.92 30.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.848 0.356 . . . . 0.0 110.659 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.403 ' HB3' ' CD1' ' A' ' 61' ' ' LEU . 1.9 mm-40 -84.69 -43.91 13.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.718 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 47.5 ttm -55.55 163.47 1.29 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.608 179.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -55.72 120.53 7.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.819 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -88.15 8.14 28.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.384 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.4 144.71 44.69 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.901 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -65.59 -176.63 0.36 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.666 179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.454 ' CD1' ' CE1' ' A' ' 15' ' ' PHE . 28.1 tp -64.98 -43.83 91.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.407 -179.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.46 -31.87 69.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.066 -179.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -86.95 -26.03 24.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.666 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.433 HG21 ' CE2' ' A' ' 41' ' ' PHE . 0.7 OUTLIER -58.84 -76.44 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.771 0.32 . . . . 0.0 111.101 -179.762 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 140.27 -22.32 2.75 Favored Glycine 0 N--CA 1.453 -0.18 0 C-N-CA 120.51 -0.853 . . . . 0.0 113.005 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -49.01 -42.8 39.26 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.89 0.376 . . . . 0.0 110.914 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 45.7 p -71.75 -34.5 69.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.714 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -59.1 -33.47 70.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.6 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.96 179.69 0.5 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.915 179.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.9 mpp_? -93.91 73.34 4.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.572 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 78.63 66.62 1.7 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.232 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -93.31 24.94 3.59 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.689 0.281 . . . . 0.0 111.524 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.409 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 47.1 mt-10 -80.61 167.81 19.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.793 0.33 . . . . 0.0 110.889 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.472 ' CG1' ' N ' ' A' ' 89' ' ' LEU . 2.4 tt -148.41 159.65 6.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.106 0.479 . . . . 0.0 110.86 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.472 ' N ' ' CG1' ' A' ' 88' ' ' ILE . 5.1 mp -78.54 145.15 66.86 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.877 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.76 -23.75 25.86 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.604 2.202 . . . . 0.0 112.441 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.15 -40.47 74.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.045 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -69.0 -45.88 69.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.911 0.386 . . . . 0.0 110.844 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.42 ' CE2' ' HB3' ' A' ' 38' ' ' TYR . 7.6 t80 -56.09 -53.13 60.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.609 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.411 ' OE2' ' NH1' ' A' ' 48' ' ' ARG . 0.0 OUTLIER -68.2 -23.34 64.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.675 179.689 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.21 -50.2 74.59 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 121.246 0.546 . . . . 0.0 109.55 179.086 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 17.5 mm -74.41 -35.26 38.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.384 179.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.424 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 9.7 t-105 -53.12 -40.14 63.97 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.953 179.246 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -85.69 -26.97 25.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.748 179.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.84 -45.75 82.18 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.131 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 40.6 t -91.24 -79.22 0.37 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.039 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 179.18 36.95 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.686 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.424 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -59.9 -57.81 17.43 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.344 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 3.7 mp -53.03 -34.9 21.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.797 0.332 . . . . 0.0 111.233 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.04 -43.36 82.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.022 0.439 . . . . 0.0 110.29 179.492 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 92.7 t80 -67.97 -38.89 83.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.493 179.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.401 ' HB3' ' CD2' ' A' ' 124' ' ' LEU . 0.4 OUTLIER -70.63 -50.85 32.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.856 179.96 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.414 ' HG3' ' N ' ' A' ' 108' ' ' SER . 0.0 OUTLIER -59.97 -29.48 68.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.811 -179.941 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' SER . . . . . 0.414 ' N ' ' HG3' ' A' ' 107' ' ' GLN . 37.1 p -69.86 -50.49 42.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.554 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.54 -30.24 65.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.534 0.683 . . . . 0.0 109.516 178.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.433 ' CD1' HD21 ' A' ' 124' ' ' LEU . 15.9 mt -61.21 -49.33 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.229 179.075 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -66.07 -37.96 87.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.43 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 63.8 m -82.17 -4.94 58.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.959 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? 63.91 64.05 0.79 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.071 0.462 . . . . 0.0 111.07 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -151.59 25.09 0.68 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.52 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -104.89 -9.87 17.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.506 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 65.13 86.33 0.14 Allowed Pre-proline 0 C--N 1.332 -0.167 0 CA-C-O 120.799 0.333 . . . . 0.0 110.919 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.407 ' HB3' HG13 ' A' ' 6' ' ' ILE . 77.9 Cg_exo -50.35 99.53 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.568 2.178 . . . . 0.0 112.164 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.41 -45.22 1.22 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.957 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.436 ' CE2' ' HG3' ' A' ' 12' ' ' GLN . 16.3 t80 -177.66 -52.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.952 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.471 ' O ' ' HB2' ' A' ' 124' ' ' LEU . . . -53.94 -39.51 65.96 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.243 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.41 HG23 ' CG1' ' A' ' 110' ' ' ILE . 40.2 p -67.05 -40.89 87.24 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.857 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -66.33 -57.87 6.55 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.096 0.474 . . . . 0.0 110.684 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' MET . . . . . 0.443 ' HE2' ' N ' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -53.1 -29.65 31.84 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.209 179.455 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.471 ' HB2' ' O ' ' A' ' 120' ' ' ALA . 0.3 OUTLIER -69.66 -48.69 58.92 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 121.129 0.49 . . . . 0.0 110.03 178.821 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 36.5 mm-40 -50.32 -36.27 31.23 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.065 179.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -83.21 -32.67 26.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.975 178.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.69 -17.56 60.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.453 179.138 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 12.1 mt -88.13 -19.5 26.9 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.226 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 8.6 mmtt . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.022 -179.926 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.815 0.341 . . . . 0.0 111.192 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.485 ' O ' HD13 ' A' ' 6' ' ' ILE . 8.0 mmt180 -57.55 -64.0 1.04 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.431 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.483 ' HA ' HD13 ' A' ' 6' ' ' ILE . 1.8 tt0 -53.26 -36.98 61.7 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.226 179.426 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -58.61 -33.74 70.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.301 179.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -74.58 -47.89 29.88 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.382 179.599 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.485 HD13 ' O ' ' A' ' 2' ' ' ARG . 2.8 mp -59.66 -63.52 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.389 179.418 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.3 p30 40.58 79.9 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.471 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.1 mtm -54.85 -73.58 0.05 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.286 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.13 29.92 17.41 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.031 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -146.0 167.09 24.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.895 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.1 mm100 -80.64 154.38 27.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.077 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.432 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 9.3 mp0 -113.48 107.61 16.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.789 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.505 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -108.15 127.62 53.98 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.902 0.382 . . . . 0.0 111.039 -179.642 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.507 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 1.4 m-85 -114.09 151.14 32.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.389 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.505 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 9.0 m-85 -150.24 157.72 43.39 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.185 0.517 . . . . 0.0 112.062 -179.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.433 ' HG3' ' CD2' ' A' ' 38' ' ' TYR . 34.3 ttp180 -149.21 149.66 31.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.835 179.28 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -151.47 115.77 3.1 Favored Pre-proline 0 C--N 1.33 -0.272 0 C-N-CA 121.066 -0.254 . . . . 0.0 111.284 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.414 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 89.8 Cg_endo -82.85 85.24 1.62 Allowed 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.725 2.284 . . . . 0.0 112.301 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.426 ' CE2' ' HB2' ' A' ' 37' ' ' TRP . 9.0 p90 -103.91 140.47 37.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.998 0.427 . . . . 0.0 110.729 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.4 mt -91.47 141.5 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.2 -179.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' A' ' 25' ' ' GLN . 0.1 OUTLIER -58.7 135.91 86.52 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.586 179.842 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.477 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 51.4 Cg_exo -54.52 -55.68 3.12 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.388 2.059 . . . . 0.0 112.949 -179.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.541 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -51.13 -54.96 20.37 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.71 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.51 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 40.7 m-20 -70.88 -31.04 67.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.158 -179.727 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.412 ' N ' ' O ' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -52.33 -57.11 10.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.65 -179.474 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.541 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.3 p90 -88.55 -19.14 26.75 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.594 -179.397 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.51 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 1.7 mtpp -56.04 -54.98 38.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.915 0.388 . . . . 0.0 110.801 179.744 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.8 p30 -167.27 144.79 3.92 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.327 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -73.35 -4.42 15.39 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.709 2.272 . . . . 0.0 112.764 179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -98.3 -40.58 8.26 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.856 0.36 . . . . 0.0 110.928 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -109.07 34.3 3.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.803 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -33.22 75.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.08 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 59.68 108.33 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.78 -179.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.82 112.93 23.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.565 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.425 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -92.67 122.02 6.73 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.621 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.414 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 15.5 m-90 -98.62 121.0 40.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.871 0.367 . . . . 0.0 110.677 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.426 ' HB2' ' CE2' ' A' ' 19' ' ' PHE . 21.9 t90 -108.44 117.5 34.32 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.326 -179.429 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.436 ' CE1' ' CD1' ' A' ' 52' ' ' LEU . 14.2 m-85 -110.98 153.3 25.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.259 179.422 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.441 ' HB1' ' CE1' ' A' ' 41' ' ' PHE . . . -165.79 124.07 1.56 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.131 0.491 . . . . 0.0 111.681 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.507 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 11.7 t-160 -97.65 94.71 7.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.671 179.086 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.54 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 13.6 m-85 -78.03 149.19 34.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.472 -179.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.453 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 88.0 m-20 -122.64 110.83 16.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.14 178.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.47 -132.58 50.04 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.051 -1.071 . . . . 0.0 111.152 -178.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.423 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 5.7 Cg_exo -73.64 -18.19 22.62 Favored 'Trans proline' 0 N--CA 1.464 -0.261 0 C-N-CA 122.557 2.171 . . . . 0.0 112.505 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' TRP . . . . . 0.429 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.5 OUTLIER -117.51 -164.76 1.02 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.87 0.366 . . . . 0.0 111.769 -178.492 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.54 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 3.3 tt -136.66 152.98 29.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.183 -179.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -125.28 -18.9 5.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.071 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.422 ' HB2' ' HB3' ' A' ' 40' ' ' HIS . 8.5 mtt180 -132.79 136.63 46.41 Favored 'General case' 0 N--CA 1.458 -0.07 0 CA-C-O 120.854 0.359 . . . . 0.0 111.406 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.43 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 0.8 OUTLIER -146.74 118.73 8.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.827 179.824 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 16.1 ttp -112.83 118.05 33.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.714 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -101.52 118.39 36.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.381 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.436 ' CD1' ' CE1' ' A' ' 38' ' ' TYR . 13.8 mt -119.27 116.53 26.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.627 179.697 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.425 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 7.9 m-70 -129.94 130.94 23.2 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.63 0.253 . . . . 0.0 111.004 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_exo -51.65 -24.62 17.98 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.399 2.066 . . . . 0.0 112.391 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.6 p-10 -104.15 -22.94 13.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.205 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.418 ' HB2' ' HB2' ' A' ' 53' ' ' HIS . 0.3 OUTLIER -119.66 127.87 26.19 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.63 -0.259 . . . . 0.0 110.946 179.828 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo -49.71 171.65 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.664 2.243 . . . . 0.0 112.451 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -62.68 77.61 0.11 Allowed 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.605 2.203 . . . . 0.0 112.354 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 6.7 mt -56.92 100.37 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 121.088 0.471 . . . . 0.0 110.765 179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.445 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.4 OUTLIER -76.43 131.84 39.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.062 -179.694 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.441 ' CD1' ' HB3' ' A' ' 66' ' ' ASP . 0.3 OUTLIER -132.19 146.66 52.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.72 179.93 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.6 p -150.75 137.16 12.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.224 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.04 167.68 2.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.273 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.25 -66.52 0.72 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.521 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.1 -66.49 0.59 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.925 0.393 . . . . 0.0 110.949 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.441 ' HB3' ' CD1' ' A' ' 61' ' ' LEU . 16.4 t0 -101.59 56.4 0.83 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.945 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.18 -17.43 62.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.592 -179.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 2.4 mtm -77.09 -30.9 55.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.895 0.379 . . . . 0.0 110.748 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.414 ' CB ' HD11 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -98.6 -21.44 16.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.196 179.984 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.3 -176.48 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.169 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 8.1 m -63.61 -47.25 82.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.795 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 70.29 25.35 4.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.112 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.64 154.41 39.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.705 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -79.54 -170.97 2.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.397 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.443 HD13 ' CZ ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -59.21 -53.1 62.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.252 -179.713 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.75 -44.75 66.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.175 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -54.78 -33.0 60.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.58 -179.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.35 -69.3 0.39 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.065 -179.646 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 133.48 -19.65 4.24 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.863 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.42 HD11 ' CE1' ' A' ' 41' ' ' PHE . 1.3 mp -51.85 -34.32 40.14 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.85 0.357 . . . . 0.0 111.025 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.14 -43.07 35.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.654 179.733 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.407 ' HB3' ' NH1' ' A' ' 82' ' ' ARG . 0.1 OUTLIER -60.06 -29.74 68.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.716 179.786 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -168.16 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.889 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.0 77.37 1.24 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.801 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 72.05 68.06 1.7 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.402 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -96.55 21.16 9.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.691 0.282 . . . . 0.0 111.267 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -86.1 150.18 24.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.924 0.392 . . . . 0.0 111.1 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.429 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 1.3 pt -133.67 -179.66 3.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.004 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -96.32 141.5 23.22 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.707 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -66.12 -13.86 41.77 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.577 2.184 . . . . 0.0 112.688 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -73.39 -49.89 24.77 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.43 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.406 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 0.2 OUTLIER -65.26 -42.93 92.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.968 0.413 . . . . 0.0 110.675 179.824 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -56.54 -53.39 58.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.555 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.27 -19.74 62.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.464 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.406 ' HB2' ' HA ' ' A' ' 92' ' ' GLN . 0.5 OUTLIER -61.25 -50.42 73.14 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.162 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.54 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 19.0 mm -73.72 -33.84 39.27 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.445 179.033 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.434 ' CH2' ' HG ' ' A' ' 60' ' ' LEU . 10.0 t-105 -53.03 -39.45 63.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.242 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -85.89 -30.54 22.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.609 179.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.54 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -58.13 -52.12 66.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.23 -179.882 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 32.4 m -78.29 -71.1 0.45 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.089 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 163.38 40.5 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.638 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.445 ' HA2' ' CD2' ' A' ' 60' ' ' LEU . . . -60.35 -47.86 89.01 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.37 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.414 ' HA ' HD13 ' A' ' 124' ' ' LEU . 3.7 mp -56.55 -34.63 42.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.847 0.356 . . . . 0.0 111.426 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -67.84 -48.69 65.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.836 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -67.73 -41.14 83.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.715 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.416 ' CD1' HG22 ' A' ' 121' ' ' THR . 0.2 OUTLIER -67.84 -50.63 55.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.945 179.954 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.413 ' HG3' ' N ' ' A' ' 108' ' ' SER . 0.0 OUTLIER -60.78 -29.54 69.5 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.78 179.801 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' SER . . . . . 0.413 ' N ' ' HG3' ' A' ' 107' ' ' GLN . 4.1 m -67.99 -50.81 53.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.604 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.43 -32.33 68.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.413 0.625 . . . . 0.0 109.732 179.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.453 ' CG1' HG22 ' A' ' 121' ' ' THR . 5.0 mt -56.76 -49.16 79.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.406 179.073 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -69.42 -36.61 76.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.51 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 51.9 m -74.83 -9.29 58.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.282 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 70.86 39.81 1.01 Allowed 'General case' 0 N--CA 1.461 0.079 0 CA-C-O 120.901 0.381 . . . . 0.0 111.033 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -111.74 -28.99 7.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.835 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.01 -166.81 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.144 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.1 ttt180 -132.56 93.64 24.25 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.03 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.406 ' HB3' HG13 ' A' ' 6' ' ' ILE . 51.9 Cg_exo -52.8 89.06 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.61 2.207 . . . . 0.0 112.116 179.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.6 t -132.88 -49.67 0.88 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.237 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.432 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 12.1 t80 -163.21 -62.28 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.889 0.376 . . . . 0.0 111.163 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.455 ' O ' ' HB2' ' A' ' 124' ' ' LEU . . . -53.85 -38.47 64.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.445 -179.59 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.453 HG22 ' CG1' ' A' ' 110' ' ' ILE . 0.9 OUTLIER -67.38 -44.64 78.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.693 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.56 -58.11 8.72 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.156 0.503 . . . . 0.0 110.696 179.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' MET . . . . . 0.437 ' HG3' ' O ' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -53.56 -29.98 39.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.485 179.512 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.455 ' HB2' ' O ' ' A' ' 120' ' ' ALA . 0.2 OUTLIER -66.54 -50.59 62.64 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.037 0.446 . . . . 0.0 109.922 178.863 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -49.77 -37.52 30.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.74 179.19 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -82.73 -31.46 28.45 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.014 178.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.4 -18.81 60.54 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.514 179.21 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -134.13 79.46 1.81 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.066 -179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.918 179.966 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.3 0 CA-C-O 120.866 0.365 . . . . 0.0 111.056 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -58.2 -62.28 1.95 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.64 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -53.77 -32.19 51.49 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.624 179.548 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -63.72 -37.16 86.31 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.404 179.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -73.91 -55.89 5.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.116 179.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.9 mp -61.15 -59.72 3.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.356 179.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.1 t70 41.14 72.63 0.15 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.963 -1.017 . . . . 0.0 111.409 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 8.5 mtm -57.24 -82.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.031 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.3 mttm 49.49 34.08 6.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.826 0.346 . . . . 0.0 111.124 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -139.72 164.12 30.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.069 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -78.97 117.06 19.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.868 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 94.8 mm-40 -84.94 102.66 13.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.899 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.512 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 1.5 mmp_? -119.82 144.0 47.57 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.849 0.357 . . . . 0.0 110.645 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.527 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 0.9 OUTLIER -123.98 134.85 53.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.346 -179.653 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.512 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 7.7 m-85 -135.36 152.59 51.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.337 0.589 . . . . 0.0 111.971 -179.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.467 ' HB3' ' CG2' ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.4 142.62 25.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.691 179.15 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.451 ' CD1' HD22 ' A' ' 80' ' ' LEU . 0.4 OUTLIER -145.88 127.27 7.53 Favored Pre-proline 0 C--N 1.328 -0.36 0 C-N-CA 120.709 -0.396 . . . . 0.0 111.983 -179.692 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.42 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 60.7 Cg_endo -89.64 91.19 0.35 Allowed 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 123.176 2.584 . . . . 0.0 111.97 179.683 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.407 ' O ' ' CD1' ' A' ' 19' ' ' PHE . 27.1 p90 -111.27 133.96 53.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.983 0.421 . . . . 0.0 111.238 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.407 HG12 ' HD2' ' A' ' 34' ' ' LYS . 17.2 mt -89.94 142.78 12.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.763 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 mtt180 -60.08 130.11 88.83 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.215 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.455 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 9.3 Cg_endo -52.75 -50.93 12.35 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.46 2.107 . . . . 0.0 112.497 -179.567 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.519 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -53.98 -58.33 7.7 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.334 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.561 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 10.3 m-20 -66.0 -33.49 75.92 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.97 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -50.66 -54.63 21.48 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.469 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.519 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.4 p90 -95.8 -12.38 25.41 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.841 -179.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.561 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 1.6 mtpp -62.17 -48.61 79.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.93 0.395 . . . . 0.0 110.566 179.704 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -160.95 140.91 8.19 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.155 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -73.19 -5.74 17.7 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.621 2.214 . . . . 0.0 112.592 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -108.17 -33.92 7.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.897 0.38 . . . . 0.0 110.605 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -97.82 30.17 3.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.763 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 15.6 mttt -65.43 -59.98 3.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.976 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 62.83 121.44 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.519 -179.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.407 ' HD2' HG12 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -98.98 131.46 45.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.045 -179.315 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -103.88 121.64 7.11 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.187 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.42 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 8.0 m-90 -97.81 119.62 36.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.903 0.382 . . . . 0.0 110.758 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.402 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 21.6 t90 -108.68 117.5 34.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.07 -179.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.445 ' CE1' ' CD1' ' A' ' 52' ' ' LEU . 4.5 m-85 -110.76 154.34 24.05 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.266 179.36 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.495 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . . . -170.38 123.83 0.69 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.123 0.487 . . . . 0.0 111.554 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.507 ' CG ' ' CE2' ' A' ' 14' ' ' PHE . 9.0 t-160 -95.57 96.05 8.79 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 178.72 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.604 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 7.4 m-85 -75.12 159.49 31.59 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.255 0.55 . . . . 0.0 111.433 -178.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.537 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.6 OUTLIER -133.09 120.35 21.16 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.113 179.003 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 58.39 -137.43 50.09 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 119.881 -1.152 . . . . 0.0 110.96 -178.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.417 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.2 Cg_exo -73.34 -16.23 24.83 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.456 2.104 . . . . 0.0 112.21 179.331 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' TRP . . . . . 0.418 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.8 OUTLIER -119.24 -158.85 0.75 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.344 -178.56 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.604 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 5.6 tt -130.82 154.84 41.3 Favored 'Isoleucine or valine' 0 C--O 1.231 0.108 0 CA-C-O 121.059 0.457 . . . . 0.0 112.089 -179.439 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -112.29 -35.44 5.6 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.457 -179.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.437 ' HG3' ' HB3' ' A' ' 40' ' ' HIS . 0.0 OUTLIER -150.85 158.25 43.91 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 120.255 -0.578 . . . . 0.0 111.781 -179.392 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.495 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 21.8 pt20 -161.17 159.25 28.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.407 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.47 ' HE1' ' N ' ' A' ' 97' ' ' TRP . 0.0 OUTLIER -134.24 122.7 23.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.436 179.46 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.429 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 2.1 mt-10 -90.09 115.71 27.56 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.838 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.445 ' CD1' ' CE1' ' A' ' 38' ' ' TYR . 33.1 mt -119.09 101.86 8.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.937 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.418 ' CD2' ' N ' ' A' ' 53' ' ' HIS . 3.2 m-70 -135.11 136.26 24.44 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.565 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -51.08 -28.65 25.61 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.713 2.276 . . . . 0.0 112.215 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 15.2 p30 -96.41 -26.37 15.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.816 179.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -113.1 112.6 49.73 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.77 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -50.01 175.05 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.468 2.112 . . . . 0.0 112.433 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -60.95 79.38 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.616 2.21 . . . . 0.0 112.357 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.429 ' HB ' ' HB2' ' A' ' 51' ' ' GLU . 7.6 mt -77.49 93.32 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.022 0.439 . . . . 0.0 110.502 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.44 ' HB3' ' CH2' ' A' ' 97' ' ' TRP . 2.8 mt -75.49 107.44 7.63 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.977 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.411 ' CD2' ' HB3' ' A' ' 66' ' ' ASP . 3.8 mt -98.32 153.41 18.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.912 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.7 p -154.78 142.07 12.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.952 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.67 164.66 1.95 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.397 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 66.68 -76.5 0.15 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.417 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.88 -61.79 2.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.977 0.418 . . . . 0.0 110.808 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.411 ' HB3' ' CD2' ' A' ' 61' ' ' LEU . 7.5 m-20 -108.14 42.83 1.3 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.672 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.61 -17.4 64.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.434 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -76.81 -28.05 55.42 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.803 0.335 . . . . 0.0 110.669 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.2 pm0 -109.19 -23.84 11.42 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.249 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.4 176.55 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.868 0.366 . . . . 0.0 110.981 179.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 7.0 t -52.33 -66.7 0.34 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.802 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 72.37 7.12 5.63 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.516 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.47 157.9 18.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.962 0.41 . . . . 0.0 111.045 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -83.04 168.3 17.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.222 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.458 ' CD1' ' CE2' ' A' ' 15' ' ' PHE . 4.2 mm? -53.91 -53.58 50.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.747 0.308 . . . . 0.0 111.601 -179.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.56 -31.63 68.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.685 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -70.34 -40.8 73.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.462 -179.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.8 -76.58 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.306 -179.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 143.27 -24.21 2.21 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.508 -0.853 . . . . 0.0 113.007 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.451 HD22 ' CD1' ' A' ' 17' ' ' ILE . 1.0 OUTLIER -53.94 -48.58 70.09 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.06 0.457 . . . . 0.0 110.538 179.875 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.53 -48.32 82.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.614 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.76 -30.11 68.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.635 179.605 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.34 177.35 0.5 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.811 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -87.96 78.28 8.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.826 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 69.27 68.51 1.62 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.372 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -90.84 16.31 9.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.465 0.174 . . . . 0.0 111.463 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -84.03 155.15 22.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.953 0.406 . . . . 0.0 111.186 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.467 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 0.8 OUTLIER -136.95 179.04 4.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.964 179.748 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.8 mp -94.07 137.93 22.79 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.607 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.72 -21.18 62.06 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.437 2.092 . . . . 0.0 112.334 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.12 -39.43 72.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.997 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -70.12 -50.44 40.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.009 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.425 ' CZ ' ' HG2' ' A' ' 50' ' ' MET . 16.7 t80 -54.91 -49.42 71.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.767 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.14 -21.93 61.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.748 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.9 -50.44 72.18 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.2 0.524 . . . . 0.0 109.614 179.131 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.427 ' HB ' ' HE1' ' A' ' 50' ' ' MET . 20.8 mm -77.47 -34.11 20.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.671 179.336 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.47 ' N ' ' HE1' ' A' ' 50' ' ' MET . 53.0 t-105 -52.96 -40.55 63.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.919 179.353 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.15 -30.16 22.7 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.453 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -56.78 -54.15 49.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.221 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 95.3 m -75.8 -82.06 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.003 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -178.62 35.99 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.515 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -67.69 -37.66 89.22 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.607 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.456 HD12 HG22 ' A' ' 103' ' ' ILE . 30.9 mm -70.21 -39.41 76.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.855 0.359 . . . . 0.0 111.162 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.7 -42.92 97.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.974 0.416 . . . . 0.0 110.425 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -67.53 -42.99 81.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.717 179.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.49 -50.25 63.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.056 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.409 ' HG3' ' N ' ' A' ' 108' ' ' SER . 0.0 OUTLIER -60.9 -29.56 69.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.024 -179.962 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' SER . . . . . 0.409 ' N ' ' HG3' ' A' ' 107' ' ' GLN . 8.5 t -68.87 -50.49 49.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.76 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.09 -31.1 65.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.351 0.596 . . . . 0.0 109.505 178.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.404 ' HB ' ' HA ' ' A' ' 107' ' ' GLN . 10.7 mt -56.96 -48.8 80.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.127 179.136 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -69.53 -39.35 77.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.577 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.39 -12.03 61.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.191 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 73.2 35.83 0.89 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.842 0.353 . . . . 0.0 110.908 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -106.8 -28.91 9.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.661 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.99 -170.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.025 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -140.16 96.21 8.15 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.951 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -45.88 107.09 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.509 2.14 . . . . 0.0 112.276 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.7 p -144.69 -45.82 0.24 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.171 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -174.37 -49.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.916 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.434 ' O ' ' HB2' ' A' ' 124' ' ' LEU . . . -58.14 -39.06 77.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.232 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 40.3 p -68.64 -44.76 73.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.746 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.21 -58.26 9.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.089 0.471 . . . . 0.0 110.427 179.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' MET . . . . . 0.462 ' HE1' ' HB2' ' A' ' 123' ' ' MET . 0.0 OUTLIER -56.19 -29.59 61.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.18 179.22 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.435 ' N ' ' HE2' ' A' ' 123' ' ' MET . 0.0 OUTLIER -67.65 -51.36 50.84 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.003 0.43 . . . . 0.0 109.943 178.956 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 46.6 mm-40 -49.75 -38.39 33.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.067 179.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 -79.63 -34.23 40.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.227 179.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.49 -18.68 60.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.387 179.065 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -148.23 84.07 1.5 Allowed 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.873 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.304 -0.855 . . . . 0.0 110.938 179.918 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.912 0.386 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.44 -61.01 2.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.984 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -64.36 -34.32 77.89 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.369 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -57.66 -33.09 67.96 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.593 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.93 -53.03 7.92 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.119 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.432 HG13 ' HB3' ' A' ' 117' ' ' PRO . 2.7 mp -61.03 -62.55 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.45 0.643 . . . . 0.0 110.225 179.124 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.4 t70 42.33 75.15 0.09 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.81 -1.086 . . . . 0.0 111.535 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.2 ptp -57.4 -70.09 0.14 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.161 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.4 mttt 45.31 40.91 5.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.967 0.413 . . . . 0.0 111.419 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.86 161.35 38.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.004 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 87.8 mm-40 -70.23 146.93 50.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.593 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.9 mp0 -112.82 113.73 25.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.918 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.452 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.7 OUTLIER -126.0 124.09 39.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.051 179.842 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.501 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -113.67 134.66 54.6 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.699 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.452 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 1.9 m-85 -133.5 160.65 36.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.28 0.562 . . . . 0.0 112.179 -178.685 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.479 ' HB3' ' CG2' ' A' ' 88' ' ' ILE . 0.4 OUTLIER -149.11 144.09 26.42 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.827 179.625 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.446 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -153.22 117.5 2.81 Favored Pre-proline 0 C--N 1.33 -0.269 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.96 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.49 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 1.2 Cg_endo -83.67 89.27 1.05 Allowed 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 123.057 2.504 . . . . 0.0 111.781 179.456 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.421 ' O ' ' CD1' ' A' ' 19' ' ' PHE . 20.8 p90 -103.1 136.58 42.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.944 0.402 . . . . 0.0 110.997 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.531 HG12 ' HG3' ' A' ' 34' ' ' LYS . 10.6 mt -84.81 139.67 17.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.072 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.7 mtp180 -60.66 139.06 93.08 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.261 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.461 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 19.5 Cg_endo -58.29 -50.55 9.51 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.409 2.073 . . . . 0.0 112.301 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.514 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -53.84 -58.34 7.6 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.077 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.511 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 45.4 m-20 -66.38 -32.69 74.23 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.983 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.418 ' HB3' ' O ' ' A' ' 22' ' ' PRO . 0.0 OUTLIER -50.37 -52.45 37.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.347 -179.653 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.514 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.9 p90 -98.17 -15.75 19.77 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.972 -179.317 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.511 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 0.7 OUTLIER -60.92 -46.51 90.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.937 0.398 . . . . 0.0 110.729 179.861 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -161.86 138.44 6.15 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.021 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.29 -7.08 20.57 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.515 2.143 . . . . 0.0 112.729 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -111.26 -29.75 7.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.854 0.359 . . . . 0.0 110.897 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.3 m120 -97.95 29.05 3.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.121 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 17.5 mttt -64.7 -62.32 1.65 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.115 0.484 . . . . 0.0 110.525 179.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.9 mmmt 67.77 100.98 0.05 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.505 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.531 ' HG3' HG12 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -81.87 139.17 34.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.457 -179.467 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.431 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -110.49 130.18 9.71 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.05 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.49 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 22.9 m-90 -97.49 112.85 24.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.054 0.454 . . . . 0.0 110.875 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.456 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 26.9 t90 -101.92 117.47 34.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.01 -179.509 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.478 ' CE1' ' CD1' ' A' ' 52' ' ' LEU . 1.2 m-85 -114.45 156.04 25.26 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.414 179.319 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.436 ' CB ' ' CD1' ' A' ' 46' ' ' ILE . . . -163.53 123.78 2.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.331 0.586 . . . . 0.0 111.852 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.491 ' HB3' ' CB ' ' A' ' 48' ' ' ARG . 2.4 t-160 -90.71 84.51 5.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.208 -0.906 . . . . 0.0 108.841 178.603 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.625 ' CG ' ' HB ' ' A' ' 46' ' ' ILE . 13.7 m-85 -71.83 149.83 44.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.836 -178.518 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.415 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.5 OUTLIER -133.03 119.13 19.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.432 -0.804 . . . . 0.0 108.898 178.968 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 62.71 -140.52 46.0 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 119.966 -1.111 . . . . 0.0 110.929 -178.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.419 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 2.6 Cg_exo -75.89 -1.17 11.07 Favored 'Trans proline' 0 CA--C 1.531 0.33 0 C-N-CA 122.691 2.261 . . . . 0.0 112.421 179.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' TRP . . . . . 0.419 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 1.5 m95 -135.5 -158.44 0.87 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.582 -178.374 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.625 ' HB ' ' CG ' ' A' ' 41' ' ' PHE . 4.2 tt -139.31 155.21 25.87 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.099 0 CA-C-O 121.119 0.485 . . . . 0.0 111.861 -179.231 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.41 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -123.85 -24.29 4.48 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.594 -0.73 . . . . 0.0 112.12 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.491 ' CB ' ' HB3' ' A' ' 40' ' ' HIS . 3.2 mtt180 -126.47 133.65 51.14 Favored 'General case' 0 C--O 1.227 -0.099 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.536 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.413 ' NE2' HD13 ' A' ' 61' ' ' LEU . 0.5 OUTLIER -144.16 137.48 27.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.913 0.387 . . . . 0.0 111.423 -179.943 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.445 ' HG2' ' CZ ' ' A' ' 93' ' ' PHE . 0.0 OUTLIER -133.62 115.51 14.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.524 179.729 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.404 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.1 OUTLIER -95.46 115.67 27.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.104 -179.73 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.478 ' CD1' ' CE1' ' A' ' 38' ' ' TYR . 15.1 mt -115.22 101.87 9.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.649 179.684 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.431 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 2.0 m-70 -123.8 133.6 24.74 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.041 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -52.66 -27.33 32.92 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.268 1.979 . . . . 0.0 112.118 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -94.75 -26.92 16.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.936 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.5 mptt -121.2 118.93 29.86 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.999 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.435 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 88.1 Cg_exo -46.09 170.13 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.536 2.157 . . . . 0.0 112.238 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.435 ' HD2' ' HB3' ' A' ' 57' ' ' PRO . 18.0 Cg_endo -58.2 82.22 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.446 2.098 . . . . 0.0 112.3 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.404 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 76.2 mt -61.03 105.36 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.735 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.443 ' HG ' ' CZ3' ' A' ' 97' ' ' TRP . 3.0 mp -81.43 121.38 26.18 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.987 -179.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.413 HD13 ' NE2' ' A' ' 49' ' ' GLN . 73.9 mt -129.4 154.17 47.19 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.076 -179.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.6 p -153.51 143.15 14.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.028 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.44 147.62 13.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.151 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.72 -50.51 2.3 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.568 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.74 -75.68 0.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.833 0.349 . . . . 0.0 110.888 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.93 56.14 3.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.916 -179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -68.18 -28.7 67.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.204 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.96 -20.71 34.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.235 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -94.78 -50.07 5.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.287 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.35 -163.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.153 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.65 114.36 11.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.595 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -103.14 37.76 1.91 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.886 0.374 . . . . 0.0 110.764 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.09 -179.18 6.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.819 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -94.67 164.21 13.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.683 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.417 HD12 ' CD2' ' A' ' 41' ' ' PHE . 0.6 OUTLIER -54.92 -32.32 61.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.659 -179.573 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.57 -56.06 7.41 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -179.273 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -77.91 -3.91 44.12 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.34 -53.56 41.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.755 0.312 . . . . 0.0 110.758 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 117.79 -25.13 8.62 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.7 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.405 HD23 ' CZ3' ' A' ' 37' ' ' TRP . 1.2 mt -56.92 -32.24 65.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.747 0.308 . . . . 0.0 111.005 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 5.1 p -80.04 -34.03 38.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.927 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -67.01 -30.5 70.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.876 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.58 -173.96 0.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.808 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.03 74.46 4.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.976 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 69.25 65.57 2.55 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.602 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -72.58 -10.26 59.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.637 0.256 . . . . 0.0 111.387 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -52.28 148.07 7.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.898 0.38 . . . . 0.0 111.388 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.479 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 1.0 OUTLIER -139.8 179.29 2.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.105 179.897 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -98.41 150.19 36.48 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.578 179.664 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.51 -29.94 71.14 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.489 2.126 . . . . 0.0 112.349 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.0 -49.69 74.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.472 -179.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.501 ' HA ' ' HG2' ' A' ' 95' ' ' GLU . 4.8 mm-40 -64.37 -46.23 84.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.937 0.399 . . . . 0.0 111.637 -179.366 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.445 ' CZ ' ' HG2' ' A' ' 50' ' ' MET . 15.2 t80 -64.72 -43.93 91.84 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.365 -179.547 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -79.6 -30.02 41.34 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -179.053 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.501 ' HG2' ' HA ' ' A' ' 92' ' ' GLN . 11.8 pt-20 -63.91 -46.43 84.83 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 120.129 -0.628 . . . . 0.0 109.799 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.604 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 38.0 mm -71.21 -37.84 67.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 CA-C-O 121.142 0.496 . . . . 0.0 110.018 178.61 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.447 ' CE2' ' HA3' ' A' ' 102' ' ' GLY . 47.5 t-105 -52.48 -39.64 61.41 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.228 179.399 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -85.51 -24.57 27.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.729 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.604 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -56.77 -45.7 81.92 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.291 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 2.2 p -88.66 -54.63 4.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.606 -179.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 148.96 45.88 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.584 -0.817 . . . . 0.0 112.556 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.447 ' HA3' ' CE2' ' A' ' 97' ' ' TRP . . . -71.09 -38.98 63.5 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.932 -0.652 . . . . 0.0 112.387 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 20.6 mm -62.44 -55.08 26.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.725 0.297 . . . . 0.0 110.951 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.19 -45.06 79.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.561 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -59.9 -49.36 77.99 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.342 179.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.01 -46.19 90.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.798 179.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.1 mm100 -59.41 -29.63 67.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.032 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.84 -50.67 40.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.933 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.13 -31.29 65.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.456 0.646 . . . . 0.0 109.607 178.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.407 ' CG1' HG23 ' A' ' 121' ' ' THR . 12.3 mt -58.69 -48.96 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.363 179.139 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -66.38 -42.44 87.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.321 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.74 -15.72 63.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.011 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 75.54 32.53 0.7 Allowed 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 120.921 0.391 . . . . 0.0 110.977 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -100.32 -26.73 13.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.792 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -59.11 -162.88 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.041 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.31 93.38 11.46 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.219 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.432 ' HB3' HG13 ' A' ' 6' ' ' ILE . 72.4 Cg_exo -51.06 89.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.602 2.201 . . . . 0.0 112.035 179.594 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 9.0 t -138.23 -47.66 0.53 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.414 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.453 ' CE1' ' CE1' ' A' ' 40' ' ' HIS . 14.4 t80 -167.23 -47.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.629 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -59.97 -52.4 65.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.664 -179.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.407 HG23 ' CG1' ' A' ' 110' ' ' ILE . 69.1 p -65.32 -49.12 70.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.718 -179.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.86 -48.39 75.62 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.414 0.626 . . . . 0.0 109.799 179.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' MET . . . . . 0.414 ' HE1' ' HB3' ' A' ' 123' ' ' MET . 0.0 OUTLIER -58.01 -31.45 66.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.245 -0.888 . . . . 0.0 109.875 178.762 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.39 -49.41 66.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.891 178.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 63.7 mm-40 -49.99 -40.65 44.97 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.966 179.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -77.95 -32.82 51.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.129 178.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.03 -17.53 62.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.53 179.027 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -141.49 70.96 1.35 Allowed 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.038 -179.839 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 32.7 mmtt . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.845 179.975 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.749 0.309 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.448 ' O ' ' HG2' ' A' ' 5' ' ' GLU . 0.2 OUTLIER -60.18 -57.89 10.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.994 0.426 . . . . 0.0 110.635 179.86 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.427 ' O ' ' N ' ' A' ' 7' ' ' ASP . 0.2 OUTLIER -57.62 -31.15 65.94 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.253 0.549 . . . . 0.0 109.84 179.353 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.405 ' HA ' ' NE2' ' A' ' 4' ' ' GLN . 5.1 tp60 -64.71 -41.8 95.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.078 179.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.451 ' HG3' ' N ' ' A' ' 6' ' ' ILE . 9.9 pt-20 -73.06 -46.31 52.37 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.758 0.313 . . . . 0.0 110.846 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.451 ' N ' ' HG3' ' A' ' 5' ' ' GLU . 3.5 mp -69.42 -58.98 4.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.766 0.793 . . . . 0.0 109.534 178.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.427 ' N ' ' O ' ' A' ' 3' ' ' GLN . 16.6 t70 49.67 92.15 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.234 -179.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.424 ' HG2' ' CD2' ' A' ' 119' ' ' TYR . 0.0 OUTLIER -62.22 -69.61 0.24 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.892 179.867 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.6 mmtt 52.77 28.24 6.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.109 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -154.75 -179.96 8.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.804 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -97.67 167.98 10.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.865 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.451 ' HG2' ' CZ ' ' A' ' 119' ' ' TYR . 10.5 mp0 -119.38 108.3 14.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.902 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.54 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -117.58 120.56 38.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.019 -179.739 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.489 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 0.1 OUTLIER -113.8 148.94 35.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.515 179.897 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.54 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 0.2 OUTLIER -152.39 162.8 40.66 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.296 0.569 . . . . 0.0 111.857 179.944 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.447 ' HG3' ' CD2' ' A' ' 38' ' ' TYR . 7.0 ttp180 -149.26 148.04 29.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.896 179.36 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -149.61 124.48 4.8 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 120.72 0.295 . . . . 0.0 111.688 -179.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.461 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 67.1 Cg_endo -91.66 97.91 0.21 Allowed 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 123.007 2.471 . . . . 0.0 112.284 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -113.21 143.27 44.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.814 0.34 . . . . 0.0 110.834 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.44 HG12 ' HG2' ' A' ' 34' ' ' LYS . 5.7 mt -85.66 153.02 3.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.372 -179.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -80.25 140.57 52.92 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.671 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.485 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 51.8 Cg_exo -55.34 -47.92 23.43 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.558 2.172 . . . . 0.0 112.844 -179.576 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.517 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -54.94 -58.98 5.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.35 -179.383 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.46 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 1.8 m-20 -67.99 -31.18 70.7 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.552 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.42 -50.39 59.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.573 -179.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.517 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.3 p90 -102.21 -5.29 24.53 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 -179.268 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.46 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 6.0 mtpp -74.41 -39.11 62.85 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.835 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -174.44 140.79 0.74 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.417 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.3 -22.28 22.14 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.671 2.248 . . . . 0.0 112.288 179.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -84.63 -36.95 21.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.169 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -94.47 41.6 1.09 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.821 179.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.2 mmtm -78.08 61.17 2.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.698 -179.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.7 mmtt -46.2 95.5 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.338 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.44 ' HG2' HG12 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -83.89 131.99 34.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.783 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.424 ' HA3' ' CD2' ' A' ' 53' ' ' HIS . . . -115.99 142.51 17.59 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.849 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.461 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 22.0 m-90 -105.82 138.35 42.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.757 0.313 . . . . 0.0 110.732 179.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.402 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 41.7 t90 -123.98 116.83 23.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.791 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.447 ' CD2' ' HG3' ' A' ' 16' ' ' ARG . 3.1 m-85 -109.73 154.53 22.77 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.413 179.693 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.487 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . . . -170.21 125.46 0.77 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.154 0.502 . . . . 0.0 112.041 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.489 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 16.8 t-160 -96.89 96.61 8.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.757 179.016 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.586 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 19.5 m-85 -83.91 122.54 28.87 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.579 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.51 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.6 OUTLIER -91.75 111.06 22.43 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 178.289 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.19 -135.6 50.09 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.018 -1.087 . . . . 0.0 110.928 -178.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.418 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 8.1 Cg_exo -72.5 -16.68 27.23 Favored 'Trans proline' 0 N--CA 1.463 -0.278 0 C-N-CA 122.444 2.096 . . . . 0.0 112.317 179.424 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' TRP . . . . . 0.418 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 0.8 OUTLIER -115.08 -170.3 1.73 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.597 -178.696 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.586 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 3.5 tt -133.07 153.65 38.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 121.172 0.51 . . . . 0.0 111.998 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.408 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -129.73 -22.21 2.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.492 -0.777 . . . . 0.0 111.959 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 3.5 mtt180 -130.22 142.3 50.57 Favored 'General case' 0 N--CA 1.46 0.04 0 CA-C-O 120.77 0.319 . . . . 0.0 111.167 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.487 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 0.1 OUTLIER -155.88 129.86 8.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.991 0.424 . . . . 0.0 111.175 179.942 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -125.47 120.53 31.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.695 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.477 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -98.53 132.85 43.63 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.071 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.423 HD13 ' CE1' ' A' ' 38' ' ' TYR . 14.1 mt -135.06 101.98 5.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.846 179.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.424 ' CD2' ' HA3' ' A' ' 35' ' ' GLY . 61.3 m170 -126.26 138.26 31.92 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.931 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -52.26 -23.64 18.62 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.439 2.092 . . . . 0.0 112.341 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -98.58 -27.45 14.01 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.233 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 1.9 mttm -118.49 125.41 27.84 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.053 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.53 177.05 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.522 2.148 . . . . 0.0 112.27 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -59.68 84.97 0.07 OUTLIER 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.642 2.228 . . . . 0.0 112.498 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.477 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 67.1 mt -66.21 98.12 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.003 0.43 . . . . 0.0 110.634 179.64 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.422 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.2 OUTLIER -72.92 107.82 5.51 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.933 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.423 ' HB3' ' HB3' ' A' ' 49' ' ' GLN . 1.1 mm? -110.15 147.46 33.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.959 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.9 p -156.53 140.51 7.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.936 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.08 170.7 0.3 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.025 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.28 -72.28 0.32 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.325 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.28 -54.0 40.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.824 0.345 . . . . 0.0 110.694 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -114.19 57.46 0.7 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.867 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -20.19 63.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.212 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -85.58 -43.3 13.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.049 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.403 ' HB3' ' CD1' ' A' ' 61' ' ' LEU . 3.2 mm-40 -68.41 -39.58 81.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.02 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -48.26 167.66 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.905 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -56.09 -30.66 62.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.864 0.364 . . . . 0.0 111.083 -179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 75.97 -61.07 0.47 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.059 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.2 mptt -53.45 161.49 0.98 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.189 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -77.59 -172.89 2.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.555 179.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.418 HD13 ' CE1' ' A' ' 15' ' ' PHE . 28.0 tp -64.47 -51.97 60.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.558 -179.542 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.16 -31.37 68.82 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.837 0.351 . . . . 0.0 111.383 -179.663 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -66.95 -37.9 85.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.611 -179.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.423 HG23 ' CE2' ' A' ' 41' ' ' PHE . 21.0 p -59.41 -74.13 0.07 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.785 0.326 . . . . 0.0 111.122 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 143.03 -17.76 2.34 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.807 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.49 -41.1 52.84 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.979 0.418 . . . . 0.0 110.756 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -73.94 -26.84 60.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.725 179.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.98 -26.91 57.22 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.975 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.86 -171.08 0.49 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.115 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.6 90.93 4.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.951 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 62.5 68.97 1.44 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.559 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -88.14 -22.0 24.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.779 0.323 . . . . 0.0 111.077 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -53.92 143.26 21.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.307 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.418 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 1.6 pt -130.16 169.66 20.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.127 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.59 147.56 49.65 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.67 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -66.02 -26.06 51.17 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.558 2.172 . . . . 0.0 112.353 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -54.37 45.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.104 -179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -50.91 71.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.12 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -54.22 -53.07 58.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.713 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.57 -20.8 62.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.502 179.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.15 -50.34 74.05 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.013 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 20.0 mm -75.4 -33.67 28.23 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.303 178.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.457 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 14.1 t-105 -52.75 -41.07 63.68 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.972 179.281 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.06 -29.0 23.74 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.381 179.188 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -45.92 92.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.207 -179.813 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 44.3 t -88.02 -83.45 0.21 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.976 -179.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -176.09 34.38 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.63 -179.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.457 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -58.26 -54.89 33.99 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.603 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 1.8 mt -58.33 -34.69 50.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.796 0.331 . . . . 0.0 111.108 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.75 -49.16 74.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.604 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -64.18 -42.52 96.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.432 179.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.41 ' CD1' ' CD1' ' A' ' 124' ' ' LEU . 0.4 OUTLIER -64.0 -46.31 85.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.693 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -61.49 -29.72 70.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.77 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 37.7 m -68.33 -50.31 54.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.749 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.27 -33.37 69.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.362 0.601 . . . . 0.0 109.518 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.423 ' CG1' HG22 ' A' ' 121' ' ' THR . 8.6 mt -56.91 -48.92 80.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.368 179.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -67.86 -38.33 82.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.413 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 1.1 m -78.07 -4.88 49.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.235 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.8 mmt85 65.27 35.88 7.38 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.964 0.411 . . . . 0.0 110.922 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.15 -25.2 9.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.873 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -56.45 -29.93 62.26 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.161 179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 72.05 97.65 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.345 179.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . 0.423 ' HB3' HG13 ' A' ' 6' ' ' ILE . 65.8 Cg_exo -52.3 87.85 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.746 2.297 . . . . 0.0 111.932 179.577 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 9.0 t -112.22 -43.48 3.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.106 -179.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.451 ' CZ ' ' HG2' ' A' ' 12' ' ' GLN . 23.0 t80 -178.89 -63.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.035 179.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -53.67 -36.12 61.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.995 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.423 HG22 ' CG1' ' A' ' 110' ' ' ILE . 0.8 OUTLIER -60.83 -47.09 87.96 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.06 179.467 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -65.79 -46.4 78.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.389 0.614 . . . . 0.0 109.695 178.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' MET . . . . . . . . . . . . . 1.9 tmm? -58.11 -35.81 72.0 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.251 179.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.41 ' CD1' ' CD1' ' A' ' 106' ' ' LEU . 0.6 OUTLIER -67.69 -45.97 73.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.74 178.996 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 60.7 mm-40 -50.52 -38.4 44.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.968 179.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -76.77 -34.95 58.0 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.065 179.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.2 mt -59.3 -21.13 59.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.084 178.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 1.8 mt -91.6 -65.81 0.98 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.93 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 1.8 mmtt . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.283 -0.865 . . . . 0.0 111.213 179.9 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.838 0.352 . . . . 0.0 110.956 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.455 ' O ' ' CD1' ' A' ' 6' ' ' ILE . 0.2 OUTLIER -63.22 -54.25 40.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.145 0.498 . . . . 0.0 110.897 -179.93 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.61 -36.07 61.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.232 0.539 . . . . 0.0 110.035 179.755 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.1 tp60 -62.77 -44.87 95.05 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.891 179.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.453 ' CG ' ' O ' ' A' ' 2' ' ' ARG . 16.5 pt-20 -72.21 -45.48 60.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.934 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.455 ' CD1' ' O ' ' A' ' 2' ' ' ARG . 2.8 mp -65.49 -61.06 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.681 0.753 . . . . 0.0 109.96 179.008 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 44.1 t0 45.0 86.36 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.553 -1.203 . . . . 0.0 111.176 -179.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.0 ptp -88.46 52.14 2.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.048 -179.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.72 -28.02 14.08 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.005 179.787 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 51.5 mtt-85 -66.25 -177.49 0.53 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.877 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.71 138.16 31.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.874 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.451 ' HG2' ' CZ ' ' A' ' 119' ' ' TYR . 5.7 mp0 -108.08 102.82 11.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.889 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.462 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 2.5 mtp180 -111.92 133.84 53.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.019 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.505 ' CE2' ' CG ' ' A' ' 40' ' ' HIS . 1.2 m-85 -117.7 134.96 54.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.145 179.799 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.462 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 1.4 m-85 -136.31 157.23 47.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.251 0.548 . . . . 0.0 112.003 -179.037 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.483 ' CD ' ' CZ ' ' A' ' 38' ' ' TYR . 16.4 ttp180 -149.38 145.89 27.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.785 179.428 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.418 ' N ' ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -140.84 125.01 10.48 Favored Pre-proline 0 C--N 1.328 -0.327 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.447 -179.72 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -88.19 96.75 0.4 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.009 2.473 . . . . 0.0 112.186 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.407 ' O ' ' CD1' ' A' ' 19' ' ' PHE . 10.9 p90 -120.39 142.61 49.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.912 0.387 . . . . 0.0 111.107 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 17.0 mt -87.9 145.41 7.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.935 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.14 129.26 93.92 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.485 179.647 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.474 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 75.8 Cg_exo -50.04 -48.96 17.59 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.431 2.087 . . . . 0.0 112.659 -179.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.523 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -54.37 -58.24 8.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.439 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.524 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 36.9 m-20 -67.38 -31.77 72.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.913 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -51.61 -55.44 19.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.493 -179.574 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.523 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.0 p90 -93.89 -14.28 26.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.728 -179.43 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.524 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 3.0 mtpp -60.97 -47.25 87.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.952 0.406 . . . . 0.0 110.6 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -164.87 142.35 5.13 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.094 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -70.66 -22.42 27.96 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.735 2.29 . . . . 0.0 112.666 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -95.09 -32.83 12.92 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.789 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 30.5 m120 -101.37 48.14 0.9 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.728 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.01 59.53 0.67 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.795 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.25 146.14 0.7 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.259 179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.26 117.49 34.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.013 -179.486 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -92.17 126.33 8.46 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.228 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 8.6 m-90 -102.16 135.21 44.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.902 0.382 . . . . 0.0 111.01 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 33.7 t90 -117.01 117.21 29.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.048 -179.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.483 ' CZ ' ' CD ' ' A' ' 16' ' ' ARG . 12.0 m-85 -111.87 150.91 29.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.122 179.434 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.488 ' HB2' ' CE1' ' A' ' 41' ' ' PHE . . . -169.55 125.05 0.84 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.146 0.498 . . . . 0.0 112.042 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.505 ' CG ' ' CE2' ' A' ' 14' ' ' PHE . 14.4 t-160 -91.92 99.56 12.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.649 178.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.551 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 36.9 m-85 -85.23 118.87 25.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.776 -179.085 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.484 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.7 OUTLIER -91.59 115.17 27.82 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.28 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 57.78 -135.82 51.38 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 119.967 -1.111 . . . . 0.0 111.107 -178.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.409 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 7.8 Cg_exo -72.38 -18.77 26.05 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.436 2.091 . . . . 0.0 112.353 179.417 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' TRP . . . . . 0.418 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.6 OUTLIER -114.24 -171.56 1.94 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.969 0.414 . . . . 0.0 111.692 -178.752 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.551 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 1.7 tt -131.03 148.5 33.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.509 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -122.92 -20.58 5.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.839 -179.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.433 ' HG3' ' CB ' ' A' ' 120' ' ' ALA . 2.3 mtt180 -129.94 138.38 50.85 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.84 0.352 . . . . 0.0 111.333 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.464 ' HB3' ' HB3' ' A' ' 61' ' ' LEU . 7.2 tt0 -147.96 121.06 8.86 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.908 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 7.3 ttm -121.01 112.76 19.14 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.708 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -94.23 129.76 40.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.14 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.42 HD12 ' CD1' ' A' ' 38' ' ' TYR . 8.5 mt -129.05 112.1 13.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.854 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.8 m-70 -128.52 129.97 23.54 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.774 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -46.68 -27.11 5.05 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.515 2.143 . . . . 0.0 112.543 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -95.08 -33.97 12.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.946 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.1 mtpt -111.95 120.44 42.03 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.954 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -47.56 174.05 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.598 2.199 . . . . 0.0 112.579 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -55.95 85.38 0.04 OUTLIER 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.7 2.266 . . . . 0.0 112.341 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 84.5 mt -64.47 92.14 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.097 0.475 . . . . 0.0 110.737 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.449 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.3 OUTLIER -64.68 132.78 50.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.719 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.464 ' HB3' ' HB3' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -140.88 150.03 42.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.163 -179.52 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 13.3 p -153.36 148.96 13.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.121 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.26 166.92 2.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.974 179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.18 -73.39 0.29 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.393 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -58.95 -57.6 12.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.845 0.355 . . . . 0.0 110.8 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -108.96 48.51 0.86 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.639 179.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.22 -17.88 65.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.422 -179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 17.9 mmt -82.14 -32.63 29.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.848 0.356 . . . . 0.0 110.563 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.406 ' HB3' ' CD1' ' A' ' 61' ' ' LEU . 1.2 mp0 -89.24 -40.81 12.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.799 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.407 ' N ' HD21 ' A' ' 61' ' ' LEU . 32.1 ttm -53.34 162.51 0.74 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.142 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 1.7 t -50.08 118.1 2.73 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.941 179.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -82.98 0.84 42.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.772 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.28 164.56 16.8 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.79 0.329 . . . . 0.0 110.997 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -83.31 -179.84 7.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.974 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.452 ' HA ' ' OG1' ' A' ' 78' ' ' THR . 4.3 mt -65.78 -34.24 77.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.444 -179.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.5 -42.11 71.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.087 -178.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -93.87 -3.75 51.25 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.303 0.482 . . . . 0.0 112.303 -178.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.452 ' OG1' ' HA ' ' A' ' 75' ' ' LEU . 0.2 OUTLIER -67.08 -64.11 0.92 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.795 0.331 . . . . 0.0 110.813 179.945 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.405 ' CA ' ' NH1' ' A' ' 82' ' ' ARG . . . 129.82 -15.83 5.63 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.763 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.1 mp -68.25 -45.07 74.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.892 0.377 . . . . 0.0 110.892 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 52.9 p -65.44 -52.16 55.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.174 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.405 ' NH1' ' CA ' ' A' ' 79' ' ' GLY . 0.0 OUTLIER -62.01 -27.59 68.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.961 -179.833 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.48 -167.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.861 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.18 73.67 7.17 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.005 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 59.71 65.35 3.47 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.651 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.99 -14.03 62.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.8 0.333 . . . . 0.0 111.492 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.69 143.18 21.13 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.273 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.445 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 2.1 pt -127.16 -179.88 3.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.193 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 8.9 mt -81.85 137.96 46.87 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.838 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.5 -51.25 5.43 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.428 2.085 . . . . 0.0 111.986 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.87 -38.26 69.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.19 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -62.33 -52.38 63.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.935 0.398 . . . . 0.0 110.981 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 43.2 t80 -54.27 -53.0 59.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.57 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.404 ' OE2' ' NH1' ' A' ' 48' ' ' ARG . 0.1 OUTLIER -68.8 -21.23 64.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.515 179.436 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.52 -50.64 72.75 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 179.041 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.428 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 17.4 mm -71.96 -32.9 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.351 179.157 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.451 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 19.4 t-105 -55.72 -37.22 68.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.995 179.047 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.68 -27.92 25.03 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.642 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.428 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.2 OUTLIER -56.58 -54.3 47.51 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.348 -179.541 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 40.9 t -83.54 -80.18 0.19 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.025 -179.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 178.85 36.48 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.579 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.451 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -54.29 -55.23 27.6 Favored Glycine 0 N--CA 1.453 -0.188 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.418 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 3.6 mp -56.69 -40.49 70.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.768 0.318 . . . . 0.0 111.292 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -59.7 -49.03 79.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.571 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 82.9 t80 -61.26 -42.16 98.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.401 179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . 0.41 ' CD2' HG23 ' A' ' 121' ' ' THR . 0.4 OUTLIER -64.92 -41.56 95.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.63 179.705 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -63.11 -32.72 74.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.727 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -67.97 -50.18 57.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.514 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.4 -35.84 78.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.437 0.636 . . . . 0.0 109.456 178.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.421 ' CD1' HD22 ' A' ' 124' ' ' LEU . 3.8 mt -59.62 -48.87 85.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.357 179.012 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -67.03 -30.93 71.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.725 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 23.4 m -86.23 -7.03 58.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.206 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 22.6 mmt85 70.27 29.01 3.75 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.898 0.38 . . . . 0.0 110.88 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 84.1 mm-40 -99.44 -25.18 14.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.587 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.04 -164.93 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.933 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -140.48 89.94 10.31 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.102 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -51.31 87.91 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.705 2.27 . . . . 0.0 112.349 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 5.7 t -127.35 -45.03 1.53 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.868 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.451 ' CZ ' ' HG2' ' A' ' 12' ' ' GLN . 27.9 t80 -168.56 -61.66 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.886 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.45 ' O ' ' HG3' ' A' ' 123' ' ' MET . . . -54.09 -37.33 64.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.317 -179.73 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.414 HG23 ' CG1' ' A' ' 110' ' ' ILE . 0.2 OUTLIER -68.33 -41.06 81.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.557 179.961 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -65.53 -56.25 13.39 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.523 179.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' MET . . . . . 0.45 ' HG3' ' O ' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -55.38 -29.12 57.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.315 179.293 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.447 ' HB2' ' O ' ' A' ' 120' ' ' ALA . 0.3 OUTLIER -64.51 -52.4 58.0 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.079 0.466 . . . . 0.0 110.043 179.055 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 -53.09 -42.69 66.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.717 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -78.63 -30.63 46.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.666 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.3 tt -76.02 -7.81 55.53 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.523 179.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 7.0 mt -89.04 -10.61 46.88 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.24 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 14.6 mmtt . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.319 -0.848 . . . . 0.0 111.052 179.948 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.824 0.345 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.48 -59.91 4.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.887 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.5 ' HA ' HD13 ' A' ' 6' ' ' ILE . 0.2 OUTLIER -53.39 -41.06 65.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.66 179.867 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.4 tp60 -61.04 -32.25 71.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.508 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.77 -53.83 7.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.014 179.546 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.5 HD13 ' HA ' ' A' ' 3' ' ' GLN . 2.7 mp -53.61 -64.6 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.327 0.584 . . . . 0.0 109.929 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.1 t0 42.25 88.46 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.405 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' MET . . . . . 0.442 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 0.0 OUTLIER -55.04 -90.29 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.968 -179.902 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.6 mtmt 44.26 33.34 0.82 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.688 0.28 . . . . 0.0 111.554 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -135.84 151.12 49.72 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.034 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.8 mm-40 -61.48 152.72 29.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.786 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.402 ' OE1' ' CE1' ' A' ' 40' ' ' HIS . 93.1 mm-40 -123.89 102.71 7.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.907 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.452 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -112.58 123.64 50.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.023 179.977 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.46 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 2.5 m-85 -108.91 134.89 50.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.012 179.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.452 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 15.1 m-85 -132.79 148.84 52.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.234 0.54 . . . . 0.0 112.12 -178.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -147.2 138.93 24.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.605 179.597 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -149.33 123.27 4.63 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-O 120.725 0.298 . . . . 0.0 111.613 -179.582 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.445 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 91.0 Cg_endo -89.16 119.59 0.97 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.016 2.478 . . . . 0.0 111.964 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.432 ' O ' ' N ' ' A' ' 35' ' ' GLY . 11.4 p90 -139.31 154.84 47.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.883 0.373 . . . . 0.0 111.068 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.401 HD11 HG21 ' A' ' 20' ' ' ILE . 58.5 mt -105.06 142.19 18.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.769 179.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -58.76 136.99 86.87 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.47 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.457 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 15.9 Cg_endo -57.46 -46.56 26.79 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.516 2.144 . . . . 0.0 112.585 -179.624 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.504 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -55.44 -58.87 5.97 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.316 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.496 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 2.7 m-20 -66.52 -32.71 74.24 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.684 179.768 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -50.62 -51.23 50.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.48 -179.696 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.504 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.8 p90 -103.32 -1.64 28.4 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.119 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.496 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 16.0 mtpp -77.89 -40.07 41.13 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.919 -0.313 . . . . 0.0 110.949 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -172.78 143.57 1.18 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.44 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -73.03 -22.7 19.2 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.807 2.338 . . . . 0.0 112.295 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -83.97 -36.2 23.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.111 179.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -94.38 41.79 1.09 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.995 179.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.9 mmtm -80.74 59.93 3.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.779 -179.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.1 94.6 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.964 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.17 -170.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.979 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 19' ' ' PHE . . . -170.11 108.52 0.29 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.23 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.464 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 18.0 m-90 -97.58 131.57 44.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.846 0.355 . . . . 0.0 110.682 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 18.3 t90 -121.02 117.5 27.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.22 -179.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.464 ' CE1' ' HB3' ' A' ' 36' ' ' TRP . 1.8 m-85 -120.2 148.02 44.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.201 179.34 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.455 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . . . -170.47 124.64 0.71 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.215 0.531 . . . . 0.0 111.69 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.465 ' HB3' ' CG ' ' A' ' 48' ' ' ARG . 10.9 t-160 -93.22 105.77 17.81 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 178.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.708 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 3.0 m-85 -85.45 134.09 34.07 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.62 -178.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.509 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 4.5 t70 -97.25 120.93 38.51 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 178.501 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 57.31 -138.65 47.62 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 119.767 -1.206 . . . . 0.0 110.889 -178.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.413 ' O ' ' ND2' ' A' ' 74' ' ' ASN . 7.4 Cg_exo -72.26 -18.67 26.55 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.351 2.034 . . . . 0.0 112.089 179.212 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' TRP . . . . . 0.405 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -113.95 -169.34 1.5 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.292 -178.921 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.708 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 8.4 tt -118.34 156.58 20.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 N-CA-C 112.643 0.608 . . . . 0.0 112.643 -179.155 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.436 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -119.78 -36.46 3.3 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.763 -179.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.465 ' CG ' ' HB3' ' A' ' 40' ' ' HIS . 6.4 ptp180 -140.07 153.44 46.76 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 120.501 -0.48 . . . . 0.0 111.406 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.455 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 30.8 tt0 -146.41 153.62 40.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.289 -179.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.417 ' HE1' ' CD2' ' A' ' 38' ' ' TYR . 20.0 ttp -142.16 111.96 6.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.566 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -95.34 126.45 40.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.957 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.434 ' HB2' ' CE2' ' A' ' 38' ' ' TYR . 1.4 mp -123.41 113.77 19.25 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.775 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 56' ' ' LYS . 0.7 OUTLIER -134.49 135.53 23.93 Favored Pre-proline 0 C--N 1.332 -0.194 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.974 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.56 -28.11 35.34 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.51 2.14 . . . . 0.0 112.319 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -102.31 -19.72 14.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.149 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 53' ' ' HIS . 5.3 mmmt -117.82 122.32 30.76 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.727 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -52.89 164.92 1.38 Allowed 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.531 2.154 . . . . 0.0 112.237 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -57.11 88.57 0.04 OUTLIER 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.641 2.227 . . . . 0.0 112.381 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.2 mt -69.59 94.54 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.147 0.498 . . . . 0.0 110.496 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.461 ' CD2' ' CZ3' ' A' ' 97' ' ' TRP . 0.8 OUTLIER -84.42 107.36 16.64 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.978 -179.626 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 29.0 mt -107.68 161.0 15.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.94 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.9 p -153.31 139.84 12.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.085 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.53 137.4 48.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.165 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 100.98 -40.46 2.41 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.438 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.87 -32.2 9.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.781 0.324 . . . . 0.0 110.853 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -132.0 44.28 2.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.886 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -59.47 -30.56 68.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.911 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 2.4 mtp -84.91 -29.8 24.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.092 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -78.3 -55.74 5.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.962 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.6 ptm -59.81 -178.12 0.07 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.032 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 2.2 t -62.29 118.25 7.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.759 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -98.91 6.41 46.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.459 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -102.74 -175.04 2.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.916 0.389 . . . . 0.0 111.114 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . 0.413 ' ND2' ' O ' ' A' ' 44' ' ' PRO . 21.0 t-20 -109.42 160.41 16.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.25 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -43.87 -37.4 2.81 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -70.77 -56.1 7.12 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.838 0.351 . . . . 0.0 111.73 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -71.37 -16.3 62.41 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -64.82 -62.15 1.74 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.79 0.329 . . . . 0.0 111.092 -179.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 122.0 -26.5 6.44 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.256 -179.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -48.92 -42.67 37.96 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.993 0.425 . . . . 0.0 110.649 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 39.0 p -70.41 -28.32 64.97 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.372 179.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 8.0 mmm-85 -96.25 6.43 48.81 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.019 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.435 ' HB3' ' HB1' ' A' ' 86' ' ' ALA . 0.4 OUTLIER -93.81 31.25 1.63 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.695 0.284 . . . . 0.0 111.277 -179.754 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 55.02 72.84 0.45 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.974 0.416 . . . . 0.0 111.263 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.72 65.42 3.56 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.888 -0.673 . . . . 0.0 113.115 179.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . 0.435 ' HB1' ' HB3' ' A' ' 83' ' ' LYS . . . -93.85 32.15 1.5 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.84 0.352 . . . . 0.0 111.009 179.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -86.87 147.36 25.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.975 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.463 ' CG1' ' N ' ' A' ' 89' ' ' LEU . 1.5 tt -130.01 159.44 42.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.802 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.463 ' N ' ' CG1' ' A' ' 88' ' ' ILE . 0.4 OUTLIER -82.0 146.4 55.39 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.018 -179.908 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -62.51 -26.5 76.25 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.526 2.151 . . . . 0.0 112.508 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.7 -50.5 73.22 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.918 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -66.4 -41.52 89.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.943 0.401 . . . . 0.0 110.943 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -57.93 -53.75 54.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.739 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.37 -20.86 62.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.48 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -60.14 -50.29 74.27 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 178.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 18.5 mm -73.02 -33.28 42.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.307 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.461 ' CZ3' ' CD2' ' A' ' 60' ' ' LEU . 4.2 t-105 -54.79 -36.56 65.05 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.881 178.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.407 ' HG3' HD13 ' A' ' 103' ' ' ILE . 1.9 mp0 -85.41 -31.16 23.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.584 179.342 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -56.78 -54.61 44.38 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.584 -179.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 42.3 t -82.37 -79.14 0.19 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.032 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 170.34 38.25 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.557 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.438 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -58.97 -50.77 64.21 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.575 -0.822 . . . . 0.0 112.182 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.407 HD13 ' HG3' ' A' ' 98' ' ' GLU . 3.3 mp -56.37 -53.07 44.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.842 0.354 . . . . 0.0 111.092 179.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -56.37 -39.84 73.57 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.994 0.426 . . . . 0.0 110.336 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -65.19 -45.36 85.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.062 179.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.05 -43.31 99.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.261 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.414 ' HA ' ' HB ' ' A' ' 110' ' ' ILE . 1.4 mm-40 -63.31 -29.83 71.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.722 179.679 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 40.4 t -67.64 -50.53 57.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.705 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.81 -35.03 67.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.487 0.66 . . . . 0.0 109.503 178.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.44 ' CG1' HG23 ' A' ' 121' ' ' THR . 13.4 mt -57.57 -49.49 80.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.456 179.285 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -72.34 -37.93 68.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.6 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 3.1 m -68.88 -13.39 62.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.073 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 77.26 30.81 0.51 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.902 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -100.75 -29.43 12.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.561 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -80.88 143.05 33.0 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.927 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -99.51 118.63 61.85 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.795 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.62 88.68 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.529 2.153 . . . . 0.0 112.504 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 97.6 m -110.56 -70.3 0.82 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.557 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.442 ' CE2' ' HG2' ' A' ' 8' ' ' MET . 48.1 t80 -147.7 -53.54 0.21 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.745 179.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -62.78 -44.66 95.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.875 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.44 HG23 ' CG1' ' A' ' 110' ' ' ILE . 0.7 OUTLIER -60.72 -49.1 78.85 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.466 179.702 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.8 -48.03 82.48 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.367 0.603 . . . . 0.0 110.153 179.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.57 -38.52 69.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.527 179.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.67 -44.29 86.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.988 179.163 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -50.9 -39.59 54.62 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.924 179.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -81.44 -32.55 32.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.113 179.012 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 tp -60.01 -19.74 54.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.489 179.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.4 mt -72.36 -28.7 63.2 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.032 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.941 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.754 0.312 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.82 -59.72 4.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.794 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -55.22 -36.83 66.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.655 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.6 tp60 -59.09 -38.26 79.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.962 0.411 . . . . 0.0 110.611 179.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -71.27 -57.13 4.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.111 179.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.444 HG12 ' CB ' ' A' ' 122' ' ' ALA . 2.9 mp -55.32 -62.28 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.163 179.049 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.9 t0 42.6 81.75 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.878 -1.055 . . . . 0.0 111.503 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.5 ptp -65.6 -19.27 65.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.309 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.8 mmtp -52.2 -28.71 19.34 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.186 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -63.68 154.57 32.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.878 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -70.24 130.34 41.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.072 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.445 ' HG3' ' CZ ' ' A' ' 119' ' ' TYR . 69.8 mm-40 -111.79 108.52 17.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.883 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.477 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 13.1 mtp180 -109.8 130.52 55.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.905 0.384 . . . . 0.0 110.915 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . 0.515 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 0.8 OUTLIER -115.67 134.85 54.63 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.996 179.879 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.477 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 5.9 m-85 -139.58 155.62 47.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.404 0.621 . . . . 0.0 112.313 -178.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.438 ' HG3' ' CD2' ' A' ' 38' ' ' TYR . 0.4 OUTLIER -149.26 144.86 26.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.519 179.122 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.423 ' CG2' ' CD ' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -136.13 125.58 15.94 Favored Pre-proline 0 C--N 1.327 -0.408 0 C-N-CA 120.893 -0.323 . . . . 0.0 111.834 -179.345 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.42 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 73.8 Cg_endo -89.2 96.92 0.34 Allowed 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.928 2.419 . . . . 0.0 111.664 179.337 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -119.17 153.81 34.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.973 0.416 . . . . 0.0 111.269 -179.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.445 HG12 ' HG2' ' A' ' 34' ' ' LYS . 11.2 mt -101.95 140.02 21.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.065 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.9 mtp180 -59.9 133.92 89.75 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.417 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.476 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 50.2 Cg_exo -53.59 -52.05 9.46 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.533 2.155 . . . . 0.0 113.0 -179.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.537 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -53.64 -58.78 5.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.522 -179.494 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.51 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 3.4 m-20 -67.71 -28.71 67.9 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.88 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.405 ' HB3' ' O ' ' A' ' 22' ' ' PRO . 0.1 OUTLIER -53.09 -57.34 10.73 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.599 -179.405 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.537 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.9 p90 -87.28 -17.19 33.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.562 -179.432 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.51 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -58.53 -53.23 60.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.899 0.381 . . . . 0.0 110.813 179.684 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -159.75 143.75 10.78 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.17 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -73.2 -7.96 21.31 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.604 2.203 . . . . 0.0 112.724 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -110.48 -36.59 5.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.901 0.382 . . . . 0.0 110.873 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -99.59 32.07 2.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.854 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.33 -30.04 61.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.935 -179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 42.6 mmtt 58.21 100.9 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.979 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.445 ' HG2' HG12 ' A' ' 20' ' ' ILE . 0.2 OUTLIER -85.0 119.79 25.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.917 179.966 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.415 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -105.85 143.79 15.75 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.907 -179.81 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.42 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 7.3 m-90 -108.99 137.44 46.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.811 0.338 . . . . 0.0 110.907 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 31.9 t90 -118.79 117.22 28.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.5 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.438 ' CD2' ' HG3' ' A' ' 16' ' ' ARG . 22.1 m-85 -111.61 149.29 31.69 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.778 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.433 ' HB3' ' CE1' ' A' ' 41' ' ' PHE . . . -170.37 124.85 0.73 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.088 0.471 . . . . 0.0 111.294 179.815 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.515 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 9.7 t-160 -95.27 103.78 15.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.673 179.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.589 ' CD2' ' HB ' ' A' ' 46' ' ' ILE . 4.4 m-85 -89.58 128.84 36.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.164 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.418 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 7.7 p-10 -96.65 114.43 26.07 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 178.623 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 58.23 -137.34 50.09 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.015 -1.088 . . . . 0.0 111.107 -178.505 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo -71.71 -16.46 29.95 Favored 'Trans proline' 0 CA--C 1.529 0.261 0 C-N-CA 122.503 2.135 . . . . 0.0 112.434 179.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' TRP . . . . . 0.408 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -114.73 -171.76 1.99 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.891 0.377 . . . . 0.0 111.804 -178.574 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.589 ' HB ' ' CD2' ' A' ' 41' ' ' PHE . 6.7 tt -131.24 153.86 39.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.875 -179.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.415 ' N ' HG12 ' A' ' 46' ' ' ILE . . . -132.28 -20.59 2.39 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.811 -0.631 . . . . 0.0 112.317 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.426 ' NE ' ' CB ' ' A' ' 120' ' ' ALA . 4.6 mtm180 -129.03 136.26 50.06 Favored 'General case' 0 C--N 1.334 -0.079 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.052 -179.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.97 122.92 15.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.087 -179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.417 ' HE1' ' CE1' ' A' ' 93' ' ' PHE . 5.2 ttm -125.07 112.59 16.69 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.7 179.732 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.49 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -95.27 133.29 39.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.099 -179.774 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.421 HD11 ' CD1' ' A' ' 38' ' ' TYR . 30.3 mt -135.13 108.77 7.96 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.735 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.415 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 1.7 m-70 -128.39 135.78 28.08 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 120.699 0.285 . . . . 0.0 111.057 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -54.21 -23.46 29.83 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.534 2.156 . . . . 0.0 112.161 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -104.5 -21.42 13.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.04 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 1.2 mmmm -119.12 125.17 27.78 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.754 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.75 167.58 0.6 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.49 2.126 . . . . 0.0 112.357 -179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.417 ' HA ' ' O ' ' A' ' 51' ' ' GLU . 20.0 Cg_endo -60.61 88.4 0.08 OUTLIER 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.718 2.279 . . . . 0.0 112.358 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.49 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 58.3 mt -64.97 105.83 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.814 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.454 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.2 OUTLIER -82.11 122.74 28.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.02 -179.905 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 91.1 mt -134.83 151.25 50.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.93 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.8 p -154.2 148.16 13.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.071 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.4 ' CB ' ' HA ' ' A' ' 47' ' ' ALA . . . -60.39 140.17 57.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.957 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.97 -46.78 1.56 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.381 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.32 -55.91 3.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.876 0.369 . . . . 0.0 110.69 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -109.74 37.63 2.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.775 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -54.14 -28.71 41.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.048 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -83.42 -28.91 28.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.84 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -77.45 -51.12 11.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.922 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.1 ptp -50.18 175.87 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.832 0.349 . . . . 0.0 111.179 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 0.423 ' O ' ' CB ' ' A' ' 72' ' ' GLU . 0.9 OUTLIER -55.64 -49.21 73.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.049 -179.86 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . 0.423 ' CB ' ' O ' ' A' ' 71' ' ' CYS . 20.1 tt0 83.47 -40.58 0.09 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.345 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 4.2 mmtt -56.28 -168.74 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.007 0.432 . . . . 0.0 111.13 -179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -109.78 -174.99 2.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.969 179.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.408 ' CD2' ' HB2' ' A' ' 41' ' ' PHE . 0.1 OUTLIER -60.1 -53.96 51.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.708 0.289 . . . . 0.0 111.643 -179.406 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -71.03 -53.39 14.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.812 0.339 . . . . 0.0 111.846 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -49.08 -36.8 19.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.186 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' THR . . . . . 0.405 ' HB ' ' CD2' ' A' ' 80' ' ' LEU . 0.9 OUTLIER -62.26 -65.86 0.63 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.755 0.312 . . . . 0.0 111.22 -179.569 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 130.43 -5.47 5.92 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.901 -179.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.457 ' HG ' ' HB2' ' A' ' 15' ' ' PHE . 3.8 mm? -53.26 -40.32 64.55 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.142 0.496 . . . . 0.0 110.23 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 11.4 p -81.05 -33.09 33.74 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.599 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -56.06 -32.26 63.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.558 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.423 ' CD ' ' CG2' ' A' ' 17' ' ' ILE . 1.9 tttp -72.27 179.81 3.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.732 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -96.73 75.25 2.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.893 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 80.42 67.47 1.55 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.631 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -97.93 20.15 12.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.771 0.32 . . . . 0.0 111.217 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -89.18 151.14 22.34 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.157 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.424 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 1.5 pt -133.83 159.44 42.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.11 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.69 151.71 91.32 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.861 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -72.5 -24.72 18.7 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.765 2.31 . . . . 0.0 112.815 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.72 -46.78 80.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.75 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -67.68 -38.45 83.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.768 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.417 ' CE1' ' HE1' ' A' ' 50' ' ' MET . 25.2 t80 -57.98 -53.23 60.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.817 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -72.28 -21.86 61.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.644 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.26 -50.49 73.82 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.061 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.412 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 17.2 mm -73.0 -33.73 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.168 178.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' TRP . . . . . 0.45 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 10.3 t-105 -53.78 -39.28 65.29 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.097 179.071 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -85.92 -27.2 25.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.8 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.412 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 5.8 mtm180 -56.59 -43.97 80.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.098 -179.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 42.5 t -93.89 -79.61 0.41 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.871 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 176.12 36.77 0.05 OUTLIER Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.569 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . 0.454 ' HA2' ' CD2' ' A' ' 60' ' ' LEU . . . -59.33 -50.73 64.6 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.391 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.438 HG12 ' CD2' ' A' ' 127' ' ' LEU . 3.3 mp -57.66 -50.01 78.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 120.761 0.315 . . . . 0.0 111.13 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -56.29 -44.41 79.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.933 0.397 . . . . 0.0 110.51 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -62.13 -46.29 89.68 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.14 179.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.02 -40.48 95.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.338 179.486 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.05 -29.75 70.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.687 179.545 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 35.7 t -69.28 -50.31 48.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.658 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.54 -35.33 68.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.452 0.644 . . . . 0.0 109.567 178.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.448 ' CG1' HG23 ' A' ' 121' ' ' THR . 13.1 mt -58.26 -49.4 81.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.426 179.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -72.56 -38.6 67.91 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.597 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 1.7 m -66.6 -15.67 63.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.184 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 77.16 34.97 0.37 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.972 0.415 . . . . 0.0 110.89 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 49.6 mm-40 -107.16 -28.19 10.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.626 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.67 151.25 39.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.029 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -107.38 108.98 62.49 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.95 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -46.29 92.18 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.68 2.253 . . . . 0.0 112.699 -179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 14.2 m -112.72 -55.69 2.49 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.742 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' TYR . . . . . 0.445 ' CZ ' ' HG3' ' A' ' 12' ' ' GLN . 51.0 t80 -166.55 -57.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.909 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.426 ' CB ' ' NE ' ' A' ' 48' ' ' ARG . . . -54.51 -43.08 71.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.054 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.448 HG23 ' CG1' ' A' ' 110' ' ' ILE . 9.2 p -58.41 -49.0 78.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.425 179.644 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.444 ' CB ' HG12 ' A' ' 6' ' ' ILE . . . -60.98 -49.95 75.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.38 0.61 . . . . 0.0 109.6 178.807 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -55.95 -30.85 62.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.069 178.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.404 ' CD2' HG21 ' A' ' 103' ' ' ILE . 0.2 OUTLIER -70.02 -46.52 64.91 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.852 178.979 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 59.6 mm-40 -51.45 -38.65 54.79 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.027 179.142 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -77.82 -36.03 50.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.05 179.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.438 ' CD2' HG12 ' A' ' 103' ' ' ILE . 0.4 OUTLIER -61.34 -18.2 57.51 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.408 178.937 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -140.64 80.33 1.75 Allowed 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.953 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.114 -0.946 . . . . 0.0 110.942 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.434 ' O ' ' NE2' ' A' ' 12' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.076 0 CA-C-O 120.796 0.331 . . . . 0.0 110.792 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.49 138.43 35.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.784 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.462 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 3.7 mp0 -124.5 115.76 21.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.994 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.473 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 8.1 mmt85 -134.58 130.79 37.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.002 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.519 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 0.2 OUTLIER -121.58 137.61 54.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.133 179.792 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.636 ' CZ ' HD11 ' A' ' 75' ' ' LEU . 0.1 OUTLIER -144.09 167.01 23.39 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.292 0.567 . . . . 0.0 112.007 -179.824 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.452 ' CD ' HG21 ' A' ' 88' ' ' ILE . 7.2 ptm180 -149.09 153.47 37.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.525 178.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -153.47 113.39 2.62 Favored Pre-proline 0 C--N 1.328 -0.365 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.612 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.429 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 75.5 Cg_endo -87.65 98.97 0.45 Allowed 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 123.026 2.484 . . . . 0.0 112.214 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -118.53 141.83 48.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.96 0.409 . . . . 0.0 111.076 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.547 HG21 ' HB2' ' A' ' 32' ' ' LYS . 14.6 mt -87.1 147.41 5.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.217 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.428 ' HD2' ' CE1' ' A' ' 53' ' ' HIS . 5.4 mtt180 -69.17 133.47 89.64 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.985 179.259 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.502 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 12.0 Cg_endo -55.76 -49.27 16.31 Favored 'Trans proline' 0 N--CA 1.464 -0.215 0 C-N-CA 122.524 2.15 . . . . 0.0 112.462 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.553 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -51.17 -58.69 5.48 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.307 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.51 ' HA ' ' CG ' ' A' ' 27' ' ' LYS . 1.2 m-20 -69.68 -30.29 67.91 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.094 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.439 ' HB3' ' HA ' ' A' ' 22' ' ' PRO . 0.0 OUTLIER -53.17 -46.15 68.81 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.668 -179.065 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.553 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.3 p90 -98.85 -36.45 9.78 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -177.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.511 ' HG2' ' O ' ' A' ' 23' ' ' ALA . 6.5 ptmt -60.95 -32.23 71.77 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.537 -0.465 . . . . 0.0 111.303 -178.854 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.432 ' CB ' ' HB2' ' A' ' 31' ' ' ASN . 43.4 m-20 -155.56 117.13 2.32 Favored Pre-proline 0 C--N 1.329 -0.316 0 C-N-CA 121.014 -0.274 . . . . 0.0 111.426 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -66.69 -24.4 47.76 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.418 2.078 . . . . 0.0 112.187 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.1 mp0 -94.58 -43.17 8.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.636 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.432 ' HB2' ' CB ' ' A' ' 28' ' ' ASP . 27.3 m-80 -88.16 53.96 2.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.439 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.547 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -119.62 70.19 0.85 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.253 -179.563 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.9 mmpt? -40.9 133.27 2.17 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.246 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.52 124.21 41.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.719 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -99.68 129.35 9.87 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.586 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.481 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 21.3 m-90 -102.03 124.79 48.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.955 0.407 . . . . 0.0 110.728 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.534 ' HZ3' HD22 ' A' ' 80' ' ' LEU . 82.6 t90 -114.69 117.01 29.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.149 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.701 ' CE1' HD12 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -117.84 148.89 41.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.087 179.216 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.653 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -157.31 124.68 5.23 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.126 0.489 . . . . 0.0 111.723 -179.104 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.519 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 9.5 t-160 -97.64 93.38 6.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.066 178.75 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.641 ' CZ ' HG21 ' A' ' 78' ' ' THR . 21.7 m-85 -77.53 149.36 34.92 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.535 -179.025 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.485 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 86.8 m-20 -122.83 110.81 15.91 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.08 178.809 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.535 ' O ' HD23 ' A' ' 75' ' ' LEU . . . 61.9 -134.01 46.54 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 119.921 -1.133 . . . . 0.0 111.074 -178.387 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.407 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.4 Cg_exo -73.68 -14.65 24.51 Favored 'Trans proline' 0 CA--C 1.53 0.294 0 C-N-CA 122.448 2.099 . . . . 0.0 112.644 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' TRP . . . . . 0.414 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.6 OUTLIER -121.93 -162.89 1.02 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.665 -178.413 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.798 HD11 ' O ' ' A' ' 48' ' ' ARG . 2.2 tt -135.21 154.45 35.85 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.129 0 CA-C-O 121.028 0.442 . . . . 0.0 111.688 -179.661 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.423 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -126.55 -19.14 4.65 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.267 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.798 ' O ' HD11 ' A' ' 46' ' ' ILE . 7.2 mtm180 -128.73 133.56 48.17 Favored 'General case' 0 C--O 1.23 0.055 0 CA-C-O 120.951 0.405 . . . . 0.0 111.084 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.509 ' HG2' HD12 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -142.08 137.53 31.08 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.924 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.488 ' HG3' ' HB2' ' A' ' 38' ' ' TYR . 0.6 OUTLIER -146.82 128.5 15.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.614 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.401 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 2.5 mt-10 -117.36 138.76 51.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.196 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.701 HD12 ' CE1' ' A' ' 38' ' ' TYR . 4.7 mt -135.12 120.77 19.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.055 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.428 ' CE1' ' HD2' ' A' ' 21' ' ' ARG . 0.3 OUTLIER -133.61 131.62 21.37 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.5 179.701 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -48.21 -27.05 8.93 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.639 2.226 . . . . 0.0 112.697 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -106.66 -13.87 15.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.27 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.62 120.97 30.25 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.797 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -49.83 168.21 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.585 2.19 . . . . 0.0 112.506 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -60.32 96.96 0.11 Allowed 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.552 2.168 . . . . 0.0 112.405 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.401 ' HB ' ' HB2' ' A' ' 51' ' ' GLU . 7.8 mt -79.1 96.04 2.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.079 0.466 . . . . 0.0 110.755 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.544 HD23 ' CZ3' ' A' ' 97' ' ' TRP . 1.0 OUTLIER -86.83 116.37 24.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.797 -179.903 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.565 HD13 ' HB3' ' A' ' 69' ' ' GLU . 20.1 mt -119.76 151.89 38.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.952 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.885 HG22 ' CE2' ' A' ' 105' ' ' TYR . 16.1 m -143.42 158.5 17.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.114 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.47 148.22 52.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.126 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.51 -55.6 4.18 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.526 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.476 ' HE2' ' HB2' ' A' ' 109' ' ' ALA . 3.4 mttm -80.28 -67.02 0.81 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.864 0.364 . . . . 0.0 110.871 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -97.24 39.82 1.17 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.819 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.85 -28.63 61.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.016 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -82.88 -27.18 30.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.901 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.565 ' HB3' HD13 ' A' ' 61' ' ' LEU . 0.4 OUTLIER -82.45 -54.39 5.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.102 -179.829 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.0 ptp -56.59 174.32 0.15 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.096 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.83 128.12 35.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.989 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.17 43.18 1.41 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.798 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.31 131.45 16.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.801 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -53.96 167.82 0.25 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.017 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.636 HD11 ' CZ ' ' A' ' 15' ' ' PHE . 2.6 mm? -44.04 -53.57 6.2 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.155 -179.342 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -70.38 -32.03 69.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.966 -179.438 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -80.09 -11.17 59.79 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.82 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.714 ' CG2' HD21 ' A' ' 80' ' ' LEU . 0.1 OUTLIER -74.41 -67.19 0.65 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.88 0.372 . . . . 0.0 111.054 -179.947 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 124.84 -27.94 5.3 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.287 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.714 HD21 ' CG2' ' A' ' 78' ' ' THR . 0.0 OUTLIER -59.55 -35.0 73.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.999 0.428 . . . . 0.0 110.382 179.684 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.439 ' CG2' HD12 ' A' ' 75' ' ' LEU . 0.6 OUTLIER -66.47 -40.97 89.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.56 179.595 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 13.8 mtt180 -67.35 -28.86 68.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.857 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.7 mtpt -55.28 -176.41 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.972 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.44 76.74 5.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.206 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 72.56 66.83 1.97 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.968 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -83.83 -17.62 40.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.764 0.316 . . . . 0.0 110.954 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.446 ' HA ' ' O ' ' A' ' 14' ' ' PHE . 0.6 OUTLIER -52.27 160.16 0.84 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.932 0.396 . . . . 0.0 111.645 -179.708 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.656 HD12 ' O ' ' A' ' 89' ' ' LEU . 1.5 pp -149.73 -179.72 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.899 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.656 ' O ' HD12 ' A' ' 88' ' ' ILE . 1.2 mp -98.69 148.18 34.2 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.668 179.637 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -65.64 -22.0 58.4 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.62 2.213 . . . . 0.0 112.443 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.33 -40.32 93.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.046 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -69.85 -45.57 67.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.905 0.383 . . . . 0.0 110.936 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.431 ' CZ ' ' HB3' ' A' ' 48' ' ' ARG . 14.0 t80 -57.38 -51.59 68.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.746 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.03 -22.83 63.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.78 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.11 -50.45 71.85 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.123 0.487 . . . . 0.0 109.793 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.467 HG21 HD11 ' A' ' 52' ' ' LEU . 20.6 mm -76.98 -33.97 21.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.757 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.544 ' CZ3' HD23 ' A' ' 60' ' ' LEU . 3.4 t-105 -52.42 -41.13 62.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.997 179.464 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -86.33 -30.55 22.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.633 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.423 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -56.83 -29.88 63.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.341 -179.694 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 16.2 m -107.23 -77.9 0.59 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.201 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 172.85 33.57 0.03 OUTLIER Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.621 -0.799 . . . . 0.0 112.743 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.478 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -60.08 -48.54 85.61 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.311 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.942 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.6 mp -52.86 -42.53 43.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.816 0.341 . . . . 0.0 111.102 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -60.91 -44.86 96.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.018 0.437 . . . . 0.0 110.282 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.885 ' CE2' HG22 ' A' ' 62' ' ' VAL . 10.6 t80 -62.58 -43.12 99.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.359 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.884 ' CD1' HD13 ' A' ' 124' ' ' LEU . 0.5 OUTLIER -66.0 -44.6 84.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.89 179.883 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.542 ' CD ' HD21 ' A' ' 128' ' ' LEU . 1.5 mt-30 -61.11 -29.92 70.05 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.987 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.61 -50.44 30.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.894 -179.743 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.617 ' HB3' ' HB2' ' A' ' 115' ' ' ALA . . . -72.41 -31.66 65.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.443 0.64 . . . . 0.0 109.746 179.159 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.754 HD11 HD22 ' A' ' 106' ' ' LEU . 9.3 mt -57.91 -49.01 82.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-N 115.063 -0.972 . . . . 0.0 110.448 179.263 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -70.61 -36.71 73.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.605 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 6.4 p -77.45 -6.61 54.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.214 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 27.6 mmt85 67.89 31.54 5.65 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.864 0.364 . . . . 0.0 110.9 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -107.94 -28.85 9.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.665 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.617 ' HB2' ' HB3' ' A' ' 109' ' ' ALA . . . -59.12 -21.54 59.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.329 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 65.35 82.09 0.21 Allowed Pre-proline 0 C--N 1.332 -0.171 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.851 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' PRO . . . . . 0.432 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 1.1 Cg_endo -45.36 97.48 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.854 2.37 . . . . 0.0 112.46 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 19.3 m -117.34 -55.81 2.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.91 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.462 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 8.2 t80 -160.32 -52.26 0.05 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.189 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.613 ' HB2' ' HE ' ' A' ' 48' ' ' ARG . . . -56.87 -41.88 78.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.313 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.697 HG22 ' CD2' ' A' ' 106' ' ' LEU . 80.6 p -57.93 -49.25 77.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.559 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.24 -49.02 78.8 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.353 0.597 . . . . 0.0 109.56 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -57.49 -32.56 67.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.855 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.942 HD11 ' HA ' ' A' ' 103' ' ' ILE . 0.4 OUTLIER -68.6 -46.1 70.22 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.026 179.035 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.696 ' HA ' HD12 ' A' ' 128' ' ' LEU . 28.1 mm100 -51.47 -39.54 57.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.804 -0.634 . . . . 0.0 109.974 179.199 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 43.2 m-20 -78.94 -32.1 45.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.292 179.096 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.2 tp -74.14 -7.34 52.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.925 179.216 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.696 HD12 ' HA ' ' A' ' 125' ' ' GLN . 38.6 mt . . . . . 0 C--N 1.333 -0.152 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.098 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 84.8 mtt-85 . . . . . 0 N--CA 1.458 -0.071 0 CA-C-O 120.78 0.324 . . . . 0.0 110.996 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -76.44 163.67 26.73 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.818 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.5 mp0 -121.43 103.0 8.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.041 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.486 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -116.99 122.09 43.25 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.613 -179.88 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.506 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 2.2 m-85 -108.51 148.71 29.84 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.677 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.571 ' HB2' HD22 ' A' ' 80' ' ' LEU . 1.8 m-85 -146.74 149.57 33.65 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.38 0.609 . . . . 0.0 112.186 -179.449 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.445 ' HG3' ' CE2' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -148.69 136.67 20.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.229 179.198 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.649 HG23 ' HB1' ' A' ' 86' ' ' ALA . 0.5 OUTLIER -141.67 131.91 12.86 Favored Pre-proline 0 C--N 1.329 -0.305 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.252 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -90.52 115.52 0.52 Allowed 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 123.183 2.589 . . . . 0.0 111.722 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.438 ' N ' ' CD1' ' A' ' 19' ' ' PHE . 2.1 p90 -134.08 149.56 51.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.89 0.376 . . . . 0.0 110.908 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.581 HG21 ' HB2' ' A' ' 32' ' ' LYS . 12.3 mt -98.77 140.59 18.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.122 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.5 mtp180 -65.01 124.53 86.96 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.296 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.487 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 86.2 Cg_exo -46.43 -50.36 10.41 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.523 2.149 . . . . 0.0 112.853 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.565 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -50.24 -58.46 5.56 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.118 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.529 ' HA ' ' CG ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -68.66 -31.37 70.45 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.161 179.838 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.455 ' HB3' ' HA ' ' A' ' 22' ' ' PRO . 0.0 OUTLIER -53.07 -45.48 68.14 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.757 -178.994 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.565 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.2 p90 -98.08 -36.6 10.04 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -177.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.529 ' CG ' ' HA ' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -59.88 -31.88 70.2 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.353 -179.068 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.443 ' CB ' ' HB2' ' A' ' 31' ' ' ASN . 28.0 m-20 -153.59 125.67 3.84 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 120.835 -0.346 . . . . 0.0 111.475 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -72.97 -28.73 12.77 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.487 2.125 . . . . 0.0 112.014 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.4 mm-40 -94.02 -44.04 8.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.449 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.443 ' HB2' ' CB ' ' A' ' 28' ' ' ASP . 44.5 m-20 -85.67 55.14 3.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.409 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.581 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -122.33 68.77 0.95 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.089 -179.707 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.5 mmpt? -41.5 135.72 2.0 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.123 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.15 109.84 22.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.856 -179.553 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.407 ' O ' ' CD1' ' A' ' 19' ' ' PHE . . . -83.76 123.63 6.26 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.332 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 8.1 m-90 -98.13 132.57 43.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.796 0.331 . . . . 0.0 110.784 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.711 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 27.2 t90 -114.06 117.86 32.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.259 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.908 ' CE1' HD12 ' A' ' 52' ' ' LEU . 3.3 m-85 -110.1 149.72 29.63 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.006 179.345 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.615 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -170.34 124.81 0.73 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.162 0.506 . . . . 0.0 112.132 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.506 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 20.1 t-160 -96.9 99.62 11.17 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.623 178.771 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.731 ' CZ ' HG21 ' A' ' 78' ' ' THR . 18.3 m-85 -85.65 119.95 26.54 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.497 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.448 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 12.1 p-10 -88.18 110.86 21.03 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.327 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.38 -136.29 49.48 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 119.954 -1.117 . . . . 0.0 110.842 -178.16 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_exo -72.09 -16.46 28.69 Favored 'Trans proline' 0 CA--C 1.531 0.33 0 C-N-CA 122.407 2.071 . . . . 0.0 112.335 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' TRP . . . . . 0.414 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.8 OUTLIER -115.81 -173.51 2.36 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.773 0.32 . . . . 0.0 111.795 -178.491 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.615 HD12 ' HB1' ' A' ' 39' ' ' ALA . 3.6 tt -131.02 153.04 38.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 121.227 0.537 . . . . 0.0 112.211 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.449 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -130.33 -22.6 2.76 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.739 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.576 ' O ' HD11 ' A' ' 46' ' ' ILE . 5.2 ttt180 -127.88 140.3 52.1 Favored 'General case' 0 N--CA 1.461 0.084 0 CA-C-O 120.778 0.323 . . . . 0.0 111.159 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.546 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 18.0 tt0 -153.44 136.39 15.45 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.003 0.43 . . . . 0.0 111.136 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.412 ' HG2' ' CZ3' ' A' ' 97' ' ' TRP . 0.0 OUTLIER -136.61 132.65 35.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.63 179.724 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.483 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 0.3 OUTLIER -119.32 125.91 50.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.815 179.865 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.908 HD12 ' CE1' ' A' ' 38' ' ' TYR . 0.8 OUTLIER -125.54 113.53 17.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.965 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.415 ' NE2' HD12 ' A' ' 59' ' ' ILE . 21.1 m-70 -122.23 133.89 24.56 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.703 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -50.69 -24.35 12.87 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.405 2.07 . . . . 0.0 112.518 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -106.38 -22.15 12.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.244 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 4.9 mmtt -115.18 125.95 28.34 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.985 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -49.49 167.55 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.425 2.083 . . . . 0.0 112.614 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.433 ' HB3' HD23 ' A' ' 52' ' ' LEU . 37.4 Cg_exo -60.89 84.07 0.08 OUTLIER 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.715 2.277 . . . . 0.0 112.418 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.564 HG22 HD23 ' A' ' 61' ' ' LEU . 21.5 mt -60.44 106.73 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.679 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.469 ' HG ' ' CH2' ' A' ' 97' ' ' TRP . 0.9 OUTLIER -83.86 117.31 23.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.949 -179.78 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.883 HD11 ' CB ' ' A' ' 69' ' ' GLU . 1.5 mm? -117.14 146.86 42.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.786 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.536 HG21 HD21 ' A' ' 106' ' ' LEU . 13.5 p -155.11 156.66 4.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.338 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.449 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -72.66 138.79 46.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.758 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.4 ' CA ' ' HD3' ' A' ' 116' ' ' ARG . . . 91.21 -62.74 2.82 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.242 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.446 ' HB2' ' HA ' ' A' ' 115' ' ' ALA . 2.2 tmtp? -67.4 -35.16 78.74 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.992 0.425 . . . . 0.0 110.512 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.5 ' CB ' HD13 ' A' ' 61' ' ' LEU . 71.9 m-20 -134.43 58.23 1.78 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.776 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -66.91 -21.6 65.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.35 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -85.34 -38.79 18.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.838 0.352 . . . . 0.0 110.871 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.883 ' CB ' HD11 ' A' ' 61' ' ' LEU . 0.3 OUTLIER -80.13 -33.82 38.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.896 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -48.66 170.09 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.021 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.622 ' SG ' HG22 ' A' ' 78' ' ' THR . 9.3 t -64.47 -40.75 96.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.184 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 77.09 -66.44 0.24 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.947 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.43 171.7 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.314 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -96.78 -169.67 1.92 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.668 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.716 ' HB3' HG21 ' A' ' 81' ' ' THR . 64.9 mt -66.28 -44.75 82.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.585 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -70.06 -31.21 68.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.462 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -85.31 -24.35 27.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.613 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.731 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.7 OUTLIER -63.81 -77.04 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.758 0.313 . . . . 0.0 111.196 -179.781 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLY . . . . . 0.402 ' HA2' ' CG ' ' A' ' 82' ' ' ARG . . . 140.49 -18.17 2.85 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.55 -0.833 . . . . 0.0 113.104 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.711 HD21 ' CZ3' ' A' ' 37' ' ' TRP . 0.6 OUTLIER -65.82 -51.21 60.86 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.929 0.395 . . . . 0.0 110.828 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.716 HG21 ' HB3' ' A' ' 75' ' ' LEU . 54.8 p -56.02 -52.69 63.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.153 -179.766 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.402 ' CG ' ' HA2' ' A' ' 79' ' ' GLY . 1.4 ppt_? -62.29 -27.71 69.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.67 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 10.7 tttt -59.95 -168.56 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.796 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -90.91 77.79 6.12 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.536 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 55.04 69.12 1.36 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.327 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.649 ' HB1' HG23 ' A' ' 17' ' ' ILE . . . -89.6 22.54 2.97 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.656 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.98 179.51 4.91 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.761 0.315 . . . . 0.0 110.721 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.511 HG22 ' CA ' ' A' ' 15' ' ' PHE . 3.8 tt -159.58 159.07 2.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.074 0.464 . . . . 0.0 111.103 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.572 ' H ' HD12 ' A' ' 89' ' ' LEU . 4.2 mp -73.42 146.41 86.37 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.811 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.5 -30.8 14.62 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.533 2.155 . . . . 0.0 112.309 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.71 -38.48 73.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.935 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -69.23 -48.28 62.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.845 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.404 ' CZ ' ' CG ' ' A' ' 50' ' ' MET . 14.2 t80 -55.23 -52.97 61.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.549 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -22.68 64.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.478 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -50.37 73.97 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.172 0.511 . . . . 0.0 109.687 179.164 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.41 ' HB ' ' CE ' ' A' ' 50' ' ' MET . 18.2 mm -71.47 -32.96 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.323 179.24 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.469 ' CH2' ' HG ' ' A' ' 60' ' ' LEU . 16.9 t-105 -57.69 -36.74 72.35 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.752 178.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.623 ' HG3' HD11 ' A' ' 103' ' ' ILE . 1.0 OUTLIER -85.11 -25.69 27.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.227 179.136 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 25.0 ttt85 -61.56 -53.62 53.98 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.272 -179.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -81.2 -84.66 0.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.084 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -173.44 36.39 0.13 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.444 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.463 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -54.31 -61.3 7.35 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.538 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.904 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.1 mp -55.31 -46.31 78.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.695 0.283 . . . . 0.0 111.681 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -58.99 -49.26 78.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.941 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.426 ' HB3' HD23 ' A' ' 60' ' ' LEU . 54.4 t80 -60.76 -50.91 71.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.411 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.588 HD12 HD11 ' A' ' 110' ' ' ILE . 0.3 OUTLIER -57.65 -44.79 85.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.787 179.695 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.402 ' HG2' ' CD2' ' A' ' 124' ' ' LEU . 1.8 mm100 -61.43 -29.93 70.25 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.844 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 32.6 t -68.31 -50.67 51.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.968 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.444 ' HB1' ' HB2' ' A' ' 114' ' ' GLN . . . -75.13 -32.37 61.33 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.307 0.575 . . . . 0.0 109.784 179.238 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.655 HD11 ' HA ' ' A' ' 121' ' ' THR . 7.0 mt -57.71 -48.68 82.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.264 179.353 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -72.42 -36.06 68.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.72 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.5 -8.31 56.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.327 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 15.6 mmt85 72.0 46.6 0.34 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.005 0.431 . . . . 0.0 110.958 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' GLN . . . . . 0.444 ' HB2' ' HB1' ' A' ' 109' ' ' ALA . 9.2 mm-40 -122.37 -40.41 2.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.67 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.446 ' HA ' ' HB2' ' A' ' 65' ' ' LYS . . . -59.3 -19.88 49.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.413 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.4 ' HD3' ' CA ' ' A' ' 64' ' ' GLY . 26.8 mtp180 62.96 118.1 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.577 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -49.22 90.9 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.409 2.073 . . . . 0.0 112.625 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 10.8 t -119.35 -165.07 1.11 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.513 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -64.45 -47.62 78.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.733 0.302 . . . . 0.0 110.778 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -60.06 -52.08 66.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.273 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.655 ' HA ' HD11 ' A' ' 110' ' ' ILE . 80.3 p -57.83 -49.13 77.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.594 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.25 -54.02 51.47 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.525 0.679 . . . . 0.0 109.721 179.024 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' MET . . . . . 0.64 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -56.25 -35.41 67.37 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.778 178.663 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.904 HD11 ' HA ' ' A' ' 103' ' ' ILE . 0.3 OUTLIER -65.47 -44.95 85.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.825 178.763 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 60.8 mm-40 -49.97 -44.21 50.61 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.279 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -83.86 -23.71 31.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.782 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.64 HD13 ' CE ' ' A' ' 123' ' ' MET . 4.4 tp -65.73 -19.68 65.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.743 0.306 . . . . 0.0 110.502 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.582 ' O ' HD12 ' A' ' 128' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--N 1.332 -0.161 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.133 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.527 0.068 0 CA-C-O 120.889 0.376 . . . . 0.0 111.175 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.51 156.73 21.55 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.994 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 67.2 mm-40 -131.22 107.46 9.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.027 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.736 ' HD3' HD21 ' A' ' 75' ' ' LEU . 3.0 mtp180 -127.49 139.53 52.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.847 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.515 ' CE2' ' CG ' ' A' ' 40' ' ' HIS . 0.7 OUTLIER -122.47 135.03 54.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.3 -179.652 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.635 ' HB2' HD22 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -138.9 154.93 48.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.288 0.566 . . . . 0.0 111.926 -179.218 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.779 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.22 144.16 26.37 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.608 179.525 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.638 HG21 ' HG2' ' A' ' 83' ' ' LYS . 0.5 OUTLIER -148.97 132.17 8.22 Favored Pre-proline 0 C--N 1.329 -0.301 0 C-N-CA 120.851 -0.34 . . . . 0.0 111.784 -179.693 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.475 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 64.6 Cg_endo -91.65 111.54 0.31 Allowed 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 123.11 2.54 . . . . 0.0 112.25 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.0 p90 -131.11 140.74 50.05 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.795 0.331 . . . . 0.0 110.83 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.647 HD11 ' NZ ' ' A' ' 34' ' ' LYS . 9.3 mt -84.7 143.4 11.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.051 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.401 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 0.0 OUTLIER -64.77 124.73 87.2 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.5 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.636 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 72.1 Cg_exo -39.5 -55.13 1.68 Allowed 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.956 2.437 . . . . 0.0 112.938 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.681 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -44.83 -58.16 3.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.636 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.486 ' HA ' ' CG ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -63.73 -34.65 78.35 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.969 -178.907 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.636 ' HG3' ' HA ' ' A' ' 22' ' ' PRO . 0.9 OUTLIER -54.99 -51.29 66.67 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -178.393 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.681 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 0.9 OUTLIER -88.23 -40.52 13.6 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -177.862 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.53 ' HG2' ' O ' ' A' ' 23' ' ' ALA . 12.3 ptmt -58.74 -33.01 69.77 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.716 -178.723 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -160.52 123.31 1.85 Allowed Pre-proline 0 C--N 1.328 -0.338 0 C-N-CA 120.766 -0.373 . . . . 0.0 111.606 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -73.13 -25.67 15.72 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.571 2.18 . . . . 0.0 112.206 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -93.06 -44.34 8.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.461 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -88.0 54.44 3.09 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.443 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.534 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -123.5 64.64 1.02 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.489 -179.384 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.84 143.01 5.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.618 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.647 ' NZ ' HD11 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -97.06 157.97 15.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.085 0.469 . . . . 0.0 111.592 -179.352 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -130.07 132.23 6.91 Favored Glycine 0 N--CA 1.451 -0.326 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.966 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.475 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 22.1 m-90 -97.75 131.09 44.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.879 0.371 . . . . 0.0 111.228 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.585 ' CZ3' HD11 ' A' ' 80' ' ' LEU . 39.2 t90 -115.35 117.65 31.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.085 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.809 ' CE1' HD12 ' A' ' 52' ' ' LEU . 1.6 m-85 -109.91 156.9 19.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.055 179.371 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.63 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.37 124.49 0.72 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.126 0.489 . . . . 0.0 111.906 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.515 ' CG ' ' CE2' ' A' ' 14' ' ' PHE . 11.0 t-160 -97.0 92.41 6.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.288 178.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.551 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 8.8 m-85 -74.47 155.76 37.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.077 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.56 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.7 OUTLIER -125.08 110.91 14.72 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.812 -0.811 . . . . 0.0 108.812 178.957 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 59.06 -133.84 52.52 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 119.706 -1.235 . . . . 0.0 110.678 -177.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -72.53 -19.6 24.58 Favored 'Trans proline' 0 CA--C 1.532 0.394 0 C-N-CA 122.359 2.039 . . . . 0.0 112.133 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' TRP . . . . . 0.439 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.7 OUTLIER -113.17 -160.12 0.71 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.567 -178.756 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.838 HD11 ' O ' ' A' ' 48' ' ' ARG . 7.6 tt -140.75 155.74 22.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-O 121.084 0.469 . . . . 0.0 111.849 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.418 ' O ' ' HE1' ' A' ' 70' ' ' MET . . . -128.65 -16.08 4.33 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.712 -0.676 . . . . 0.0 112.197 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.838 ' O ' HD11 ' A' ' 46' ' ' ILE . 4.2 mtt180 -137.06 137.86 39.79 Favored 'General case' 0 C--O 1.231 0.085 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.192 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.501 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 19.4 tt0 -151.56 125.7 9.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.255 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.569 ' SD ' HD11 ' A' ' 52' ' ' LEU . 0.8 OUTLIER -125.02 111.97 16.0 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.154 179.465 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.43 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 4.2 mt-10 -99.76 132.33 45.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.662 -179.256 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.809 HD12 ' CE1' ' A' ' 38' ' ' TYR . 3.6 mt -127.17 101.68 6.62 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.254 179.244 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -125.49 150.04 66.62 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 120.872 0.368 . . . . 0.0 111.332 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -61.69 -31.52 86.31 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.645 2.23 . . . . 0.0 112.198 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -94.7 -8.65 37.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.177 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.701 ' HB3' HD11 ' A' ' 59' ' ' ILE . 0.1 OUTLIER -136.25 114.45 10.65 Favored Pre-proline 0 C--N 1.331 -0.204 0 CA-C-N 116.687 -0.233 . . . . 0.0 110.785 179.974 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -50.96 -176.57 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.459 2.106 . . . . 0.0 112.311 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -59.15 85.2 0.06 OUTLIER 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 122.416 2.077 . . . . 0.0 112.398 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.701 HD11 ' HB3' ' A' ' 56' ' ' LYS . 87.7 mt -76.03 97.47 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.807 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.504 HD13 ' HA2' ' A' ' 102' ' ' GLY . 4.3 mt -83.74 100.53 10.96 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.487 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.797 HD21 ' HB3' ' A' ' 69' ' ' GLU . 0.3 OUTLIER -95.98 152.57 18.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.346 -179.461 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.556 HG21 HD21 ' A' ' 106' ' ' LEU . 11.5 p -152.56 161.64 2.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.656 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.483 ' N ' HG22 ' A' ' 62' ' ' VAL . . . -78.8 158.58 28.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.818 0.342 . . . . 0.0 111.502 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.416 ' HA3' ' HD2' ' A' ' 116' ' ' ARG . . . 70.17 -66.8 0.7 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.459 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.44 ' HB3' HG13 ' A' ' 62' ' ' VAL . 7.5 tptm -62.89 -41.3 99.36 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.836 0.351 . . . . 0.0 110.821 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.427 ' HB3' ' CD1' ' A' ' 61' ' ' LEU . 24.8 m-20 -132.56 56.99 1.81 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.788 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.27 -17.74 62.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.487 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 3.6 mtm -83.12 -30.45 27.91 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.713 0.292 . . . . 0.0 111.147 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.797 ' HB3' HD21 ' A' ' 61' ' ' LEU . 6.0 mm-40 -97.88 -23.75 15.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.242 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.418 ' HE1' ' O ' ' A' ' 47' ' ' ALA . 3.1 ttm -57.44 163.79 2.19 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.863 0.364 . . . . 0.0 111.108 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 8.8 t -46.99 -49.76 20.3 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.332 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 77.2 -57.49 0.51 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.987 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.7 mmtm -55.88 158.84 3.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.018 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -90.81 176.28 6.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.254 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.736 HD21 ' HD3' ' A' ' 13' ' ' ARG . 0.9 OUTLIER -54.75 -51.17 66.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.873 0.368 . . . . 0.0 111.56 -179.617 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -31.52 69.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.283 -179.62 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -81.42 -10.15 59.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.752 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.407 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 1.4 p -91.51 -73.96 0.52 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.77 0.319 . . . . 0.0 111.143 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 139.09 -20.91 3.0 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.785 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.707 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 3.8 mt -49.29 -30.04 6.8 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.991 0.424 . . . . 0.0 110.813 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.405 HG23 ' HG ' ' A' ' 75' ' ' LEU . 63.0 p -80.56 -31.92 36.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.362 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -94.48 7.87 44.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.046 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.638 ' HG2' HG21 ' A' ' 17' ' ' ILE . 2.2 mptt -92.69 32.05 1.29 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.726 0.298 . . . . 0.0 111.216 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 58.46 63.07 1.79 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.964 0.411 . . . . 0.0 111.053 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 62.76 60.38 7.82 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.627 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.707 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -77.32 -3.65 41.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.65 0.262 . . . . 0.0 111.576 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -51.51 168.13 0.08 Allowed 'General case' 0 CA--C 1.528 0.129 0 CA-C-O 120.839 0.352 . . . . 0.0 111.358 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.779 HG21 ' HB3' ' A' ' 16' ' ' ARG . 1.0 OUTLIER -151.23 179.94 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.151 179.872 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.523 HD12 ' HB3' ' A' ' 91' ' ' ARG . 0.2 OUTLIER -97.82 145.82 30.39 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.717 179.871 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.78 -10.48 28.64 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.591 2.194 . . . . 0.0 112.532 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.523 ' HB3' HD12 ' A' ' 89' ' ' LEU . 0.4 OUTLIER -72.05 -51.93 19.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.56 -179.93 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.404 ' N ' ' HG3' ' A' ' 91' ' ' ARG . 0.5 OUTLIER -67.45 -42.91 82.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.039 -179.907 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -56.98 -53.28 59.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.879 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.88 -19.34 61.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.732 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -62.37 -50.52 71.24 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 179.214 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.466 ' HB ' ' HE1' ' A' ' 50' ' ' MET . 19.3 mm -75.95 -33.79 25.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.59 179.326 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.483 ' CZ3' ' CD2' ' A' ' 60' ' ' LEU . 12.9 t-105 -52.45 -40.98 62.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.007 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -86.24 -31.56 21.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.584 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.439 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.1 OUTLIER -57.71 -52.91 63.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.385 -179.637 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 95.0 m -79.77 -82.47 0.11 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.225 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.405 ' C ' HD13 ' A' ' 60' ' ' LEU . . . -178.3 37.89 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.622 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.504 ' HA2' HD13 ' A' ' 60' ' ' LEU . . . -72.02 -41.25 55.1 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.542 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.709 ' HA ' HD11 ' A' ' 124' ' ' LEU . 29.4 mm -64.68 -46.65 91.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.799 0.333 . . . . 0.0 110.897 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -60.17 -49.12 78.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.492 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -57.61 -49.11 77.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.286 179.494 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.874 HD12 HD11 ' A' ' 110' ' ' ILE . 0.2 OUTLIER -59.03 -45.02 91.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.361 179.355 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.425 ' HG2' ' CD2' ' A' ' 124' ' ' LEU . 0.9 OUTLIER -61.14 -29.75 69.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.997 179.615 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.36 -50.5 45.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.972 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.408 ' HB1' ' HB2' ' A' ' 114' ' ' GLN . . . -74.0 -31.72 63.08 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.333 0.587 . . . . 0.0 109.716 179.033 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.874 HD11 HD12 ' A' ' 106' ' ' LEU . 11.7 mt -59.0 -49.23 83.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.517 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -72.39 -37.18 68.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.783 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 5.8 m -76.0 -8.33 56.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.358 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 72.11 28.59 2.46 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.806 0.336 . . . . 0.0 110.867 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' GLN . . . . . 0.413 ' CB ' ' HD3' ' A' ' 65' ' ' LYS . 74.2 mt-30 -98.55 -29.73 12.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.652 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.71 -163.92 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.886 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.416 ' HD2' ' HA3' ' A' ' 64' ' ' GLY . 1.5 tpt180 -133.76 91.74 24.56 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.195 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -50.04 90.25 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.578 2.185 . . . . 0.0 111.849 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 2.4 p -136.12 -50.46 0.7 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.553 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -162.23 -61.6 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.339 . . . . 0.0 111.576 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.482 ' O ' ' HB2' ' A' ' 124' ' ' LEU . . . -53.59 -38.59 64.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.558 -179.203 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.501 HG22 ' CD1' ' A' ' 106' ' ' LEU . 17.7 p -69.3 -35.64 76.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.786 0.327 . . . . 0.0 110.679 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -70.22 -55.44 9.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.279 0.562 . . . . 0.0 110.532 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' MET . . . . . 0.503 ' HE1' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -56.44 -29.22 61.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.374 179.207 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.709 HD11 ' HA ' ' A' ' 103' ' ' ILE . 0.3 OUTLIER -69.47 -44.61 70.82 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.095 0.474 . . . . 0.0 109.937 178.96 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.675 ' HA ' HD12 ' A' ' 128' ' ' LEU . 18.0 mm100 -54.03 -44.84 71.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.584 179.649 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.07 -30.11 31.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.707 179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.515 HD23 ' C ' ' A' ' 127' ' ' LEU . 1.2 tt -66.61 -16.05 63.9 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.282 179.039 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.675 HD12 ' HA ' ' A' ' 125' ' ' GLN . 10.0 mt . . . . . 0 C--N 1.332 -0.167 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.953 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.912 0.387 . . . . 0.0 111.36 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -69.01 177.6 2.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.921 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.441 ' HG3' ' CZ ' ' A' ' 119' ' ' TYR . 12.5 mm100 -127.74 111.91 14.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.948 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.468 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -116.43 135.51 53.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.749 179.882 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.523 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 0.0 OUTLIER -126.85 149.74 49.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.55 -179.524 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.789 ' HB2' HD22 ' A' ' 80' ' ' LEU . 0.2 OUTLIER -154.67 162.46 41.12 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.226 0.536 . . . . 0.0 111.653 179.981 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.48 ' CG ' HG21 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.29 154.08 38.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.627 178.843 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -151.93 127.64 5.0 Favored Pre-proline 0 C--N 1.328 -0.361 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.891 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.453 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 75.3 Cg_endo -87.43 94.73 0.46 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.953 2.435 . . . . 0.0 111.981 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.0 p90 -111.76 155.08 24.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.87 0.366 . . . . 0.0 110.907 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.589 HG12 ' CG ' ' A' ' 34' ' ' LYS . 1.4 mt -100.0 153.11 4.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.344 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 -82.47 134.9 47.32 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.526 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.592 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 72.9 Cg_exo -39.96 -60.25 0.59 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.956 2.438 . . . . 0.0 113.051 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.682 ' HB1' ' HD2' ' A' ' 27' ' ' LYS . . . -46.11 -54.01 9.33 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.826 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.414 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -61.02 -37.53 82.89 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.213 -178.93 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.592 ' HG3' ' HA ' ' A' ' 22' ' ' PRO . 0.9 OUTLIER -55.7 -57.35 12.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.913 0.387 . . . . 0.0 111.805 -178.965 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.627 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.6 p90 -86.47 -9.0 57.14 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.87 -179.238 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.682 ' HD2' ' HB1' ' A' ' 23' ' ' ALA . 2.9 mtpp -70.25 -44.49 68.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.948 0.404 . . . . 0.0 110.366 179.357 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -174.18 138.85 0.7 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.867 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -67.96 -23.44 40.71 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.549 2.166 . . . . 0.0 112.449 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.5 mm100 -95.76 -40.5 9.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.005 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -93.73 48.32 1.28 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.962 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.412 ' HD3' ' O ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -110.0 61.88 0.6 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.671 179.785 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.01 135.62 0.88 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.663 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.589 ' CG ' HG12 ' A' ' 20' ' ' ILE . 8.4 mtmt -104.82 141.15 37.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.519 -179.665 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -112.95 135.75 12.91 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.524 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.453 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 15.6 m-90 -100.47 111.67 23.95 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.929 0.395 . . . . 0.0 110.845 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.607 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 39.0 t90 -95.04 117.66 30.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.808 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.8 ' CE1' HD12 ' A' ' 52' ' ' LEU . 14.5 m-85 -105.58 152.43 23.09 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.372 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.665 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -163.43 123.46 2.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.267 0.556 . . . . 0.0 111.445 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.486 ' HB3' ' CB ' ' A' ' 48' ' ' ARG . 0.1 OUTLIER -99.39 86.89 3.48 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.401 -0.818 . . . . 0.0 108.796 178.801 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.693 ' CG ' ' HB ' ' A' ' 46' ' ' ILE . 7.6 m-85 -71.81 156.41 39.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.747 -178.479 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.536 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 4.3 t70 -130.38 118.25 20.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.317 -0.856 . . . . 0.0 108.81 178.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 58.63 -136.46 51.1 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 119.732 -1.223 . . . . 0.0 110.828 -178.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.415 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.4 Cg_exo -73.71 -15.46 24.16 Favored 'Trans proline' 0 CA--C 1.53 0.292 0 C-N-CA 122.495 2.13 . . . . 0.0 112.332 179.425 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' TRP . . . . . 0.415 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 0.8 OUTLIER -119.83 -157.68 0.71 Allowed 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.714 -178.467 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.863 HD11 ' O ' ' A' ' 48' ' ' ARG . 5.8 tt -137.81 156.54 31.96 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.104 0 CA-C-O 121.149 0.5 . . . . 0.0 112.094 -179.306 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.651 ' CB ' HG21 ' A' ' 118' ' ' THR . . . -129.94 -15.15 3.88 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.521 -0.763 . . . . 0.0 112.166 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.863 ' O ' HD11 ' A' ' 46' ' ' ILE . 11.2 mtt180 -136.28 138.64 41.98 Favored 'General case' 0 C--O 1.23 0.053 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.753 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.452 ' OE1' HD12 ' A' ' 61' ' ' LEU . 0.6 OUTLIER -146.43 130.81 17.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.226 -179.735 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.452 ' HE1' ' HB ' ' A' ' 96' ' ' ILE . 0.2 OUTLIER -127.46 112.81 15.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.608 179.821 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.491 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -89.93 118.94 29.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.053 -179.753 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.8 HD12 ' CE1' ' A' ' 38' ' ' TYR . 43.3 mt -120.38 102.73 8.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.806 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 16.9 m80 -130.82 136.22 28.57 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.914 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -52.25 -25.95 25.41 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.354 2.036 . . . . 0.0 112.28 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -94.87 -28.26 15.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.14 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.3 mttp -119.79 119.5 31.19 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.086 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.453 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 72.6 Cg_exo -48.79 171.0 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.565 2.177 . . . . 0.0 112.121 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.453 ' HD2' ' HB3' ' A' ' 57' ' ' PRO . 19.1 Cg_endo -59.02 83.42 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.462 2.108 . . . . 0.0 112.367 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.594 HG22 ' HG ' ' A' ' 61' ' ' LEU . 63.8 mt -61.39 104.87 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.776 179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.446 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.2 OUTLIER -79.92 100.8 8.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.848 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.594 ' HG ' HG22 ' A' ' 59' ' ' ILE . 84.0 mt -109.51 145.09 36.86 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.735 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.527 HG21 ' HG ' ' A' ' 106' ' ' LEU . 8.5 t -141.66 147.2 22.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.085 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.584 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -59.53 151.74 23.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.01 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.04 -58.87 4.99 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.406 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.531 ' HG3' ' HB1' ' A' ' 109' ' ' ALA . 0.0 OUTLIER -80.12 -31.64 39.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.92 0.39 . . . . 0.0 110.802 179.783 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -123.62 54.13 1.31 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.74 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.38 -30.21 71.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.891 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.24 -40.48 16.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.826 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.407 ' HB3' ' CD2' ' A' ' 61' ' ' LEU . 6.1 mm-40 -73.13 -54.94 7.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.902 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.424 ' HE2' ' C ' ' A' ' 48' ' ' ARG . 46.0 ttm -52.24 163.23 0.41 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.842 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 3.0 t -51.39 136.67 24.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.844 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -119.93 47.25 1.77 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.0 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.52 134.21 10.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.015 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -55.28 164.95 0.82 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.885 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.728 HD11 ' CE1' ' A' ' 15' ' ' PHE . 1.2 tp -50.78 -45.5 59.18 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.721 -179.507 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.21 -31.79 69.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.602 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.26 -21.58 28.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.699 -179.472 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.623 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -62.47 -74.51 0.09 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.85 0.357 . . . . 0.0 111.177 -179.805 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 138.67 -25.19 2.85 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.326 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.789 HD22 ' HB2' ' A' ' 15' ' ' PHE . 0.8 OUTLIER -53.5 -36.21 61.47 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.972 0.415 . . . . 0.0 110.661 179.844 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.5 p -74.21 -30.64 62.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.66 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.3 mmm180 -72.68 -31.95 65.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.609 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.4 mptt -60.9 -168.22 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.812 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.52 73.81 2.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.994 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 72.03 66.38 2.12 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.535 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.0 -10.04 59.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.569 0.223 . . . . 0.0 111.349 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.403 ' HA ' ' O ' ' A' ' 14' ' ' PHE . 8.3 tt0 -52.55 154.7 2.47 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.896 0.379 . . . . 0.0 111.415 -179.666 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.48 HG21 ' CG ' ' A' ' 16' ' ' ARG . 1.2 pt -144.78 168.28 9.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.198 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.57 HD23 ' CD ' ' A' ' 90' ' ' PRO . 2.3 mt -78.81 144.75 64.94 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.554 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' PRO . . . . . 0.57 ' CD ' HD23 ' A' ' 89' ' ' LEU . 11.5 Cg_exo -69.02 -35.4 14.91 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.369 2.046 . . . . 0.0 111.387 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 6.9 mtm180 -55.35 -54.4 44.14 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.344 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -57.62 -45.18 85.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.279 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.423 ' HD2' HD11 ' A' ' 88' ' ' ILE . 14.0 t80 -55.29 -53.09 60.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.824 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.64 -21.15 60.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.825 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -50.77 71.56 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.261 0.553 . . . . 0.0 109.649 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.452 ' HB ' ' HE1' ' A' ' 50' ' ' MET . 16.7 mm -72.9 -34.93 47.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.246 179.032 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.45 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 11.9 t-105 -54.08 -39.08 66.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.142 179.258 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.519 ' HG3' HD13 ' A' ' 103' ' ' ILE . 1.5 tt0 -85.67 -25.96 26.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.604 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.445 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -56.36 -54.3 47.18 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.393 -179.759 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 8.3 t -83.68 -67.52 0.78 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.061 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 160.62 40.91 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.563 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.45 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -60.76 -52.93 49.38 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.349 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.787 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.7 mp -53.86 -42.12 51.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.72 0.295 . . . . 0.0 111.136 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.64 -43.9 97.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.013 0.435 . . . . 0.0 110.2 179.38 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -63.88 -40.97 97.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.132 179.428 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.608 HD13 HD13 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -68.21 -38.52 82.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.659 179.69 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.595 ' CD ' HD22 ' A' ' 128' ' ' LEU . 0.2 OUTLIER -65.58 -30.07 70.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.516 179.607 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.3 m -70.62 -50.05 41.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.342 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.531 ' HB1' ' HG3' ' A' ' 65' ' ' LYS . . . -71.76 -33.5 68.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.33 0.586 . . . . 0.0 109.747 179.051 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.643 ' CD1' HD22 ' A' ' 124' ' ' LEU . 5.1 mt -56.93 -49.18 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.48 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -72.27 -38.08 68.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.598 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 59.0 m -66.39 -15.86 63.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.124 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.0 mmm180 76.81 30.43 0.59 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.892 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 42.2 mm-40 -102.76 -28.69 11.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.586 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.86 158.09 22.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.046 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.442 ' O ' HG22 ' A' ' 118' ' ' THR . 2.1 mtt85 -110.15 95.32 21.03 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.782 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' PRO . . . . . 0.408 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 87.9 Cg_exo -47.91 129.64 18.26 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.72 2.28 . . . . 0.0 112.588 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.651 HG21 ' CB ' ' A' ' 47' ' ' ALA . 1.1 t -161.1 -54.38 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.004 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.441 ' CZ ' ' HG3' ' A' ' 12' ' ' GLN . 68.5 t80 -159.59 -62.17 0.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.081 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.509 ' HB1' ' NE ' ' A' ' 48' ' ' ARG . . . -53.99 -44.18 70.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.276 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.449 HG22 ' CG1' ' A' ' 110' ' ' ILE . 0.5 OUTLIER -62.15 -34.89 77.24 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.912 0.387 . . . . 0.0 110.465 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -71.37 -58.7 3.28 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.675 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' MET . . . . . 0.58 ' HE1' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -58.22 -29.41 65.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.325 179.397 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.833 HD23 HD23 ' A' ' 128' ' ' LEU . 7.4 tt -68.23 -48.87 63.97 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.146 0.498 . . . . 0.0 109.971 179.02 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.493 ' HA ' HD21 ' A' ' 128' ' ' LEU . 0.0 OUTLIER -53.15 -36.39 60.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.159 179.33 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 18.5 m-20 -86.65 -29.28 22.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.536 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.58 HD13 ' HE1' ' A' ' 123' ' ' MET . 1.3 tt -72.83 -10.0 59.3 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.879 179.454 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.833 HD23 HD23 ' A' ' 124' ' ' LEU . 4.0 pp . . . . . 0 C--N 1.333 -0.122 0 CA-C-O 120.763 0.316 . . . . 0.0 111.165 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.4 mtt85 . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 120.791 0.329 . . . . 0.0 110.916 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.27 158.99 16.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.931 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.424 ' HG3' ' CE2' ' A' ' 119' ' ' TYR . 89.3 mm-40 -130.14 102.9 6.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.806 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.547 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -122.26 127.95 50.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.097 -179.579 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.498 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 0.4 OUTLIER -115.46 151.34 34.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.296 179.772 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.702 ' HB2' HD22 ' A' ' 80' ' ' LEU . 0.8 OUTLIER -151.51 159.09 44.3 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-O 121.289 0.566 . . . . 0.0 112.041 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.724 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.29 145.67 27.17 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.961 179.332 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.565 ' CD1' HD23 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -153.07 124.69 3.71 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.684 0.278 . . . . 0.0 111.745 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.471 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 68.3 Cg_endo -89.27 103.61 0.38 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.063 2.509 . . . . 0.0 111.914 179.698 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.2 p90 -116.87 138.25 51.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.957 0.408 . . . . 0.0 111.076 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.489 HG12 ' HG3' ' A' ' 34' ' ' LYS . 37.4 mt -78.87 134.42 27.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.117 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.5 ttp180 -58.19 139.88 83.54 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.643 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.462 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 14.3 Cg_endo -56.59 -45.38 37.46 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.395 2.063 . . . . 0.0 112.434 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.533 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -55.92 -58.35 8.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.173 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.57 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 0.6 OUTLIER -68.35 -29.85 68.67 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.765 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.39 -57.08 10.94 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.319 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.533 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.8 p90 -91.74 -13.56 31.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.747 -179.485 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.57 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 0.1 OUTLIER -62.31 -46.31 89.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.844 0.354 . . . . 0.0 110.554 179.785 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -166.39 142.94 4.08 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.244 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -69.75 -26.1 27.98 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.636 2.224 . . . . 0.0 112.258 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -94.95 -36.17 11.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.627 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -98.3 49.88 1.0 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.687 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.466 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -109.66 63.36 0.6 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.826 179.999 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.431 ' HB3' ' HG2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -41.98 142.81 0.64 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.368 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.489 ' HG3' HG12 ' A' ' 20' ' ' ILE . 0.4 OUTLIER -113.42 152.18 30.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.32 -179.618 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.427 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -127.94 138.28 10.32 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.289 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.471 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 28.3 m-90 -97.73 128.32 44.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.887 0.375 . . . . 0.0 110.708 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.554 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 23.2 t90 -113.91 117.36 31.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.309 -179.236 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.587 ' CE1' HD12 ' A' ' 52' ' ' LEU . 1.3 m-85 -111.72 155.34 23.62 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.031 179.189 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.758 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.53 126.74 0.77 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.043 0.449 . . . . 0.0 111.884 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.498 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 17.0 t-160 -98.1 99.12 10.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.608 178.872 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.811 ' CZ ' HG21 ' A' ' 78' ' ' THR . 34.1 m-85 -85.25 114.52 22.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.629 -179.117 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.445 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 51.9 t0 -88.39 113.89 24.45 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.534 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 59.67 -136.04 50.6 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 119.966 -1.111 . . . . 0.0 111.062 -178.489 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.406 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.4 Cg_exo -73.53 -15.25 24.74 Favored 'Trans proline' 0 N--CA 1.463 -0.28 0 C-N-CA 122.527 2.151 . . . . 0.0 112.266 179.394 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' TRP . . . . . 0.408 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -118.05 -173.99 2.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.965 0.412 . . . . 0.0 111.765 -178.527 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.788 HD11 ' O ' ' A' ' 48' ' ' ARG . 1.5 tt -129.62 147.1 33.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.59 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.503 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -122.5 -21.03 5.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.98 -179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.788 ' O ' HD11 ' A' ' 46' ' ' ILE . 5.3 ttm180 -127.17 139.23 53.1 Favored 'General case' 0 C--N 1.334 -0.089 0 C-N-CA 120.868 -0.333 . . . . 0.0 111.253 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.536 HE21 HD13 ' A' ' 61' ' ' LEU . 1.1 tt0 -154.51 139.24 17.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.786 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.431 ' HE2' ' HB ' ' A' ' 96' ' ' ILE . 1.2 ttm -140.44 116.75 10.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.9 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.444 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -95.95 136.83 35.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.002 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.587 HD12 ' CE1' ' A' ' 38' ' ' TYR . 81.0 mt -134.46 119.13 18.14 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.075 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.427 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 1.7 m-70 -143.24 135.0 12.95 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.915 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.431 ' HG2' ' HB3' ' A' ' 33' ' ' LYS . 9.8 Cg_endo -52.65 -26.86 31.11 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.565 2.177 . . . . 0.0 112.181 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -98.9 -24.46 14.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.968 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.442 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 0.5 OUTLIER -118.01 120.61 32.34 Favored Pre-proline 0 C--O 1.234 0.275 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.84 179.899 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.442 ' HD2' ' HA ' ' A' ' 56' ' ' LYS . 10.8 Cg_endo -54.15 168.89 0.78 Allowed 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.456 2.104 . . . . 0.0 112.204 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.428 ' HA ' ' O ' ' A' ' 51' ' ' GLU . 50.8 Cg_exo -55.52 86.77 0.04 OUTLIER 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.577 2.185 . . . . 0.0 112.38 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.444 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 88.6 mt -67.44 95.56 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.099 0.476 . . . . 0.0 110.62 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.46 HD21 ' N ' ' A' ' 102' ' ' GLY . 0.1 OUTLIER -71.65 127.63 33.18 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.913 -179.774 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.898 HD11 ' HB3' ' A' ' 69' ' ' GLU . 0.3 OUTLIER -132.67 147.18 52.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.085 -179.764 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.489 ' HA ' ' HE1' ' A' ' 70' ' ' MET . 10.5 p -156.24 142.1 10.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.837 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.503 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -56.27 164.03 1.46 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.285 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.408 ' HA3' ' HB2' ' A' ' 116' ' ' ARG . . . 76.24 -70.02 2.17 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.324 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -57.21 6.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.862 0.363 . . . . 0.0 110.654 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.424 ' HB3' ' CD2' ' A' ' 61' ' ' LEU . 11.1 m-20 -110.08 45.61 1.09 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.58 179.719 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.59 -21.71 65.82 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.399 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 5.5 ptp -81.26 -31.81 33.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.89 0.376 . . . . 0.0 110.625 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.898 ' HB3' HD11 ' A' ' 61' ' ' LEU . 27.2 mp0 -85.29 -36.8 20.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.897 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.489 ' HE1' ' HA ' ' A' ' 62' ' ' VAL . 0.8 OUTLIER -46.0 170.07 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.518 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.742 ' SG ' HD13 ' A' ' 46' ' ' ILE . 3.8 m -51.51 -26.6 8.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.109 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 68.16 -78.11 0.04 OUTLIER 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.971 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.51 -178.63 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.22 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -95.4 -164.72 1.19 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.691 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.537 HD21 ' HB3' ' A' ' 41' ' ' PHE . 3.8 mm? -69.48 -49.36 55.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.508 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -62.46 -31.59 72.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.688 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -83.31 -27.94 29.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.505 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.811 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.6 OUTLIER -67.2 -78.42 0.06 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.835 0.35 . . . . 0.0 111.085 -179.763 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 144.44 -21.97 2.04 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.76 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.702 HD22 ' HB2' ' A' ' 15' ' ' PHE . 2.5 mt -51.88 -33.13 35.32 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.91 0.386 . . . . 0.0 111.075 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 68.1 p -83.55 -31.45 26.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.789 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 46.7 mtm-85 -66.45 -29.78 69.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.886 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.412 ' CD ' HG21 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -70.02 -166.5 0.12 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.854 179.977 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -100.61 92.21 5.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.008 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 53.81 74.13 0.34 Allowed Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.803 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -85.41 4.44 35.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.592 0.234 . . . . 0.0 111.56 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.407 ' HA ' ' O ' ' A' ' 14' ' ' PHE . 8.4 tm-20 -59.98 158.09 11.55 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.813 0.339 . . . . 0.0 111.4 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.724 HG21 ' HB3' ' A' ' 16' ' ' ARG . 0.9 OUTLIER -147.38 -179.95 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.177 179.985 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.03 146.59 33.21 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.626 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -68.18 -16.85 44.96 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.6 2.2 . . . . 0.0 112.69 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.07 -54.58 39.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.147 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -70.36 -41.32 73.28 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.916 0.389 . . . . 0.0 110.992 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.43 ' CE2' ' HD2' ' A' ' 48' ' ' ARG . 9.4 t80 -57.8 -53.01 63.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.941 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.65 -21.22 60.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.849 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -60.68 -50.34 73.88 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.283 0.563 . . . . 0.0 109.616 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.538 HG21 HD11 ' A' ' 52' ' ' LEU . 19.9 mm -75.44 -34.9 31.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.636 179.318 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.458 ' CE2' ' HA3' ' A' ' 102' ' ' GLY . 41.4 t-105 -52.92 -40.46 63.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.915 179.307 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -85.94 -28.22 24.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.717 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.429 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.4 OUTLIER -56.75 -44.08 81.38 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.251 -179.75 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 50.2 t -90.09 -76.91 0.41 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.01 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.408 ' C ' HD21 ' A' ' 60' ' ' LEU . . . 173.95 37.45 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.573 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.46 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -68.76 -44.27 70.82 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.499 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.853 HD13 HD21 ' A' ' 127' ' ' LEU . 4.3 mt -60.88 -39.9 83.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.935 0.397 . . . . 0.0 110.922 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -63.39 -45.81 89.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.12 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 21.9 t80 -62.05 -36.22 80.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.174 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 1.043 HD13 HD13 ' A' ' 124' ' ' LEU . 0.3 OUTLIER -71.47 -40.23 70.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.58 179.605 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -64.73 -29.9 70.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.597 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 5.1 m -71.95 -50.06 32.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.475 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.539 ' HB3' ' HB2' ' A' ' 115' ' ' ALA . . . -69.94 -34.07 72.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.5 0.667 . . . . 0.0 109.622 178.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.607 HD11 HD22 ' A' ' 106' ' ' LEU . 5.9 mt -56.95 -49.18 80.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.512 179.278 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -72.13 -34.17 68.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.642 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.406 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 12.3 t -75.79 -8.97 58.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.303 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ARG . . . . . 0.406 ' HB2' ' O ' ' A' ' 112' ' ' SER . 5.3 mmm180 68.41 27.66 6.32 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.855 0.359 . . . . 0.0 110.909 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -109.62 -24.11 11.11 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.761 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.539 ' HB2' ' HB3' ' A' ' 109' ' ' ALA . . . -56.96 -21.96 34.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.32 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.408 ' HB2' ' HA3' ' A' ' 64' ' ' GLY . 75.2 ttt180 67.68 92.95 0.06 OUTLIER Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.316 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -46.66 90.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.877 2.385 . . . . 0.0 112.305 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -114.06 -63.41 1.45 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.183 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.424 ' CE2' ' HG3' ' A' ' 12' ' ' GLN . 9.5 t80 -161.8 -55.75 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.037 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.672 ' HB2' ' HE ' ' A' ' 48' ' ' ARG . . . -53.73 -30.12 42.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.18 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.435 ' HA ' HD11 ' A' ' 110' ' ' ILE . 22.2 p -69.79 -37.9 76.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.747 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -68.48 -54.06 19.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.011 0.434 . . . . 0.0 110.704 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' MET . . . . . 0.64 ' HE1' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -57.92 -29.63 65.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.564 179.519 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 1.043 HD13 HD13 ' A' ' 106' ' ' LEU . 0.2 OUTLIER -67.08 -50.13 62.71 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.084 0.469 . . . . 0.0 110.312 179.012 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.566 ' HA ' HD12 ' A' ' 128' ' ' LEU . 11.3 mm100 -53.42 -41.62 66.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.618 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -80.95 -31.13 35.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.39 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.853 HD21 HD13 ' A' ' 103' ' ' ILE . 0.9 OUTLIER -70.36 -12.04 61.31 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.534 179.073 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.566 HD12 ' HA ' ' A' ' 125' ' ' GLN . 8.7 mt . . . . . 0 C--N 1.332 -0.154 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.382 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.802 0.334 . . . . 0.0 111.05 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -95.18 170.46 9.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.098 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.48 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 1.6 mp0 -131.25 102.81 6.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.936 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.534 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 3.2 mtt-85 -122.08 126.6 48.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.002 0.43 . . . . 0.0 111.015 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.511 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 2.7 m-85 -108.77 134.84 50.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.811 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.808 ' CE2' HG22 ' A' ' 81' ' ' THR . 2.9 m-85 -131.43 153.49 49.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.38 0.61 . . . . 0.0 112.542 -178.307 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.503 ' CB ' HG21 ' A' ' 88' ' ' ILE . 0.8 OUTLIER -145.99 142.78 28.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.622 179.21 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.983 HD11 HD22 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -151.35 114.68 3.08 Favored Pre-proline 0 C--N 1.328 -0.362 0 C-N-CA 120.759 -0.377 . . . . 0.0 111.628 -179.456 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.451 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 74.7 Cg_endo -87.49 98.12 0.45 Allowed 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.894 2.396 . . . . 0.0 111.956 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 42.9 p90 -116.72 137.9 51.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.925 0.393 . . . . 0.0 111.059 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.63 HD11 ' NZ ' ' A' ' 34' ' ' LYS . 24.2 mt -78.92 145.72 9.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.325 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.16 142.32 94.86 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.429 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.446 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 19.1 Cg_endo -58.68 -50.78 8.45 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.508 2.139 . . . . 0.0 112.22 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.509 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -55.25 -58.23 8.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.066 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.524 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 1.1 m-20 -65.37 -30.25 71.06 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.0 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.51 -56.05 20.3 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.393 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.509 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.7 p90 -94.52 -5.0 47.03 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.976 -179.392 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.524 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 5.3 mtpp -73.02 -46.58 51.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.885 0.374 . . . . 0.0 110.818 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -162.59 141.48 6.87 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.287 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -73.18 -9.28 23.16 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.686 2.258 . . . . 0.0 112.543 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 78.5 mm-40 -110.83 -33.8 6.43 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.958 0.409 . . . . 0.0 110.814 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 67.3 m-20 -97.44 37.07 1.39 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.761 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.495 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -71.36 -35.02 70.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.412 -179.753 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 46.96 93.35 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.196 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.63 ' NZ ' HD11 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -77.9 149.9 34.17 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.479 -179.763 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.436 ' HA3' ' CD2' ' A' ' 53' ' ' HIS . . . -121.79 132.94 9.18 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.247 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.451 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 21.5 m-90 -98.26 124.23 42.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.894 0.378 . . . . 0.0 110.957 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.422 ' CD1' ' HG2' ' A' ' 51' ' ' GLU . 63.4 t90 -107.64 117.13 33.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.973 -179.497 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.864 ' CE1' HD12 ' A' ' 52' ' ' LEU . 22.5 m-85 -111.54 151.43 28.7 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.432 179.544 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.487 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -169.99 124.07 0.75 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.078 0.466 . . . . 0.0 111.343 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.511 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 16.8 t-160 -99.83 96.17 7.4 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.73 179.307 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.606 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 5.1 m-85 -79.09 143.39 35.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.225 -179.268 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.553 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.3 OUTLIER -113.37 111.71 22.44 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.822 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.87 -133.21 49.5 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 119.907 -1.139 . . . . 0.0 111.224 -178.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_exo -73.36 -16.78 24.53 Favored 'Trans proline' 0 CA--C 1.531 0.325 0 C-N-CA 122.509 2.139 . . . . 0.0 112.517 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' TRP . . . . . 0.425 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.5 OUTLIER -119.06 -163.48 0.97 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.751 -178.501 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.606 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 4.9 tt -134.85 155.53 38.49 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.693 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.604 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -131.59 -20.88 2.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.427 -179.362 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.558 ' O ' HD11 ' A' ' 46' ' ' ILE . 14.5 mtt180 -128.9 134.8 48.39 Favored 'General case' 0 C--O 1.23 0.064 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.764 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.458 ' NE2' ' O ' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -143.98 122.61 12.54 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.971 0.415 . . . . 0.0 111.466 -179.564 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.432 ' HE1' ' HB ' ' A' ' 96' ' ' ILE . 24.2 ttp -122.77 115.6 22.3 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.038 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.44 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 1.4 mt-10 -105.2 129.61 53.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.005 0.431 . . . . 0.0 111.69 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.864 HD12 ' CE1' ' A' ' 38' ' ' TYR . 5.2 mt -128.75 106.43 8.93 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.312 179.456 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.44 ' HB2' ' HG2' ' A' ' 56' ' ' LYS . 0.2 OUTLIER -131.7 138.7 33.17 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.543 -0.298 . . . . 0.0 111.13 -179.635 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.43 -23.91 26.09 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.381 2.054 . . . . 0.0 112.202 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -88.46 -32.85 18.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.129 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.514 ' HB2' HD11 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -127.12 125.74 24.17 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.09 -179.983 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.421 ' CB ' ' CD ' ' A' ' 58' ' ' PRO . 76.9 Cg_exo -50.81 -175.66 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.692 2.261 . . . . 0.0 112.485 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.421 ' CD ' ' CB ' ' A' ' 57' ' ' PRO . 33.3 Cg_exo -58.7 81.3 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.584 2.189 . . . . 0.0 112.498 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.514 HD11 ' HB2' ' A' ' 56' ' ' LYS . 94.6 mt -65.56 95.29 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.092 0.472 . . . . 0.0 110.441 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.452 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.4 OUTLIER -78.0 117.55 19.43 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.108 -179.608 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.425 ' HB2' ' HB3' ' A' ' 49' ' ' GLN . 53.9 mt -121.52 151.37 40.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.732 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.771 HG21 HD21 ' A' ' 106' ' ' LEU . 11.8 p -151.63 145.74 16.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.091 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.604 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -61.38 139.89 58.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.916 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.403 ' HA3' ' HG3' ' A' ' 116' ' ' ARG . . . 98.83 -47.43 1.4 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.394 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.543 ' HG3' ' HB1' ' A' ' 109' ' ' ALA . 0.0 OUTLIER -92.67 -42.46 9.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.901 0.381 . . . . 0.0 110.685 179.829 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -121.32 47.9 1.76 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.699 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.53 -29.84 70.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.045 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -85.38 -30.33 23.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.201 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -79.41 -50.11 11.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.196 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.4 ' HE1' ' N ' ' A' ' 63' ' ' ALA . 2.1 ptp -52.93 -177.47 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.157 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.48 -50.92 61.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.764 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 75.17 -57.8 0.59 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.311 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -46.26 154.77 0.25 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.326 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -74.83 174.11 9.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.922 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.486 HD12 ' CZ ' ' A' ' 15' ' ' PHE . 4.0 mm? -58.19 -45.99 86.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.473 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -69.71 -40.84 76.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.925 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -65.82 -22.63 66.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.547 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.422 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -77.45 -69.94 0.5 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.722 0.296 . . . . 0.0 110.921 -179.898 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 126.11 -19.83 6.39 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.684 -0.769 . . . . 0.0 112.671 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.983 HD22 HD11 ' A' ' 17' ' ' ILE . 0.1 OUTLIER -51.14 -53.11 37.58 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.851 0.358 . . . . 0.0 110.713 -179.916 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.808 HG22 ' CE2' ' A' ' 15' ' ' PHE . 11.6 p -58.06 -49.88 75.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.665 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -58.17 -27.15 63.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.456 179.483 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -163.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.578 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -99.71 82.22 2.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.792 0.33 . . . . 0.0 110.81 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.67 70.27 1.03 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.565 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -95.93 32.62 1.85 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.602 0.239 . . . . 0.0 111.164 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.487 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 0.7 OUTLIER -113.07 141.38 46.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.35 -179.891 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.503 HG21 ' CB ' ' A' ' 16' ' ' ARG . 0.1 OUTLIER -124.67 157.28 32.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.78 179.545 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.595 HD12 ' H ' ' A' ' 92' ' ' GLN . 0.3 OUTLIER -61.52 145.63 90.93 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.506 179.747 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -60.6 -23.38 75.54 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.599 2.199 . . . . 0.0 112.51 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -53.3 57.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.22 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.595 ' H ' HD12 ' A' ' 89' ' ' LEU . 6.1 mm-40 -57.71 -56.34 23.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.28 -179.656 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -50.18 -53.35 28.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.806 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.36 -20.45 62.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.525 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.403 ' HB2' ' HA ' ' A' ' 92' ' ' GLN . 0.4 OUTLIER -60.59 -50.01 75.23 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 109.541 -0.541 . . . . 0.0 109.541 179.089 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.432 ' HB ' ' HE1' ' A' ' 50' ' ' MET . 15.0 mm -72.38 -35.41 51.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.579 179.206 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.439 ' CH2' ' HG ' ' A' ' 60' ' ' LEU . 12.7 t-105 -52.58 -41.93 64.05 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.125 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -85.99 -26.46 25.43 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.655 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.17 -53.24 60.45 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.449 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 70.9 m -86.85 -87.16 0.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.341 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -167.23 48.64 0.25 Allowed Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.543 -0.837 . . . . 0.0 112.683 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.452 ' HA2' ' CD2' ' A' ' 60' ' ' LEU . . . -69.37 -39.56 80.87 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.565 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.79 HD12 HD22 ' A' ' 127' ' ' LEU . 16.7 mm -70.08 -44.95 77.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.799 0.333 . . . . 0.0 111.288 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.03 -49.21 78.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.813 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 94.0 t80 -59.5 -50.45 73.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.053 0.454 . . . . 0.0 110.407 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.771 HD21 HG21 ' A' ' 62' ' ' VAL . 0.2 OUTLIER -57.29 -46.53 83.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.393 179.508 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.408 ' HG2' HD23 ' A' ' 124' ' ' LEU . 2.8 mm-40 -59.67 -29.82 68.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.663 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 15.1 m -67.11 -50.32 61.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.777 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.543 ' HB1' ' HG3' ' A' ' 65' ' ' LYS . . . -70.32 -33.78 71.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.564 0.697 . . . . 0.0 109.436 178.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.553 ' CG1' HG22 ' A' ' 121' ' ' THR . 9.5 mt -56.31 -48.73 79.25 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.258 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -72.0 -32.56 67.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.245 179.303 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.46 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 0.3 OUTLIER -74.71 -9.28 58.41 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.062 179.491 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ARG . . . . . 0.46 ' HB2' ' O ' ' A' ' 112' ' ' SER . 15.7 mmm180 69.66 31.37 3.63 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.966 0.413 . . . . 0.0 110.998 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' GLN . . . . . 0.406 ' HB3' ' CG ' ' A' ' 65' ' ' LYS . 11.2 mt-30 -108.9 -29.97 8.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.555 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.51 ' HB1' ' CG2' ' A' ' 121' ' ' THR . . . -71.38 102.15 2.56 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.866 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.907 ' O ' HG22 ' A' ' 118' ' ' THR . 39.2 mtt85 -58.04 109.78 2.06 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.191 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' PRO . . . . . 0.6 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 75.6 Cg_exo -50.5 89.82 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.676 2.25 . . . . 0.0 112.187 179.467 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.907 HG22 ' O ' ' A' ' 116' ' ' ARG . 1.5 t -141.58 81.77 1.79 Allowed 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.834 0.349 . . . . 0.0 111.822 -179.553 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.48 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 7.8 t80 65.13 -64.34 0.17 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 179.003 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.401 ' N ' ' O ' ' A' ' 118' ' ' THR . . . -53.54 -52.22 60.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.921 0.391 . . . . 0.0 111.397 -179.184 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.6 ' OG1' ' HA ' ' A' ' 117' ' ' PRO . 0.6 OUTLIER -65.26 -46.58 79.95 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.677 179.669 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.85 -56.27 21.24 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.387 0.613 . . . . 0.0 110.256 179.372 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' MET . . . . . 0.828 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -53.69 -33.66 56.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.335 179.17 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.492 HD13 ' CG ' ' A' ' 106' ' ' LEU . 0.1 OUTLIER -63.72 -49.04 74.64 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.15 0.5 . . . . 0.0 109.818 178.997 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 40.7 mm-40 -50.79 -40.2 54.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.909 178.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -79.3 -32.0 43.38 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.068 178.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.828 HD13 ' CE ' ' A' ' 123' ' ' MET . 0.3 OUTLIER -59.31 -21.43 59.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.118 178.922 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.472 ' O ' HD12 ' A' ' 128' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--N 1.332 -0.173 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.952 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.431 ' HD2' ' HA2' ' A' ' 43' ' ' GLY . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.207 0 CA-C-O 120.683 0.278 . . . . 0.0 111.023 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -44.76 147.4 0.63 Allowed 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.951 0.405 . . . . 0.0 111.705 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.436 ' HB3' ' HE2' ' A' ' 40' ' ' HIS . 74.2 mm-40 -118.91 112.64 19.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.952 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.594 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 1.1 mtp180 -115.4 132.36 56.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.006 0.432 . . . . 0.0 110.767 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.498 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 1.3 m-85 -115.59 135.21 54.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.399 -179.617 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.601 ' HB3' HD12 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -136.76 154.17 50.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.289 0.566 . . . . 0.0 112.007 -178.759 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.477 ' HD2' ' CE2' ' A' ' 38' ' ' TYR . 0.6 OUTLIER -149.21 147.16 28.08 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.767 179.872 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.746 HD13 HD13 ' A' ' 80' ' ' LEU . 0.4 OUTLIER -153.28 127.63 4.58 Favored Pre-proline 0 C--O 1.233 0.213 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.781 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.411 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 66.2 Cg_endo -91.87 114.83 0.37 Allowed 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 123.222 2.614 . . . . 0.0 111.573 179.17 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.7 p90 -131.31 142.95 50.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.955 0.407 . . . . 0.0 111.573 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.716 HD13 ' HE3' ' A' ' 32' ' ' LYS . 23.4 mt -88.03 134.2 28.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.801 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -56.21 122.84 51.29 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.571 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.467 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 84.5 Cg_exo -44.5 -46.82 11.73 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.568 2.178 . . . . 0.0 112.787 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.529 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -54.74 -58.24 8.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.109 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.541 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 7.0 m-20 -67.96 -29.39 68.43 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.853 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.67 -55.04 25.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.273 -179.677 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.529 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.1 p90 -94.03 -14.31 25.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.91 -179.353 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.541 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 3.3 mtpt -62.98 -50.95 68.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.797 0.332 . . . . 0.0 110.768 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 179.07 144.53 0.34 Allowed Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.347 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.44 ' HA ' ' HG2' ' A' ' 32' ' ' LYS . 71.9 Cg_endo -73.55 -2.29 11.94 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.756 2.304 . . . . 0.0 112.824 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.38 -46.55 8.65 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.026 0.441 . . . . 0.0 110.575 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -95.33 33.55 1.56 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.195 179.15 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.716 ' HE3' HD13 ' A' ' 20' ' ' ILE . 2.8 mmtt -45.83 -76.59 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.518 -179.729 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 61.83 93.87 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.727 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.641 ' NZ ' HD11 ' A' ' 20' ' ' ILE . 1.2 ttmt -91.06 138.28 31.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.375 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -107.66 134.63 12.31 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.269 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.42 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 11.4 m-90 -98.61 134.58 41.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.879 0.371 . . . . 0.0 110.82 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.411 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 26.2 t90 -113.39 117.27 31.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.06 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.787 ' CE1' HD12 ' A' ' 52' ' ' LEU . 53.2 m-85 -116.28 142.74 46.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.053 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.718 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -164.97 124.22 1.8 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.279 0.561 . . . . 0.0 111.883 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.507 ' HB3' ' HG3' ' A' ' 48' ' ' ARG . 5.5 t-160 -90.81 95.75 10.29 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.341 -0.845 . . . . 0.0 108.733 178.403 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.629 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 7.7 m-85 -76.98 158.57 30.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.544 -178.437 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.609 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 3.5 t70 -126.32 115.09 19.14 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.431 ' HA2' ' HD2' ' A' ' 10' ' ' ARG . . . 57.65 -135.61 51.55 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 119.804 -1.189 . . . . 0.0 111.124 -178.452 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_exo -71.7 -18.26 28.86 Favored 'Trans proline' 0 CA--C 1.53 0.289 0 C-N-CA 122.53 2.154 . . . . 0.0 112.278 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' TRP . . . . . 0.402 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.7 OUTLIER -116.15 -159.34 0.72 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.391 -178.83 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.837 HD11 ' O ' ' A' ' 48' ' ' ARG . 4.7 tt -131.62 157.73 43.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 CA-C-O 121.304 0.573 . . . . 0.0 112.255 -179.287 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.446 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -112.45 -37.3 5.0 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.013 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.837 ' O ' HD11 ' A' ' 46' ' ' ILE . 0.1 OUTLIER -146.38 160.32 42.2 Favored 'General case' 0 CA--C 1.523 -0.084 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.964 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.508 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 9.1 tt0 -149.9 150.55 32.06 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.158 0.504 . . . . 0.0 111.646 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.418 ' HE1' ' N ' ' A' ' 97' ' ' TRP . 3.3 ttm -138.85 122.51 17.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.134 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.402 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 4.3 mt-10 -111.44 139.75 46.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.043 0.449 . . . . 0.0 111.583 -179.302 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.787 HD12 ' CE1' ' A' ' 38' ' ' TYR . 0.7 OUTLIER -135.08 101.77 4.98 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.364 179.652 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -116.68 138.05 24.21 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.096 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -52.06 -26.6 26.19 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.662 2.241 . . . . 0.0 112.331 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -98.89 -25.04 14.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.968 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.613 ' CB ' HD11 ' A' ' 59' ' ' ILE . 0.1 OUTLIER -117.06 118.98 35.53 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.774 -179.807 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.403 ' O ' ' N ' ' A' ' 59' ' ' ILE . 73.1 Cg_exo -48.72 177.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.405 2.07 . . . . 0.0 112.261 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -56.75 82.4 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.536 2.157 . . . . 0.0 112.345 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.613 HD11 ' CB ' ' A' ' 56' ' ' LYS . 5.8 mt -65.01 107.05 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.861 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.654 HD23 ' HB2' ' A' ' 105' ' ' TYR . 0.3 OUTLIER -83.28 136.96 34.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.893 -179.93 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.813 HD21 ' HB3' ' A' ' 69' ' ' GLU . 0.2 OUTLIER -132.68 145.79 51.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.024 -179.804 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.928 HG21 HD21 ' A' ' 106' ' ' LEU . 12.0 p -150.37 131.91 5.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.982 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.67 164.7 1.02 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.414 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.79 -70.71 1.15 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.407 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.473 ' HG3' ' HB1' ' A' ' 109' ' ' ALA . 0.0 OUTLIER -64.62 -55.67 18.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.948 0.404 . . . . 0.0 110.788 179.868 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.446 ' CB ' HD13 ' A' ' 61' ' ' LEU . 66.6 m-20 -99.13 59.33 1.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.864 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -69.04 -23.97 64.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.203 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 7.1 mmt -85.25 -37.87 19.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.994 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.813 ' HB3' HD21 ' A' ' 61' ' ' LEU . 6.0 mt-10 -81.69 -36.59 28.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.202 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.418 ' N ' HD11 ' A' ' 61' ' ' LEU . 63.4 tpp -52.11 158.62 1.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.18 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 5.4 t -49.1 -58.7 4.51 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.105 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 66.03 19.36 11.19 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.216 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.61 ' HB2' HG23 ' A' ' 78' ' ' THR . 15.6 mmtt -123.69 131.67 53.66 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.782 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -58.64 166.4 1.85 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.41 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.438 HD23 ' HA ' ' A' ' 75' ' ' LEU . 12.2 mt -58.8 -53.11 62.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.682 0.277 . . . . 0.0 111.432 -179.458 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -62.87 -31.93 73.07 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.275 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -77.82 -36.67 49.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.322 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.61 HG23 ' HB2' ' A' ' 73' ' ' LYS . 0.7 OUTLIER -62.8 -73.27 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.118 -179.808 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 140.23 -6.6 2.81 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.532 -0.842 . . . . 0.0 113.101 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.746 HD13 HD13 ' A' ' 17' ' ' ILE . 2.6 mm? -63.12 -38.15 90.02 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.249 0.547 . . . . 0.0 110.161 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 69.0 p -87.56 -28.52 21.91 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.978 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.04 -36.11 82.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.612 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.624 ' HD3' ' HB2' ' A' ' 86' ' ' ALA . 0.3 OUTLIER -80.24 -164.61 0.71 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.753 179.824 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -109.86 112.88 25.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.911 0.386 . . . . 0.0 111.302 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.82 82.6 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.954 -0.641 . . . . 0.0 113.227 179.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -118.63 15.19 13.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.718 0.294 . . . . 0.0 111.163 179.397 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.423 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 14.6 mt-10 -87.02 166.4 15.07 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.895 0.378 . . . . 0.0 111.286 -179.769 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.472 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 0.8 OUTLIER -146.98 168.11 5.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.008 179.688 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.867 HD12 ' HB2' ' A' ' 91' ' ' ARG . 0.8 OUTLIER -90.01 140.82 27.61 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.742 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.13 -16.47 54.62 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.632 2.221 . . . . 0.0 112.649 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.867 ' HB2' HD12 ' A' ' 89' ' ' LEU . 0.6 OUTLIER -71.76 -54.06 11.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.205 -179.817 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.435 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 0.0 OUTLIER -66.95 -39.83 87.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.972 -179.803 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -58.5 -53.21 60.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.477 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.75 -19.32 62.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.411 179.321 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.435 ' HB2' ' HA ' ' A' ' 92' ' ' GLN . 0.1 OUTLIER -61.82 -50.18 73.35 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.117 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.404 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 14.0 mm -72.23 -37.76 60.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.405 179.11 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.441 ' O ' ' N ' ' A' ' 102' ' ' GLY . 41.2 t-105 -52.88 -42.15 65.01 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.152 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -85.72 -21.9 28.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.699 179.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.404 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 4.9 tpt180 -58.24 -54.07 51.1 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.356 -179.698 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 41.6 t -86.12 -83.01 0.19 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.29 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.577 ' C ' HD21 ' A' ' 60' ' ' LEU . . . -165.84 31.45 0.22 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.601 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.532 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -52.64 -48.06 56.73 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.65 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.731 ' HA ' HD11 ' A' ' 124' ' ' LEU . 24.2 mm -66.29 -43.13 91.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.742 0.306 . . . . 0.0 111.056 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.86 -39.43 74.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.97 0.415 . . . . 0.0 110.552 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.654 ' HB2' HD23 ' A' ' 60' ' ' LEU . 17.7 t80 -64.2 -53.48 48.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.637 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.928 HD21 HG21 ' A' ' 62' ' ' VAL . 1.5 mt -61.59 -37.66 84.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.632 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.519 ' HG2' HD21 ' A' ' 124' ' ' LEU . 0.3 OUTLIER -64.36 -31.05 72.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.702 179.757 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 14.7 m -70.14 -50.33 41.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.642 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.473 ' HB1' ' HG3' ' A' ' 65' ' ' LYS . . . -72.06 -31.91 66.57 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.246 0.546 . . . . 0.0 109.729 179.063 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.595 ' CD1' HD22 ' A' ' 124' ' ' LEU . 4.6 mt -56.89 -47.14 83.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.247 179.007 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -69.59 -39.31 77.35 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.436 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.57 -14.1 62.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.111 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ARG . . . . . 0.401 ' NH1' ' HB3' ' A' ' 113' ' ' ARG . 3.6 mmm180 72.45 29.47 2.11 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.817 0.341 . . . . 0.0 111.004 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -111.81 -21.32 11.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.05 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.403 ' HA ' ' HB2' ' A' ' 65' ' ' LYS . . . -56.68 -26.36 56.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.443 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 56.7 mtt180 60.74 96.56 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.631 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -47.11 92.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.592 2.195 . . . . 0.0 112.566 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 23.8 m -106.24 -59.54 1.77 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.59 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -165.59 -56.26 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.151 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.406 ' CB ' HD11 ' A' ' 106' ' ' LEU . . . -53.8 -40.85 66.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.191 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.623 HG22 HD22 ' A' ' 106' ' ' LEU . 6.6 p -60.79 -40.68 93.5 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.164 179.628 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -63.99 -54.26 37.17 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.42 0.628 . . . . 0.0 109.424 178.426 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' MET . . . . . 0.561 ' CE ' HD13 ' A' ' 127' ' ' LEU . 2.5 tmm? -56.35 -33.63 65.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.662 178.527 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.781 HD13 ' HB3' ' A' ' 106' ' ' LEU . 1.2 tt -67.55 -44.81 77.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.04 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.693 ' HA ' HD12 ' A' ' 128' ' ' LEU . 46.3 mm-40 -52.88 -38.73 61.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.014 179.296 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 49.9 m-20 -80.99 -34.28 33.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.345 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.561 HD13 ' CE ' ' A' ' 123' ' ' MET . 1.7 tp -68.98 -11.25 60.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.823 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.693 HD12 ' HA ' ' A' ' 125' ' ' GLN . 14.5 mt . . . . . 0 C--O 1.231 0.121 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.224 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.6 ttm-85 . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.936 0.398 . . . . 0.0 111.01 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 63.67 133.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.108 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.422 ' HG3' ' CZ ' ' A' ' 119' ' ' TYR . 90.6 mm-40 -125.0 102.82 7.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.69 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.477 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 18.3 mtp180 -117.53 129.35 55.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.159 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.504 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 1.3 m-85 -113.46 134.64 54.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.982 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.828 ' HB2' HD22 ' A' ' 80' ' ' LEU . 2.2 m-85 -134.67 153.49 51.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.215 0.531 . . . . 0.0 112.019 -178.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.466 ' HB3' ' CG2' ' A' ' 88' ' ' ILE . 0.6 OUTLIER -149.17 146.11 27.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.803 179.486 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.507 HG12 HD23 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -143.06 122.31 7.56 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 120.656 0.265 . . . . 0.0 111.359 -179.589 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.463 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 74.3 Cg_endo -88.44 89.49 0.47 Allowed 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.938 2.425 . . . . 0.0 112.354 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 29.1 p90 -109.15 144.78 36.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.819 0.342 . . . . 0.0 110.878 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.814 HG23 ' O ' ' A' ' 33' ' ' LYS . 4.8 mt -90.77 144.96 8.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.045 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.409 ' O ' ' CG ' ' A' ' 25' ' ' GLN . 7.5 mtt180 -70.12 134.4 87.41 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.503 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.583 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 85.3 Cg_exo -41.26 -60.81 0.58 Allowed 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.949 2.432 . . . . 0.0 113.19 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.698 ' HB1' ' HD2' ' A' ' 27' ' ' LYS . . . -46.22 -53.89 9.77 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.899 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.546 ' HB3' ' HA ' ' A' ' 32' ' ' LYS . 1.4 m-20 -60.34 -36.79 78.79 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.651 -0.704 . . . . 0.0 112.072 -178.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.583 ' HG3' ' HA ' ' A' ' 22' ' ' PRO . 1.3 mt-30 -56.92 -57.59 11.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.723 -179.147 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.645 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.8 p90 -86.36 -3.03 58.92 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.71 -179.403 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.698 ' HD2' ' HB1' ' A' ' 23' ' ' ALA . 0.4 OUTLIER -76.85 -43.69 35.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.865 0.364 . . . . 0.0 110.424 179.353 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.434 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 3.4 t70 -168.39 148.69 4.29 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.121 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 2.8 Cg_exo -73.44 -30.38 10.14 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.758 2.305 . . . . 0.0 111.781 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -94.6 -41.97 9.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.802 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -87.35 53.59 2.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.642 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.546 ' HA ' ' HB3' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -122.34 62.09 0.97 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.859 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.814 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -43.02 148.7 0.24 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.313 -179.921 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.92 117.65 34.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.332 -179.44 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -85.39 124.34 6.75 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.793 -0.718 . . . . 0.0 111.948 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.463 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 24.2 m-90 -97.88 131.31 44.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.038 0.447 . . . . 0.0 111.258 -179.518 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.697 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 33.2 t90 -116.2 117.15 29.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.636 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.737 ' CE1' HD12 ' A' ' 52' ' ' LEU . 11.7 m-85 -110.11 152.08 26.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.622 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.511 ' HB3' ' HE1' ' A' ' 41' ' ' PHE . . . -170.3 124.26 0.72 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.013 0.435 . . . . 0.0 111.319 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.504 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 14.1 t-160 -97.11 101.0 12.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.75 179.349 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.631 ' CE2' HG21 ' A' ' 78' ' ' THR . 7.7 m-85 -87.96 123.38 32.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.495 -179.263 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.459 ' OD2' ' HB3' ' A' ' 47' ' ' ALA . 38.3 m-20 -95.87 121.45 37.62 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 56.09 -137.77 46.36 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 119.944 -1.122 . . . . 0.0 111.042 -178.689 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.404 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 7.2 Cg_exo -73.33 -16.06 24.93 Favored 'Trans proline' 0 CA--C 1.531 0.355 0 C-N-CA 122.38 2.053 . . . . 0.0 112.28 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' TRP . . . . . 0.405 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -117.26 -170.25 1.81 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.943 0.401 . . . . 0.0 111.89 -178.434 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.638 HD11 ' O ' ' A' ' 48' ' ' ARG . 3.9 tt -128.28 154.65 39.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.878 -179.334 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.459 ' HB3' ' OD2' ' A' ' 42' ' ' ASP . . . -131.97 -19.37 2.58 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.132 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.638 ' O ' HD11 ' A' ' 46' ' ' ILE . 5.9 mtm180 -130.27 142.65 50.54 Favored 'General case' 0 C--N 1.337 0.054 0 CA-C-O 120.85 0.357 . . . . 0.0 111.039 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.604 HE22 ' HE1' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -147.38 132.88 18.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.207 -179.76 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.403 ' HB3' ' HB2' ' A' ' 38' ' ' TYR . 14.1 ttp -133.4 120.71 21.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.331 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.552 ' HB3' HD12 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -105.24 135.0 47.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.267 -179.648 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.737 HD12 ' CE1' ' A' ' 38' ' ' TYR . 54.7 mt -135.15 101.88 5.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.71 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.413 ' HB2' ' HB2' ' A' ' 56' ' ' LYS . 0.4 OUTLIER -120.75 155.4 57.19 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.015 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.16 -30.03 81.53 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.757 2.305 . . . . 0.0 112.457 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -109.82 9.67 24.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.478 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.54 ' HB3' HD11 ' A' ' 59' ' ' ILE . 0.9 OUTLIER -142.3 113.12 6.16 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.792 179.895 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -50.92 -179.9 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.432 2.088 . . . . 0.0 112.336 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.25 82.69 0.07 OUTLIER 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.665 2.244 . . . . 0.0 112.488 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.552 HD12 ' HB3' ' A' ' 51' ' ' GLU . 7.1 mt -64.8 98.48 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.991 0.424 . . . . 0.0 110.709 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.567 HD21 ' N ' ' A' ' 102' ' ' GLY . 0.2 OUTLIER -76.1 112.69 12.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.773 -179.74 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.792 HD21 ' HB3' ' A' ' 69' ' ' GLU . 0.9 OUTLIER -115.74 152.6 32.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.847 -179.719 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.677 HG21 HD21 ' A' ' 106' ' ' LEU . 12.1 p -158.79 146.47 7.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.048 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.22 162.03 2.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.026 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.401 ' CA ' ' HD3' ' A' ' 116' ' ' ARG . . . 75.09 -65.75 2.26 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.065 -179.623 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.3 -36.4 66.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.034 0.445 . . . . 0.0 110.342 179.489 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -119.49 54.83 0.98 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.505 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.44 -34.22 77.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.203 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 36.5 mmm -85.71 -38.94 17.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.881 0.372 . . . . 0.0 110.777 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.792 ' HB3' HD21 ' A' ' 61' ' ' LEU . 0.3 OUTLIER -72.58 -44.9 61.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.976 -179.804 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.416 ' HG3' ' HG3' ' A' ' 49' ' ' GLN . 21.3 ttm -52.32 163.51 0.4 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.927 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.484 ' SG ' HG22 ' A' ' 78' ' ' THR . 1.8 t -46.7 -55.07 8.36 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.208 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.425 ' CB ' ' O ' ' A' ' 71' ' ' CYS . 2.7 tt0 84.04 -21.89 0.24 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.786 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.47 -179.69 5.87 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.922 0.391 . . . . 0.0 111.163 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -99.26 -171.58 2.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.463 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.558 HD11 ' HB2' ' A' ' 41' ' ' PHE . 3.6 mm? -67.3 -49.99 61.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.568 -179.441 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.27 -41.72 73.08 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.854 0.359 . . . . 0.0 111.338 -179.394 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -61.81 -38.4 88.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.684 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.631 HG21 ' CE2' ' A' ' 41' ' ' PHE . 1.0 OUTLIER -59.82 -72.42 0.11 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.146 -179.643 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 132.88 -19.4 4.42 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.551 -179.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.828 HD22 ' HB2' ' A' ' 15' ' ' PHE . 1.5 mp -52.79 -42.83 65.4 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.032 0.444 . . . . 0.0 110.765 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 28.3 p -71.2 -39.63 71.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.649 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -60.87 -30.41 70.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.557 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.6 mtpp -60.11 -177.11 0.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.691 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.54 68.88 2.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.767 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.56 64.55 1.68 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.638 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -92.6 26.25 2.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.709 0.29 . . . . 0.0 111.233 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.99 155.65 16.65 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.85 0.357 . . . . 0.0 110.928 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.466 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 1.0 OUTLIER -133.56 178.69 5.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.072 179.818 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.593 HD23 ' H ' ' A' ' 89' ' ' LEU . 0.9 OUTLIER -93.75 158.45 36.51 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.828 179.821 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo -73.0 -35.81 4.98 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.736 2.291 . . . . 0.0 112.107 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.592 ' HB2' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -53.96 -54.26 41.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.223 -179.781 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.441 ' HG3' HD21 ' A' ' 89' ' ' LEU . 0.5 OUTLIER -64.3 -45.87 86.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.18 -179.78 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -55.33 -53.25 58.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.014 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -72.6 -20.22 61.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.679 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.408 ' HB2' ' HA ' ' A' ' 92' ' ' GLN . 1.3 tm-20 -59.93 -49.63 76.93 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.468 HG21 HD11 ' A' ' 52' ' ' LEU . 16.7 mm -73.76 -35.06 42.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.366 179.023 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.449 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 5.8 t-105 -54.65 -39.7 68.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.991 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.63 -25.59 26.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.531 179.272 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.8 -53.7 54.8 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.085 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 52.3 t -83.96 -76.65 0.29 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.026 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 175.01 39.0 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.598 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.567 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -58.9 -62.22 6.48 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.429 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.619 ' H ' HD12 ' A' ' 103' ' ' ILE . 3.7 mp -52.93 -38.37 28.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.784 0.326 . . . . 0.0 111.258 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -66.96 -40.13 87.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.982 0.42 . . . . 0.0 110.515 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -69.72 -41.55 75.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.496 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.719 HD12 HD11 ' A' ' 110' ' ' ILE . 0.3 OUTLIER -68.22 -50.31 54.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.876 179.888 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -29.68 70.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.037 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 4.0 m -68.52 -50.51 51.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.793 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.518 ' HB1' ' HB2' ' A' ' 114' ' ' GLN . . . -71.29 -35.1 71.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.645 0.736 . . . . 0.0 109.389 178.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.719 HD11 HD12 ' A' ' 106' ' ' LEU . 15.9 mt -56.24 -45.23 81.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.534 179.13 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -70.34 -41.16 73.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.031 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.501 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 21.6 p -76.55 -4.63 43.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.424 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ARG . . . . . 0.501 ' HB2' ' O ' ' A' ' 112' ' ' SER . 24.2 mmm180 75.38 24.12 1.43 Allowed 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.79 0.329 . . . . 0.0 111.332 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' GLN . . . . . 0.518 ' HB2' ' HB1' ' A' ' 109' ' ' ALA . 0.0 OUTLIER -90.38 -24.19 20.87 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.386 179.082 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -102.11 107.7 18.87 Favored 'General case' 0 N--CA 1.456 -0.136 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.873 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.648 ' HG3' HG23 ' A' ' 118' ' ' THR . 0.2 OUTLIER -56.17 135.15 74.92 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.937 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_exo -52.42 84.95 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.596 2.197 . . . . 0.0 112.517 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.648 HG23 ' HG3' ' A' ' 116' ' ' ARG . 3.6 p -107.62 -176.59 3.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.413 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.422 ' CZ ' ' HG3' ' A' ' 12' ' ' GLN . 40.2 t80 -59.17 -36.35 75.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.87 0.367 . . . . 0.0 110.77 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.482 ' HB2' ' HE ' ' A' ' 48' ' ' ARG . . . -69.15 -52.08 31.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.116 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.595 ' HA ' HD11 ' A' ' 110' ' ' ILE . 60.5 p -58.63 -49.28 78.09 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.835 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.97 -48.54 79.69 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.244 0.545 . . . . 0.0 109.826 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' MET . . . . . 0.621 ' HE1' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -62.14 -33.37 74.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.883 178.785 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.509 HD21 ' O ' ' A' ' 103' ' ' ILE . 0.1 OUTLIER -63.97 -50.26 69.28 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.168 179.2 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.408 ' HA ' HD12 ' A' ' 128' ' ' LEU . 28.7 mm100 -52.92 -42.57 65.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.359 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -79.06 -29.84 43.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.638 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.621 HD13 ' HE1' ' A' ' 123' ' ' MET . 1.3 tt -76.73 -7.02 54.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.647 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.408 HD12 ' HA ' ' A' ' 125' ' ' GLN . 20.3 mt . . . . . 0 C--N 1.332 -0.163 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.896 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 18.6 mtt180 . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.781 0.324 . . . . 0.0 111.029 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.2 134.14 42.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.943 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 89.7 mm-40 -119.1 102.68 8.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.941 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.498 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -122.34 143.23 49.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.787 179.868 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.543 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 0.7 OUTLIER -124.34 134.74 53.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.709 -179.621 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.498 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 0.2 OUTLIER -143.56 155.53 44.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.236 0.541 . . . . 0.0 111.881 -179.695 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.854 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.6 153.4 37.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.897 178.71 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.634 HG21 ' CD ' ' A' ' 83' ' ' LYS . 0.1 OUTLIER -148.79 133.09 8.82 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.757 0.313 . . . . 0.0 111.535 -179.776 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.428 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 70.7 Cg_endo -91.97 120.25 0.54 Allowed 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.183 2.589 . . . . 0.0 111.777 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.7 p90 -144.59 155.99 43.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.99 0.424 . . . . 0.0 111.154 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.513 HG23 ' O ' ' A' ' 33' ' ' LYS . 2.2 mt -108.9 150.53 11.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.812 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -69.23 123.22 87.82 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.25 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.635 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 67.2 Cg_exo -40.0 -50.79 3.3 Favored 'Trans proline' 0 C--O 1.239 0.554 0 C-N-CA 122.952 2.435 . . . . 0.0 112.996 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.683 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -47.6 -59.09 3.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.879 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.492 ' HA ' ' HG2' ' A' ' 27' ' ' LYS . 0.8 OUTLIER -62.63 -33.59 75.33 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.505 -0.77 . . . . 0.0 112.833 -178.831 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.635 ' HG3' ' HA ' ' A' ' 22' ' ' PRO . 0.5 OUTLIER -55.89 -53.89 51.28 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -178.314 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.683 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.9 p90 -88.88 -40.72 12.91 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -178.016 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.545 ' HG2' ' O ' ' A' ' 23' ' ' ALA . 11.0 ptmt -58.34 -36.26 73.17 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 -178.633 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -156.91 116.67 2.06 Favored Pre-proline 0 C--N 1.33 -0.28 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.893 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.27 -7.01 19.85 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.617 2.212 . . . . 0.0 112.366 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -95.8 -36.14 11.26 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.947 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -88.99 46.02 1.35 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.441 178.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.431 ' HD3' ' HA ' ' A' ' 25' ' ' GLN . 3.9 mmtp -78.86 59.65 2.64 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.948 -179.272 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.513 ' O ' HG23 ' A' ' 20' ' ' ILE . 12.2 mmtm -53.8 100.7 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.025 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.92 121.35 31.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.949 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -113.66 144.48 18.18 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.727 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.451 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 11.2 m-90 -106.21 132.73 51.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.843 0.354 . . . . 0.0 110.745 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.513 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 22.4 t90 -115.05 117.56 30.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.222 -179.427 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.833 ' CE1' HD12 ' A' ' 52' ' ' LEU . 0.4 OUTLIER -117.24 152.28 35.16 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.32 179.146 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.61 ' HB3' ' HE1' ' A' ' 41' ' ' PHE . . . -170.58 130.29 0.86 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.203 0.525 . . . . 0.0 111.807 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.575 ' HB3' ' HG3' ' A' ' 48' ' ' ARG . 8.4 t-160 -96.68 103.68 15.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.496 -0.775 . . . . 0.0 108.997 178.616 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.759 ' CE2' HG21 ' A' ' 78' ' ' THR . 7.1 m-85 -90.3 127.42 36.16 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.589 -179.043 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.428 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 1.1 m-20 -93.88 113.36 25.36 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 178.706 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 57.48 -136.51 50.6 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.025 -1.084 . . . . 0.0 110.959 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -71.17 -19.2 29.89 Favored 'Trans proline' 0 N--CA 1.465 -0.192 0 C-N-CA 122.385 2.056 . . . . 0.0 112.08 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' TRP . . . . . 0.404 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -111.4 -174.0 2.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.505 -178.864 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.675 HG21 ' SG ' ' A' ' 71' ' ' CYS . 1.4 tt -121.44 149.33 24.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.172 0.51 . . . . 0.0 112.198 -179.401 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.415 ' N ' HG13 ' A' ' 46' ' ' ILE . . . -105.42 -40.33 5.84 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.832 -179.433 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.575 ' HG3' ' HB3' ' A' ' 40' ' ' HIS . 1.6 ptp180 -149.58 153.24 36.8 Favored 'General case' 0 CA--C 1.523 -0.084 0 C-N-CA 120.542 -0.463 . . . . 0.0 111.512 -179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.71 ' OE1' HD12 ' A' ' 61' ' ' LEU . 6.7 tt0 -148.23 156.11 42.17 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.896 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.782 ' HE1' HD11 ' A' ' 52' ' ' LEU . 22.8 ptm -142.61 122.64 13.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.297 179.523 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.477 ' O ' ' HA ' ' A' ' 58' ' ' PRO . 0.0 OUTLIER -98.78 126.51 44.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.324 -179.405 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.833 HD12 ' CE1' ' A' ' 38' ' ' TYR . 20.4 mt -128.21 112.05 14.09 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.752 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -140.02 134.63 15.87 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.2 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -50.99 -26.19 17.95 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.399 2.066 . . . . 0.0 112.234 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -96.68 -28.76 14.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.949 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.44 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 5.5 mttp -116.26 121.68 33.23 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.79 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.44 ' HD2' ' HA ' ' A' ' 56' ' ' LYS . 9.5 Cg_endo -50.94 169.63 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.341 2.028 . . . . 0.0 112.111 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.477 ' HA ' ' O ' ' A' ' 51' ' ' GLU . 19.2 Cg_endo -60.84 78.54 0.07 OUTLIER 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.536 2.157 . . . . 0.0 112.477 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 11.8 mt -65.46 89.96 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 121.075 0.464 . . . . 0.0 110.7 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.504 HD13 ' HA2' ' A' ' 102' ' ' GLY . 7.2 mt -68.68 113.72 6.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.558 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.932 HD21 ' HB3' ' A' ' 69' ' ' GLU . 5.7 mt -101.96 155.72 17.98 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.399 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.588 HG13 ' O ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -164.52 140.08 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.867 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.12 161.2 7.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.928 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.403 ' HA3' ' HB2' ' A' ' 116' ' ' ARG . . . 79.39 -69.86 2.92 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.84 -179.581 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -45.12 73.12 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.043 0.449 . . . . 0.0 110.426 179.561 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.479 ' OD2' HD23 ' A' ' 61' ' ' LEU . 21.9 m-20 -114.35 52.64 0.83 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.569 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -62.46 -38.22 88.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.107 -179.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 75.7 mmm -85.64 -31.08 22.75 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.949 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.932 ' HB3' HD21 ' A' ' 61' ' ' LEU . 0.3 OUTLIER -75.52 -36.54 60.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.049 -179.754 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.86 ' HA ' HD13 ' A' ' 61' ' ' LEU . 0.2 OUTLIER -47.42 172.45 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.244 179.861 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.675 ' SG ' HG21 ' A' ' 46' ' ' ILE . 21.5 p -45.88 -41.55 11.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.181 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.424 ' CB ' ' O ' ' A' ' 71' ' ' CYS . 10.5 tt0 82.19 -13.78 0.83 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.84 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.88 -176.41 3.05 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.908 0.385 . . . . 0.0 110.864 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -106.4 174.07 6.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.463 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.496 HD11 ' CZ ' ' A' ' 15' ' ' PHE . 32.4 tp -56.21 -44.21 79.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.461 -179.604 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -70.96 -46.18 62.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.714 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.48 -28.88 65.33 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -178.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.759 HG21 ' CE2' ' A' ' 41' ' ' PHE . 0.9 OUTLIER -56.49 -67.28 0.32 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.736 0.303 . . . . 0.0 111.243 -179.589 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 131.46 -20.28 4.69 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.876 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.582 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 6.7 mt -53.22 -29.91 34.95 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.977 0.418 . . . . 0.0 110.822 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 11.2 p -86.24 -43.36 13.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.737 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.53 -30.18 69.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.703 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.634 ' CD ' HG21 ' A' ' 17' ' ' ILE . 43.6 mttt -67.45 -177.25 0.69 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.978 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 20.5 mmt85 -81.62 73.75 8.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.1 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.92 65.05 3.81 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.65 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.582 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -76.82 -5.35 47.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.573 0.225 . . . . 0.0 111.501 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -55.03 150.03 11.02 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.973 0.416 . . . . 0.0 111.147 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.854 HG21 ' HB3' ' A' ' 16' ' ' ARG . 9.8 pt -136.46 169.45 20.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.135 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.893 HD12 ' HB2' ' A' ' 91' ' ' ARG . 1.0 OUTLIER -82.58 146.17 52.79 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.757 179.789 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -67.34 -24.78 42.92 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.557 2.171 . . . . 0.0 112.534 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.893 ' HB2' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -60.35 -54.1 49.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.992 -179.926 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.414 ' HG3' HD21 ' A' ' 89' ' ' LEU . 5.9 mm-40 -58.61 -49.0 79.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.006 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -55.66 -53.32 58.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.714 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.83 -21.82 65.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.791 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.74 -50.59 68.48 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.059 0.457 . . . . 0.0 109.862 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.405 ' HB ' ' CE ' ' A' ' 50' ' ' MET . 18.8 mm -77.85 -34.48 19.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.71 179.376 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.56 ' HZ2' HD12 ' A' ' 106' ' ' LEU . 28.0 t-105 -52.59 -40.68 62.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.909 179.421 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -86.12 -30.91 22.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.425 179.089 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -57.34 -54.23 49.19 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.424 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 73.7 m -74.69 -75.85 0.15 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.162 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.418 ' C ' HD13 ' A' ' 60' ' ' LEU . . . 171.25 38.32 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.619 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.504 ' HA2' HD13 ' A' ' 60' ' ' LEU . . . -69.21 -41.7 78.61 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.342 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.583 HG23 ' HG ' ' A' ' 124' ' ' LEU . 37.1 mm -65.15 -44.08 95.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.757 0.313 . . . . 0.0 110.824 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -49.09 78.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.328 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.421 ' CE2' ' CG2' ' A' ' 62' ' ' VAL . 2.2 t80 -62.6 -37.89 88.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.065 179.36 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.68 HD13 ' CD1' ' A' ' 124' ' ' LEU . 0.1 OUTLIER -69.1 -35.72 76.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.442 179.462 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.91 -33.24 75.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.306 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 2.6 m -68.78 -49.92 54.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.3 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.418 ' HB3' ' HB2' ' A' ' 115' ' ' ALA . . . -69.07 -34.79 75.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.398 0.618 . . . . 0.0 109.772 179.008 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.727 HD11 ' HA ' ' A' ' 121' ' ' THR . 2.6 mt -56.94 -47.13 83.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.61 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -72.15 -33.1 67.47 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.562 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 10.0 t -77.57 -8.94 58.6 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.23 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 112' ' ' SER . 74.1 mmt-85 68.81 26.83 5.9 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 120.907 0.384 . . . . 0.0 111.105 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -108.92 -21.9 12.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.774 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.418 ' HB2' ' HB3' ' A' ' 109' ' ' ALA . . . -56.81 -22.62 37.64 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.365 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.549 ' HG2' HG23 ' A' ' 118' ' ' THR . 2.2 ttt180 68.49 81.83 0.2 Allowed Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.835 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' PRO . . . . . 0.482 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 68.7 Cg_exo -51.85 89.42 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.654 2.236 . . . . 0.0 112.489 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.549 HG23 ' HG2' ' A' ' 116' ' ' ARG . 71.5 p -117.9 -36.64 3.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.889 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 12.0 t80 -176.3 -49.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.126 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -55.02 -52.14 64.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.215 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.727 ' HA ' HD11 ' A' ' 110' ' ' ILE . 70.5 p -59.58 -45.21 92.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.629 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.94 -55.48 30.18 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 121.662 0.744 . . . . 0.0 109.627 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' MET . . . . . 0.467 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -57.58 -32.75 67.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.784 178.492 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.68 ' CD1' HD13 ' A' ' 106' ' ' LEU . 0.1 OUTLIER -67.82 -41.98 82.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.079 178.724 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.466 ' HA ' HD12 ' A' ' 128' ' ' LEU . 29.0 mm100 -52.66 -44.53 66.25 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.329 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ASN . . . . . 0.432 ' OD1' ' HA ' ' A' ' 123' ' ' MET . 0.9 OUTLIER -81.08 -27.73 35.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.66 179.465 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.467 HD13 ' CE ' ' A' ' 123' ' ' MET . 1.0 OUTLIER -64.82 -19.26 65.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.851 0.358 . . . . 0.0 110.344 178.958 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.466 HD12 ' HA ' ' A' ' 125' ' ' GLN . 17.8 mt . . . . . 0 C--N 1.333 -0.144 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.241 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.833 0.349 . . . . 0.0 111.003 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.84 153.36 17.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.023 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.437 ' HG2' ' CZ ' ' A' ' 119' ' ' TYR . 13.5 mp0 -122.1 102.94 8.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.888 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.503 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -108.99 136.99 47.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.007 0.432 . . . . 0.0 110.833 -179.822 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.508 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 0.4 OUTLIER -119.55 138.87 52.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.189 -179.701 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.826 ' HB2' HD13 ' A' ' 80' ' ' LEU . 5.5 m-85 -142.3 152.15 42.69 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.463 0.649 . . . . 0.0 112.685 -178.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.493 ' HA ' ' O ' ' A' ' 37' ' ' TRP . 8.2 ttp180 -149.59 147.41 28.11 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 114.836 -1.074 . . . . 0.0 109.59 179.14 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.671 HD13 HD23 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -153.4 129.53 5.35 Favored Pre-proline 0 C--N 1.331 -0.235 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.455 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 52.8 Cg_endo -91.88 117.57 0.45 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 123.23 2.62 . . . . 0.0 111.621 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -135.76 160.03 39.81 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.12 0.486 . . . . 0.0 111.558 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.605 HG12 ' HD3' ' A' ' 34' ' ' LYS . 1.9 mt -102.18 147.24 9.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.186 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.9 mtp180 -75.25 141.51 74.03 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.118 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.476 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 11.5 Cg_endo -55.13 -52.36 8.07 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.584 2.189 . . . . 0.0 112.702 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.568 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -53.46 -58.83 5.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.377 -179.551 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.559 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 20.2 m-20 -67.09 -30.7 70.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.109 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.59 -56.54 14.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.469 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.568 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.3 p90 -91.39 -16.85 26.74 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.659 -179.483 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.559 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 0.6 OUTLIER -59.51 -45.16 92.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.794 0.331 . . . . 0.0 110.784 179.668 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -168.11 133.18 1.51 Allowed Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.267 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -67.43 -13.49 39.38 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.57 2.18 . . . . 0.0 112.271 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -98.1 -34.29 10.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.383 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -98.54 26.63 5.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.823 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.464 ' HB3' HG21 ' A' ' 20' ' ' ILE . 40.9 mttt -57.98 -67.18 0.37 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.457 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.1 mmmm 60.06 116.4 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.925 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.605 ' HD3' HG12 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -108.38 143.49 37.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.002 0.429 . . . . 0.0 110.964 179.788 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -95.45 139.01 14.27 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.21 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.483 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 12.8 m-90 -97.68 111.08 23.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.112 0.482 . . . . 0.0 110.495 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.575 ' HZ3' HD11 ' A' ' 80' ' ' LEU . 12.1 t90 -95.7 117.5 30.63 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.551 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.805 ' CE1' HD12 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -117.86 144.8 45.08 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.153 179.001 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.692 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.32 124.5 0.72 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.122 0.487 . . . . 0.0 111.696 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.503 ' HB3' ' HG3' ' A' ' 48' ' ' ARG . 8.8 t-160 -92.64 104.34 16.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.341 178.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.645 ' CE2' HG21 ' A' ' 78' ' ' THR . 3.5 m-85 -86.86 153.02 21.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.179 0.514 . . . . 0.0 111.658 -178.89 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.453 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 28.1 p-10 -123.19 114.06 19.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.073 178.714 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 59.23 -135.49 51.61 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 119.892 -1.147 . . . . 0.0 111.151 -178.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.402 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 7.6 Cg_exo -72.7 -17.61 25.92 Favored 'Trans proline' 0 N--CA 1.464 -0.227 0 C-N-CA 122.506 2.137 . . . . 0.0 112.469 179.541 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' TRP . . . . . 0.421 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.7 OUTLIER -116.02 -165.91 1.09 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.514 -178.584 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.82 HD11 ' O ' ' A' ' 48' ' ' ARG . 2.4 tt -128.1 151.87 35.47 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-O 121.122 0.487 . . . . 0.0 111.927 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -103.03 -40.78 6.34 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.531 -0.758 . . . . 0.0 111.816 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.82 ' O ' HD11 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -144.85 154.28 42.49 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 120.7 -0.4 . . . . 0.0 111.396 -179.535 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.412 ' OE1' ' CZ2' ' A' ' 37' ' ' TRP . 7.9 tt0 -141.13 141.73 34.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.362 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.418 ' SD ' HD11 ' A' ' 52' ' ' LEU . 5.3 ttm -135.99 111.64 9.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.178 179.412 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.489 ' HB3' ' HB ' ' A' ' 59' ' ' ILE . 4.5 tt0 -102.82 137.41 41.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.892 0.377 . . . . 0.0 111.523 -179.451 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.805 HD12 ' CE1' ' A' ' 38' ' ' TYR . 3.2 mt -133.79 124.78 27.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.8 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.421 ' CD2' ' HG2' ' A' ' 51' ' ' GLU . 25.6 m-70 -139.33 134.61 16.61 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.537 -0.302 . . . . 0.0 111.1 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -50.64 -25.71 15.45 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.54 2.16 . . . . 0.0 112.245 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -99.53 -27.37 13.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.006 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -114.47 118.99 40.8 Favored Pre-proline 0 C--O 1.234 0.262 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.826 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -49.7 177.37 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.565 2.177 . . . . 0.0 112.559 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -58.67 85.74 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.699 2.266 . . . . 0.0 112.216 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.489 ' HB ' ' HB3' ' A' ' 51' ' ' GLU . 44.4 mt -71.34 101.28 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.77 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.496 HD21 ' N ' ' A' ' 102' ' ' GLY . 1.1 mp -78.66 144.66 35.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.096 -179.687 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.804 HD13 ' HA ' ' A' ' 70' ' ' MET . 84.5 mt -146.21 151.17 37.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.966 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.5 p -156.48 149.88 10.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.987 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.69 140.47 58.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.209 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.56 -49.46 1.46 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.332 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.492 ' HD2' ' HB2' ' A' ' 109' ' ' ALA . 0.1 OUTLIER -88.08 -63.03 1.36 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.885 0.374 . . . . 0.0 110.727 179.809 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.779 ' HB3' HD22 ' A' ' 61' ' ' LEU . 18.6 m-20 -101.24 55.01 0.83 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.8 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.06 -27.26 63.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.971 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 50.0 mtp -84.77 -28.9 25.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.991 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -87.49 -42.08 13.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.09 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.804 ' HA ' HD13 ' A' ' 61' ' ' LEU . 4.8 ptm -57.25 -166.92 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.074 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.574 ' SG ' HG22 ' A' ' 78' ' ' THR . 17.0 t -81.52 104.5 11.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.087 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -73.77 -17.96 61.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.935 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -78.84 177.12 8.96 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.018 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.526 ' O ' HG23 ' A' ' 78' ' ' THR . 9.4 m120 -105.37 -173.59 2.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.857 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.696 HD11 HG21 ' A' ' 81' ' ' THR . 0.7 OUTLIER -54.72 -53.08 59.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.744 -179.462 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -71.58 -54.36 10.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.871 0.367 . . . . 0.0 111.787 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.03 -38.2 36.57 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.496 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.645 HG21 ' CE2' ' A' ' 41' ' ' PHE . 2.0 p -48.12 -61.56 1.92 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.777 0.322 . . . . 0.0 111.543 -179.245 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 125.15 -28.68 5.04 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.703 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.826 HD13 ' HB2' ' A' ' 15' ' ' PHE . 1.1 mt -49.05 -45.55 43.07 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.998 0.428 . . . . 0.0 110.737 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.696 HG21 HD11 ' A' ' 75' ' ' LEU . 0.6 OUTLIER -74.89 -32.26 61.8 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.46 179.695 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 5.9 mmm180 -61.74 -32.07 72.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.493 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.686 ' HD2' ' HB2' ' A' ' 86' ' ' ALA . 0.1 OUTLIER -86.3 -174.65 5.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.631 179.82 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 8.4 mpt_? -102.47 119.48 38.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.946 0.403 . . . . 0.0 111.123 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 60.65 85.25 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.749 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.686 ' HB2' ' HD2' ' A' ' 83' ' ' LYS . . . -130.92 19.79 5.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.639 0.257 . . . . 0.0 111.244 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.48 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 30.5 mt-10 -99.83 160.0 14.64 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.959 0.409 . . . . 0.0 111.239 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.468 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 0.8 OUTLIER -138.16 174.51 10.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.042 179.916 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.479 HD12 ' H ' ' A' ' 92' ' ' GLN . 0.4 OUTLIER -98.06 147.99 33.85 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.545 179.584 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -66.97 -22.98 47.43 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.483 2.122 . . . . 0.0 112.7 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -54.79 40.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.786 0.327 . . . . 0.0 111.082 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.479 ' H ' HD12 ' A' ' 89' ' ' LEU . 0.9 OUTLIER -70.51 -34.84 72.78 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.03 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.472 ' CE1' ' HD3' ' A' ' 48' ' ' ARG . 21.8 t80 -62.64 -53.23 57.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.482 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.81 -22.05 63.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.548 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.11 -50.82 71.67 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 179.157 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.564 HG21 HD11 ' A' ' 52' ' ' LEU . 17.5 mm -71.53 -35.93 58.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.259 178.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.436 ' CZ3' ' HG ' ' A' ' 60' ' ' LEU . 18.4 t-105 -53.45 -40.49 65.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.029 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -85.72 -23.93 27.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.816 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.427 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 7.4 mtt-85 -56.85 -54.1 50.28 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.053 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 43.1 t -81.51 -81.32 0.14 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.037 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -173.98 39.64 0.13 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.553 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.496 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -61.33 -55.23 30.36 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.634 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.453 HD12 HD22 ' A' ' 127' ' ' LEU . 10.1 mm -57.18 -42.95 80.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.769 0.318 . . . . 0.0 111.173 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -65.25 -49.28 70.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.681 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -60.57 -40.07 90.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.514 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.795 HD12 HD11 ' A' ' 110' ' ' ILE . 0.2 OUTLIER -70.38 -45.93 65.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.87 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.446 ' HG2' HD23 ' A' ' 124' ' ' LEU . 0.9 OUTLIER -61.88 -29.95 70.54 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.988 179.918 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 54.6 p -72.55 -50.32 26.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.805 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.492 ' HB2' ' HD2' ' A' ' 65' ' ' LYS . . . -68.93 -35.9 77.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.579 0.704 . . . . 0.0 109.161 178.833 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.795 HD11 HD12 ' A' ' 106' ' ' LEU . 13.6 mt -58.59 -44.3 89.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.912 178.772 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.96 -43.13 83.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.535 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 5.9 m -72.58 -10.09 59.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.246 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ARG . . . . . 0.435 ' HB2' ' O ' ' A' ' 112' ' ' SER . 16.3 mmt180 75.39 27.28 1.07 Allowed 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.909 0.385 . . . . 0.0 110.987 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -92.31 -28.67 16.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.384 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.511 ' HB1' ' CG2' ' A' ' 121' ' ' THR . . . -82.95 94.66 7.78 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.749 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.8 ptt180 -53.29 118.37 14.1 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.218 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -52.96 88.53 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.519 2.146 . . . . 0.0 112.124 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 5.2 t -110.2 -46.29 3.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.052 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.437 ' CZ ' ' HG2' ' A' ' 12' ' ' GLN . 9.8 t80 -177.36 -54.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.187 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.468 ' O ' ' HG3' ' A' ' 123' ' ' MET . . . -53.82 -40.31 66.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.863 0.363 . . . . 0.0 111.177 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.527 HG22 ' CD1' ' A' ' 106' ' ' LEU . 62.6 p -69.27 -43.74 73.29 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.481 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.57 -58.12 9.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.172 0.511 . . . . 0.0 110.239 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' MET . . . . . 0.612 ' HE2' ' N ' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -55.36 -29.93 59.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.046 179.119 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.612 ' N ' ' HE2' ' A' ' 123' ' ' MET . 0.1 OUTLIER -67.17 -48.94 66.46 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 121.022 0.439 . . . . 0.0 109.852 178.805 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.513 ' HA ' HD12 ' A' ' 128' ' ' LEU . 75.7 mm-40 -50.01 -39.62 41.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.796 179.188 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -80.09 -35.16 37.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.059 178.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.453 HD22 HD12 ' A' ' 103' ' ' ILE . 0.6 OUTLIER -57.81 -20.29 34.63 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.652 179.046 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.513 HD12 ' HA ' ' A' ' 125' ' ' GLN . 9.6 mt . . . . . 0 C--N 1.332 -0.181 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.141 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.784 0.326 . . . . 0.0 111.012 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -93.04 125.25 37.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.986 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.447 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 3.7 mp0 -111.96 102.8 11.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.974 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.538 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 2.9 mtt180 -113.92 126.8 55.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.977 0.418 . . . . 0.0 110.953 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.493 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 2.2 m-85 -109.0 134.99 50.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.884 179.715 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.819 ' CB ' HD22 ' A' ' 80' ' ' LEU . 2.6 m-85 -131.25 152.65 50.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.29 0.567 . . . . 0.0 112.335 -178.374 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.523 ' CB ' HG21 ' A' ' 88' ' ' ILE . 41.3 ttp85 -149.28 148.06 29.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.92 179.68 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.616 HG23 ' HB1' ' A' ' 86' ' ' ALA . 0.3 OUTLIER -152.08 121.73 3.45 Favored Pre-proline 0 C--N 1.329 -0.286 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.646 179.905 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -86.15 88.41 0.78 Allowed 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.93 2.42 . . . . 0.0 112.32 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.7 p90 -116.0 139.66 50.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.931 0.396 . . . . 0.0 111.02 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.735 HG23 ' O ' ' A' ' 33' ' ' LYS . 13.2 mt -86.85 142.58 12.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.927 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.8 110.22 2.35 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.118 179.369 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.499 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 76.4 Cg_exo -39.76 -51.84 2.83 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.795 2.33 . . . . 0.0 112.863 -179.393 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.545 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -50.07 -58.76 4.83 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.871 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.555 ' HA ' ' HG2' ' A' ' 27' ' ' LYS . 6.1 m-20 -67.07 -33.05 74.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.24 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.421 ' HB3' ' HA ' ' A' ' 22' ' ' PRO . 0.0 OUTLIER -52.07 -43.55 63.89 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.736 -178.904 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.545 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.7 p90 -104.59 -34.93 8.02 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -178.031 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.555 ' HG2' ' HA ' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -61.84 -32.31 72.63 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.664 -0.415 . . . . 0.0 111.601 -178.774 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.406 ' CB ' ' HB2' ' A' ' 31' ' ' ASN . 67.7 m-20 -150.2 120.32 3.83 Favored Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 120.844 -0.343 . . . . 0.0 111.523 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -72.67 -7.84 21.47 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.539 2.159 . . . . 0.0 112.321 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -109.81 -32.41 7.08 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.937 0.399 . . . . 0.0 110.394 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.406 ' HB2' ' CB ' ' A' ' 28' ' ' ASP . 84.2 m-20 -97.72 28.18 3.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.658 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.641 ' HB3' HG21 ' A' ' 20' ' ' ILE . 13.5 mttt -59.83 -59.05 6.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.918 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.735 ' O ' HG23 ' A' ' 20' ' ' ILE . 17.8 mmtt 70.54 113.78 0.05 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.599 -179.58 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.409 ' HD2' HG12 ' A' ' 20' ' ' ILE . 0.3 OUTLIER -83.01 110.86 18.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.489 -179.938 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.592 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -91.34 117.59 5.22 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.833 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 10.1 m-90 -97.84 126.24 43.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.853 0.359 . . . . 0.0 110.431 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.541 ' CZ3' HD11 ' A' ' 80' ' ' LEU . 11.2 t90 -113.65 119.87 38.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.614 -179.192 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.799 ' CE1' HD12 ' A' ' 52' ' ' LEU . 4.1 m-85 -115.96 150.46 37.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.941 178.918 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.535 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -170.45 123.75 0.68 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.161 0.505 . . . . 0.0 111.61 179.81 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.493 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 18.0 t-160 -93.17 98.28 11.19 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.451 178.736 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.669 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 20.4 m-85 -85.93 127.31 34.58 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.426 -179.146 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.551 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 25.0 p-10 -93.7 110.99 22.59 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 178.53 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 58.93 -134.53 52.44 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.053 -1.07 . . . . 0.0 111.122 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo -71.66 -19.64 27.62 Favored 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 122.489 2.126 . . . . 0.0 112.204 179.524 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' TRP . . . . . 0.423 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.6 OUTLIER -112.82 -170.11 1.61 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.274 -178.851 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.686 HD13 ' SG ' ' A' ' 71' ' ' CYS . 3.2 tt -127.35 151.69 34.49 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-O 121.263 0.554 . . . . 0.0 112.114 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -111.6 -32.64 6.61 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.917 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.47 ' CZ ' ' CE2' ' A' ' 93' ' ' PHE . 4.2 ptm180 -157.19 154.97 30.11 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.46 -179.678 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.679 ' HB3' HD11 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -161.55 159.02 27.26 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.242 179.801 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.467 ' HE1' ' HB ' ' A' ' 96' ' ' ILE . 11.3 ttp -134.46 154.84 51.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.852 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.464 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.2 OUTLIER -129.49 117.67 20.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.897 179.694 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.799 HD12 ' CE1' ' A' ' 38' ' ' TYR . 1.3 mt -120.35 106.18 11.62 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.876 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.592 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 1.1 m80 -127.54 134.12 25.84 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.698 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -51.94 -23.44 16.58 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.342 2.028 . . . . 0.0 112.262 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -100.34 -26.95 13.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.113 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.443 ' HB2' ' HB2' ' A' ' 53' ' ' HIS . 7.9 mttt -117.84 126.02 27.61 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.977 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -54.9 173.46 0.27 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.767 2.312 . . . . 0.0 112.463 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -60.25 88.02 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.714 2.276 . . . . 0.0 112.383 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.701 HG22 ' CD2' ' A' ' 61' ' ' LEU . 75.0 mt -70.4 100.57 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.799 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.44 ' HG ' ' CH2' ' A' ' 97' ' ' TRP . 0.3 OUTLIER -77.97 123.99 27.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.693 -179.966 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.701 ' CD2' HG22 ' A' ' 59' ' ' ILE . 2.8 mm? -121.02 139.55 53.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.25 -179.626 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.2 p -149.14 139.26 16.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.951 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.616 ' HB2' ' HE1' ' A' ' 70' ' ' MET . . . -59.16 155.95 13.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.988 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.416 ' HA3' ' HB2' ' A' ' 116' ' ' ARG . . . 85.76 -63.49 4.25 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.112 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.19 -67.93 0.6 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.997 0.427 . . . . 0.0 110.483 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.467 ' CB ' HD13 ' A' ' 61' ' ' LEU . 5.6 m-20 -97.11 47.16 1.04 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.404 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.463 ' HA ' ' HG2' ' A' ' 70' ' ' MET . 1.4 t0 -63.31 -25.35 68.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.438 -179.601 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -85.56 -35.73 20.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.753 0.311 . . . . 0.0 111.151 -179.696 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.536 ' CB ' HD11 ' A' ' 61' ' ' LEU . 1.1 mp0 -80.18 -36.22 35.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.256 -179.626 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.616 ' HE1' ' HB2' ' A' ' 63' ' ' ALA . 0.7 OUTLIER -56.0 -169.36 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.876 0.37 . . . . 0.0 111.146 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.686 ' SG ' HD13 ' A' ' 46' ' ' ILE . 3.5 m -68.19 -44.38 76.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.571 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 69.23 -64.65 0.33 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.101 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 11.0 mptt -54.3 178.91 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.113 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -94.67 -168.69 1.88 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.604 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.666 HD22 HG23 ' A' ' 81' ' ' THR . 7.8 mt -71.99 -53.38 13.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.386 -179.635 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -31.69 70.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.219 -179.63 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -80.5 -36.37 33.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.327 -179.554 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.642 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 1.0 OUTLIER -61.54 -80.06 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.051 -179.772 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 147.53 -16.43 1.45 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.507 -0.854 . . . . 0.0 113.038 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.819 HD22 ' CB ' ' A' ' 15' ' ' PHE . 5.3 mt -53.89 -35.24 61.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.905 0.383 . . . . 0.0 110.915 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.666 HG23 HD22 ' A' ' 75' ' ' LEU . 22.6 p -81.81 -39.92 23.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.594 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.5 mmm180 -63.97 -30.54 71.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.545 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -165.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.728 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -102.23 83.48 2.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.778 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.15 71.26 0.78 Allowed Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.336 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.616 ' HB1' HG23 ' A' ' 17' ' ' ILE . . . -98.17 34.42 1.96 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.666 0.269 . . . . 0.0 110.978 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -90.9 147.81 22.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.224 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.523 HG21 ' CB ' ' A' ' 16' ' ' ARG . 1.3 pt -139.09 179.46 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.057 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.605 HD12 ' CB ' ' A' ' 91' ' ' ARG . 0.4 OUTLIER -106.33 149.9 38.81 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.648 179.594 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -61.98 -30.7 83.67 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.506 2.137 . . . . 0.0 112.215 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.605 ' CB ' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -56.51 -54.0 50.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.351 -179.845 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -64.02 -53.84 43.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.418 -179.685 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.47 ' CE2' ' CZ ' ' A' ' 48' ' ' ARG . 6.2 t80 -52.65 -53.23 50.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.189 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.402 ' OE2' ' NH1' ' A' ' 48' ' ' ARG . 1.2 tt0 -66.58 -22.75 66.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.39 179.562 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.09 -50.36 73.56 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.161 0.505 . . . . 0.0 109.756 179.186 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.467 ' HB ' ' HE1' ' A' ' 50' ' ' MET . 17.0 mm -71.48 -34.5 53.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.662 179.362 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.467 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 25.5 t-105 -54.33 -38.14 65.67 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.031 179.27 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.644 ' HG3' HD13 ' A' ' 103' ' ' ILE . 1.4 tt0 -85.55 -27.85 25.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.659 179.335 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.3 mtp85 -56.82 -50.65 71.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.13 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 76.6 m -84.97 -80.79 0.2 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.153 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -178.99 37.55 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.614 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.467 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -59.66 -59.59 10.27 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.492 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.923 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.8 mp -52.8 -30.39 15.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.808 0.337 . . . . 0.0 111.477 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.83 -45.34 74.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.003 0.43 . . . . 0.0 110.578 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -68.23 -39.44 82.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.42 179.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.889 ' CD1' HD13 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -69.68 -50.97 38.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.03 -179.852 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -29.59 69.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.87 0.366 . . . . 0.0 110.789 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 6.1 m -69.01 -50.12 51.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.653 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.64 -32.73 68.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.507 0.67 . . . . 0.0 109.854 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.633 HD11 ' HA ' ' A' ' 121' ' ' THR . 9.3 mt -58.97 -48.48 86.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 114.869 -1.059 . . . . 0.0 110.584 179.428 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -70.57 -35.78 73.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.578 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.5 -15.39 62.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.055 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 9.5 mmm180 74.97 35.27 0.62 Allowed 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.876 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -108.67 -27.35 9.87 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.792 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.14 -172.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.149 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.416 ' HB2' ' HA3' ' A' ' 64' ' ' GLY . 3.2 ttt180 -129.66 93.7 34.11 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.906 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -50.41 89.47 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.532 2.155 . . . . 0.0 112.323 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 6.5 p -129.07 -51.97 1.21 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.878 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.447 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 13.4 t80 -165.56 -55.49 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.265 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.436 ' O ' ' HG3' ' A' ' 123' ' ' MET . . . -53.96 -42.61 69.1 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.273 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.633 ' HA ' HD11 ' A' ' 110' ' ' ILE . 10.2 p -66.6 -38.74 87.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.686 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -67.73 -58.41 4.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.145 0.498 . . . . 0.0 110.688 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' MET . . . . . 0.436 ' HG3' ' O ' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -53.04 -29.6 30.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.414 179.521 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.923 HD11 ' HA ' ' A' ' 103' ' ' ILE . 0.4 OUTLIER -66.39 -52.74 43.62 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.02 0.438 . . . . 0.0 109.944 178.961 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -49.87 -37.04 29.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.012 179.316 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -80.99 -34.19 33.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.227 179.124 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.06 -18.85 60.08 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.398 179.082 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.9 mt . . . . . 0 C--N 1.332 -0.158 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.88 179.974 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.527 0.093 0 CA-C-O 120.732 0.301 . . . . 0.0 110.93 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -82.42 158.14 23.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.015 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.445 ' HG2' ' CZ ' ' A' ' 119' ' ' TYR . 3.5 mp0 -122.02 103.45 8.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.907 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.514 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -110.79 130.0 55.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.948 0.404 . . . . 0.0 110.893 179.829 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.518 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 0.9 OUTLIER -115.27 135.15 54.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.307 -179.946 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.6 ' CE1' HD11 ' A' ' 75' ' ' LEU . 0.3 OUTLIER -140.4 153.57 46.38 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.365 0.602 . . . . 0.0 112.219 -179.713 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.675 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.58 143.0 25.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.393 179.112 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.55 HG23 ' HB1' ' A' ' 86' ' ' ALA . 0.3 OUTLIER -141.05 135.63 15.42 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 120.857 0.36 . . . . 0.0 111.919 -179.376 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.492 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 61.7 Cg_endo -92.07 103.28 0.21 Allowed 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 123.301 2.667 . . . . 0.0 112.296 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 15.1 p90 -123.31 148.79 45.6 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.937 0.398 . . . . 0.0 110.934 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.459 HG21 ' HB2' ' A' ' 32' ' ' LYS . 3.8 mt -94.3 149.25 4.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.016 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -71.86 131.13 86.01 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.678 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.575 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 77.6 Cg_exo -40.21 -60.16 0.62 Allowed 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.974 2.449 . . . . 0.0 113.138 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.635 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -45.85 -53.8 9.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.866 -179.596 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.466 ' HB3' ' HA ' ' A' ' 32' ' ' LYS . 4.3 m-20 -62.96 -34.49 77.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.257 -178.87 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.575 ' HG3' ' HA ' ' A' ' 22' ' ' PRO . 1.1 mt-30 -58.12 -57.49 12.59 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.703 0.287 . . . . 0.0 111.631 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.635 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.6 p90 -84.71 -7.5 59.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.641 -179.313 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.542 ' HD2' ' HB1' ' A' ' 23' ' ' ALA . 4.0 mtpp -74.1 -42.93 59.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.843 0.354 . . . . 0.0 110.56 179.409 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -173.07 139.0 0.85 Allowed Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.037 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.81 -21.54 33.11 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.6 2.2 . . . . 0.0 112.366 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -97.97 -31.72 12.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.715 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -100.25 42.63 1.1 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.778 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.466 ' HA ' ' HB3' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -102.26 60.44 0.84 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.508 179.703 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.411 ' HB3' ' HG2' ' A' ' 54' ' ' PRO . 13.9 mmtp -36.92 115.82 0.4 Allowed 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.679 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -85.22 134.04 34.16 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.207 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.452 ' HA2' ' HD3' ' A' ' 54' ' ' PRO . . . -120.93 138.58 12.76 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.648 -0.786 . . . . 0.0 112.531 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.492 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 29.3 m-90 -97.91 148.05 23.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.905 0.383 . . . . 0.0 110.82 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.441 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 86.4 t90 -130.93 117.36 19.14 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.909 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.891 ' CE1' HD12 ' A' ' 52' ' ' LEU . 2.2 m-85 -112.67 152.81 28.56 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.847 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.677 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.77 124.74 0.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.302 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.518 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 12.1 t-160 -93.92 101.74 13.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.151 179.336 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.758 ' CZ ' HG21 ' A' ' 78' ' ' THR . 11.0 m-85 -85.86 126.19 33.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.513 -179.51 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.469 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 4.2 m-20 -100.09 116.92 33.24 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 178.621 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 59.63 -140.09 48.18 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 119.986 -1.102 . . . . 0.0 111.014 -178.427 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -72.1 -12.68 28.25 Favored 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.489 2.126 . . . . 0.0 112.208 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' TRP . . . . . . . . . . . . . 1.2 m95 -118.22 -168.25 1.49 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.936 0.398 . . . . 0.0 111.95 -178.513 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.677 ' CD1' ' HB1' ' A' ' 39' ' ' ALA . 4.3 tt -134.73 156.12 39.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.576 -179.429 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.703 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -132.45 -28.32 1.67 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.123 -179.472 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.472 ' CB ' ' HB3' ' A' ' 40' ' ' HIS . 6.5 ttm180 -115.57 133.53 55.94 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.828 0.347 . . . . 0.0 111.107 -179.559 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.467 ' HB3' ' HB3' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -137.63 134.14 35.15 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.853 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 3.1 ttm -141.16 111.77 6.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.724 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.644 ' HB3' HD12 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -96.76 135.76 38.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.997 -179.74 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.891 HD12 ' CE1' ' A' ' 38' ' ' TYR . 38.3 mt -131.13 102.14 5.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.744 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -121.66 138.4 28.4 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.918 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.452 ' HD3' ' HA2' ' A' ' 35' ' ' GLY . 50.3 Cg_exo -54.44 -29.4 58.87 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.45 2.1 . . . . 0.0 112.388 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 37.2 p30 -95.75 -20.71 18.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.193 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.8 mttt -124.2 115.16 27.5 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.834 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -47.17 173.34 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.512 2.141 . . . . 0.0 112.451 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -54.53 88.5 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.489 2.126 . . . . 0.0 112.356 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.644 HD12 ' HB3' ' A' ' 51' ' ' GLU . 5.4 mt -65.77 104.6 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.906 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.629 ' HG ' ' HA2' ' A' ' 102' ' ' GLY . 0.0 OUTLIER -76.43 133.22 39.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.804 -179.995 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.971 HD21 ' HB3' ' A' ' 69' ' ' GLU . 0.7 OUTLIER -141.32 154.43 45.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.087 -179.928 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.5 p -157.63 144.09 9.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.826 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.703 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -55.68 151.63 10.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.855 0.359 . . . . 0.0 111.198 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.404 ' HA3' ' HB2' ' A' ' 116' ' ' ARG . . . 84.08 -63.3 4.46 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.217 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.95 -31.54 63.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.939 0.399 . . . . 0.0 110.573 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.426 ' CB ' ' HG ' ' A' ' 61' ' ' LEU . 9.3 m-20 -119.56 56.72 0.93 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.664 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.05 -32.22 73.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.071 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.57 -34.33 21.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.274 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.971 ' HB3' HD21 ' A' ' 61' ' ' LEU . 11.9 mp0 -81.15 -51.65 8.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.123 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.433 ' CE ' ' N ' ' A' ' 63' ' ' ALA . 28.0 tpp -38.36 152.1 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.415 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.42 ' O ' ' CB ' ' A' ' 72' ' ' GLU . 0.5 OUTLIER -42.04 -60.15 1.52 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.221 179.97 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.42 ' CB ' ' O ' ' A' ' 71' ' ' CYS . 0.0 OUTLIER 83.51 -21.79 0.26 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.934 179.647 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.5 ' O ' HG23 ' A' ' 78' ' ' THR . 0.7 OUTLIER -94.74 122.48 37.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.644 0.259 . . . . 0.0 110.834 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.411 ' N ' ' CG ' ' A' ' 77' ' ' GLU . 7.2 m120 -50.83 176.09 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.886 0.374 . . . . 0.0 111.053 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.89 HD12 HG23 ' A' ' 81' ' ' THR . 0.6 OUTLIER -50.65 -46.71 58.52 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.2 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.92 -56.31 12.4 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.537 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.422 ' HG3' ' CA ' ' A' ' 73' ' ' LYS . 1.1 pm0 -61.45 -18.08 57.34 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.581 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.758 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.3 OUTLIER -74.81 -63.62 1.21 Allowed 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.917 179.843 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 122.83 -12.85 8.67 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.586 -0.816 . . . . 0.0 113.101 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.9 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 3.4 mm? -54.13 -36.67 63.51 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.267 0.556 . . . . 0.0 110.387 179.778 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.89 HG23 HD12 ' A' ' 75' ' ' LEU . 45.9 p -83.94 -21.51 31.8 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.912 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 7.7 mtt180 -84.52 -11.89 55.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.592 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.624 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 0.3 OUTLIER -93.34 24.7 3.75 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.958 0.409 . . . . 0.0 111.34 -179.849 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.5 mmt85 37.73 93.94 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 77.64 46.53 9.66 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.764 -0.732 . . . . 0.0 113.585 178.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.9 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -101.82 16.6 25.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.79 0.295 . . . . 0.0 111.011 179.324 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.555 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -89.27 167.08 13.36 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.898 0.38 . . . . 0.0 111.353 -179.673 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.675 HG21 ' HB3' ' A' ' 16' ' ' ARG . 0.9 OUTLIER -143.45 -179.95 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.999 179.843 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.596 HD12 ' HB2' ' A' ' 91' ' ' ARG . 0.2 OUTLIER -101.76 155.77 36.01 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.743 179.742 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.29 -22.87 24.85 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.499 2.132 . . . . 0.0 112.404 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.596 ' HB2' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -57.91 -54.04 51.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.116 -179.847 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 10.0 mm100 -66.4 -38.28 87.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.903 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.452 ' CE1' ' HD2' ' A' ' 48' ' ' ARG . 15.3 t80 -58.28 -53.15 61.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.919 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.411 ' OE1' ' NH1' ' A' ' 48' ' ' ARG . 0.2 OUTLIER -70.13 -23.56 63.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.782 179.852 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.27 -50.95 72.03 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 179.04 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.4 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 20.5 mm -74.8 -30.79 24.89 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.954 178.695 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.436 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 24.2 t-105 -57.6 -36.4 71.7 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.737 178.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -85.41 -29.4 24.42 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.289 179.204 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.4 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 7.7 mtm180 -56.66 -52.97 62.87 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.108 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 42.6 t -83.5 -82.02 0.16 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.3 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -177.02 37.47 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.525 -0.845 . . . . 0.0 112.791 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.629 ' HA2' ' HG ' ' A' ' 60' ' ' LEU . . . -56.08 -64.39 4.43 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.416 179.691 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.935 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.7 mp -52.94 -33.54 19.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.974 0.416 . . . . 0.0 111.181 179.682 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -68.17 -45.42 73.53 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.514 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -68.03 -41.69 81.75 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.424 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.927 ' CD1' HD13 ' A' ' 124' ' ' LEU . 0.3 OUTLIER -66.91 -51.13 59.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.83 179.86 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.425 ' HA ' ' HB ' ' A' ' 110' ' ' ILE . 0.9 OUTLIER -60.39 -29.23 68.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.846 179.919 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 108' ' ' SER . . . . . 0.404 ' N ' ' HG3' ' A' ' 107' ' ' GLN . 12.3 t -68.23 -50.69 52.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.735 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.99 -33.94 70.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.5 0.667 . . . . 0.0 109.35 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.495 HD12 HD22 ' A' ' 124' ' ' LEU . 10.3 mt -56.61 -46.11 82.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.009 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -68.63 -37.7 79.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.147 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.446 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 5.2 t -72.27 -10.51 59.88 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.9 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 112' ' ' SER . 3.6 mpp_? 69.65 32.51 3.29 Favored 'General case' 0 C--O 1.23 0.079 0 CA-C-O 121.015 0.436 . . . . 0.0 111.097 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.5 mt-30 -106.3 -25.92 11.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.398 179.341 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -75.99 90.57 3.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.078 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.404 ' HB2' ' HA3' ' A' ' 64' ' ' GLY . 12.2 mtt180 -48.86 105.57 0.52 Allowed Pre-proline 0 C--N 1.331 -0.198 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.833 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' PRO . . . . . 0.411 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 50.0 Cg_exo -53.44 98.84 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.392 2.061 . . . . 0.0 112.566 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.438 HG21 ' HB2' ' A' ' 47' ' ' ALA . 79.5 m -112.63 -43.86 3.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.609 179.788 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.445 ' CZ ' ' HG2' ' A' ' 12' ' ' GLN . 14.8 t80 -178.23 -47.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.951 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.461 ' O ' ' HG3' ' A' ' 123' ' ' MET . . . -56.31 -39.21 72.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.265 -179.814 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.65 HG22 HD22 ' A' ' 106' ' ' LEU . 37.7 p -68.98 -37.26 78.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.506 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.96 -58.35 8.93 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.214 0.53 . . . . 0.0 110.332 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' MET . . . . . 0.564 ' HE1' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -58.17 -29.4 65.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.167 178.934 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.935 HD11 ' HA ' ' A' ' 103' ' ' ILE . 0.3 OUTLIER -70.28 -46.93 63.35 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.145 0.498 . . . . 0.0 109.875 178.982 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -50.73 -40.98 55.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.652 -0.703 . . . . 0.0 109.807 179.176 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 28.4 m-20 -76.1 -34.35 59.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.857 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.634 HD22 HG12 ' A' ' 103' ' ' ILE . 0.1 OUTLIER -60.14 -20.0 56.36 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.374 178.893 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.476 ' O ' HD12 ' A' ' 128' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--O 1.233 0.204 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.938 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.873 0.368 . . . . 0.0 110.997 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -81.59 137.28 35.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.995 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.445 ' HG3' ' CE2' ' A' ' 119' ' ' TYR . 33.7 mm-40 -100.72 102.74 13.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.751 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.572 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -110.27 124.75 52.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.031 -179.45 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.502 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 1.1 m-85 -110.77 152.91 26.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.473 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.777 ' HB2' HD22 ' A' ' 80' ' ' LEU . 4.4 m-85 -152.2 152.73 32.61 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.367 0.603 . . . . 0.0 112.178 -179.559 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.721 ' NH1' HD12 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -148.96 139.43 22.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.394 179.217 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.506 HG23 ' HB1' ' A' ' 86' ' ' ALA . 0.1 OUTLIER -142.25 125.72 9.6 Favored Pre-proline 0 C--N 1.329 -0.295 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.731 -179.319 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.501 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 67.9 Cg_endo -89.86 101.71 0.32 Allowed 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 123.065 2.51 . . . . 0.0 112.155 179.764 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.1 p90 -120.02 145.42 46.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.856 0.36 . . . . 0.0 110.912 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.481 HG12 ' HG3' ' A' ' 34' ' ' LYS . 3.0 mt -89.63 150.34 3.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.925 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.402 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 0.5 OUTLIER -72.15 126.65 91.1 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.719 179.963 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.596 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 70.3 Cg_exo -39.83 -60.33 0.57 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.043 2.495 . . . . 0.0 113.097 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.672 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -44.87 -52.71 8.33 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.837 -179.576 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.516 ' HB3' ' HA ' ' A' ' 32' ' ' LYS . 2.1 m-20 -65.62 -37.06 85.52 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.508 -178.829 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.596 ' HG3' ' HA ' ' A' ' 22' ' ' PRO . 4.0 mt-30 -54.91 -57.53 11.27 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -178.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.672 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.0 p90 -83.75 -16.75 43.6 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.706 -179.22 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.436 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -60.98 -47.1 88.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.755 0.312 . . . . 0.0 110.286 179.564 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 177.08 141.28 0.24 Allowed Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.124 179.378 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.42 -19.01 66.08 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.621 2.214 . . . . 0.0 112.289 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -86.34 -39.43 16.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.589 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -105.87 57.83 0.66 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.69 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.516 ' HA ' ' HB3' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -111.7 54.76 0.68 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.607 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.455 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.2 OUTLIER -41.58 138.46 1.35 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.549 -179.844 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.481 ' HG3' HG12 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -107.93 144.03 35.75 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.046 0.451 . . . . 0.0 111.862 -179.42 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -121.28 129.44 7.76 Favored Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.807 179.142 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.501 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 28.9 m-90 -98.08 133.99 41.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.013 0.435 . . . . 0.0 111.146 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.649 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 15.6 t90 -113.48 117.27 31.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.965 -179.537 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.686 ' CE1' HD12 ' A' ' 52' ' ' LEU . 10.9 m-85 -110.38 147.57 33.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.219 179.534 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.843 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -170.13 124.71 0.75 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.059 0.457 . . . . 0.0 111.992 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.504 ' HB3' ' CB ' ' A' ' 48' ' ' ARG . 12.7 t-160 -97.68 98.04 9.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.375 178.776 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.777 ' CZ ' HG21 ' A' ' 78' ' ' THR . 11.8 m-85 -85.32 119.34 25.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.715 -178.93 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.463 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 3.3 p-10 -91.21 114.8 27.43 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 178.451 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 57.69 -135.95 51.23 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 119.908 -1.139 . . . . 0.0 111.153 -178.349 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -72.62 -17.31 26.44 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 122.536 2.158 . . . . 0.0 112.444 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -115.36 -172.67 2.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.946 0.403 . . . . 0.0 111.8 -178.595 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.771 HD11 ' O ' ' A' ' 48' ' ' ARG . 2.8 tt -131.98 153.67 38.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.726 -179.567 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.409 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -127.24 -26.77 3.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.646 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.771 ' O ' HD11 ' A' ' 46' ' ' ILE . 2.1 ttp180 -117.5 136.77 53.0 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-O 120.817 0.341 . . . . 0.0 111.295 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.843 ' NE2' ' HB2' ' A' ' 39' ' ' ALA . 0.7 OUTLIER -145.12 132.48 20.65 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.887 179.967 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 2.5 ttm -143.48 129.45 19.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.677 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.482 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -114.11 140.71 48.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.165 -179.61 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.686 HD12 ' CE1' ' A' ' 38' ' ' TYR . 31.1 mt -135.29 108.53 7.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.811 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 -135.85 138.2 27.29 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.858 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.406 ' HG2' ' HB3' ' A' ' 33' ' ' LYS . 9.9 Cg_endo -52.8 -23.88 22.03 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.602 2.201 . . . . 0.0 112.254 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -96.18 -28.71 14.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.999 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 1.8 mtpp -118.3 122.14 30.51 Favored Pre-proline 0 C--O 1.233 0.229 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.844 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.36 -179.99 0.07 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.582 2.188 . . . . 0.0 112.237 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.417 ' O ' HD13 ' A' ' 60' ' ' LEU . 42.4 Cg_exo -56.75 85.08 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.545 2.163 . . . . 0.0 112.332 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.57 HG22 ' HG ' ' A' ' 61' ' ' LEU . 91.1 mt -65.42 98.06 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.8 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.469 HD21 ' N ' ' A' ' 102' ' ' GLY . 0.4 OUTLIER -82.2 112.83 19.58 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.703 -179.975 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.57 ' HG ' HG22 ' A' ' 59' ' ' ILE . 71.9 mt -123.6 148.24 46.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.071 0.462 . . . . 0.0 111.324 -179.64 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.641 HG12 ' HE2' ' A' ' 105' ' ' TYR . 13.4 p -149.43 150.66 13.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.787 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.417 ' HB1' ' HD3' ' A' ' 116' ' ' ARG . . . -58.38 145.81 36.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.846 0.355 . . . . 0.0 111.305 -179.698 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.409 ' HA3' ' HB2' ' A' ' 116' ' ' ARG . . . 87.92 -61.41 4.05 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.159 -179.743 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.542 ' NZ ' ' HB2' ' A' ' 109' ' ' ALA . 0.8 OUTLIER -72.23 -68.38 0.47 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.896 0.379 . . . . 0.0 110.603 179.735 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.427 ' HB3' HD22 ' A' ' 61' ' ' LEU . 0.7 OUTLIER -98.91 36.56 1.66 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.607 179.753 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.5 -21.28 36.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.284 -179.746 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 3.6 mpp? -82.13 -31.92 30.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.848 0.356 . . . . 0.0 110.659 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.449 ' HB3' HD13 ' A' ' 61' ' ' LEU . 1.9 mm-40 -84.69 -43.91 13.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.718 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.523 ' HE2' ' HB2' ' A' ' 49' ' ' GLN . 47.5 ttm -55.55 163.47 1.29 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.608 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.735 ' SG ' HG22 ' A' ' 78' ' ' THR . 0.5 OUTLIER -55.72 120.53 7.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.819 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -88.15 8.14 28.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.384 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.467 ' O ' HG23 ' A' ' 78' ' ' THR . 0.0 OUTLIER -117.4 144.71 44.69 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.901 179.884 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.456 ' O ' HG23 ' A' ' 78' ' ' THR . 8.7 m120 -65.59 -176.63 0.36 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.666 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.642 HD11 ' CZ ' ' A' ' 15' ' ' PHE . 28.1 tp -64.98 -43.83 91.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.407 -179.652 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.46 -31.87 69.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.066 -179.676 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -86.95 -26.03 24.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.666 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.777 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.7 OUTLIER -58.84 -76.44 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.771 0.32 . . . . 0.0 111.101 -179.762 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 140.27 -22.32 2.75 Favored Glycine 0 N--CA 1.453 -0.18 0 C-N-CA 120.51 -0.853 . . . . 0.0 113.005 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.777 HD22 ' HB2' ' A' ' 15' ' ' PHE . 1.0 OUTLIER -49.01 -42.8 39.26 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.89 0.376 . . . . 0.0 110.914 -179.908 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 45.7 p -71.75 -34.5 69.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.714 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -59.1 -33.47 70.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.6 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.96 179.69 0.5 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.915 179.719 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.9 mpp_? -93.91 73.34 4.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.572 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 78.63 66.62 1.7 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.232 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.591 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -93.31 24.94 3.59 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.689 0.281 . . . . 0.0 111.524 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.424 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 47.1 mt-10 -80.61 167.81 19.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.793 0.33 . . . . 0.0 110.889 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.721 HD12 ' NH1' ' A' ' 16' ' ' ARG . 2.4 tt -148.41 159.65 6.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.106 0.479 . . . . 0.0 110.86 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.472 ' N ' ' CG1' ' A' ' 88' ' ' ILE . 5.1 mp -78.54 145.15 66.86 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.877 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.76 -23.75 25.86 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.604 2.202 . . . . 0.0 112.441 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.15 -40.47 74.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.045 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -69.0 -45.88 69.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.911 0.386 . . . . 0.0 110.844 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.438 ' CE2' ' HB3' ' A' ' 38' ' ' TYR . 7.6 t80 -56.09 -53.13 60.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.609 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.411 ' OE2' ' NH1' ' A' ' 48' ' ' ARG . 0.0 OUTLIER -68.2 -23.34 64.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.675 179.689 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.21 -50.2 74.59 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 121.246 0.546 . . . . 0.0 109.55 179.086 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.452 HG21 HD11 ' A' ' 52' ' ' LEU . 17.5 mm -74.41 -35.26 38.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.384 179.114 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.44 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 9.7 t-105 -53.12 -40.14 63.97 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.953 179.246 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.645 ' HG3' HD13 ' A' ' 103' ' ' ILE . 10.2 tt0 -85.69 -26.97 25.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.748 179.225 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.84 -45.75 82.18 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.131 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 40.6 t -91.24 -79.22 0.37 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.039 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 179.18 36.95 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.686 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.469 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -59.9 -57.81 17.43 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.344 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.846 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.7 mp -53.03 -34.9 21.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.797 0.332 . . . . 0.0 111.233 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.04 -43.36 82.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.022 0.439 . . . . 0.0 110.29 179.492 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.641 ' HE2' HG12 ' A' ' 62' ' ' VAL . 92.7 t80 -67.97 -38.89 83.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.493 179.685 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.904 ' CD1' HD13 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -70.63 -50.85 32.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.856 179.96 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.419 ' HA ' ' HB ' ' A' ' 110' ' ' ILE . 0.9 OUTLIER -59.97 -29.48 68.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.811 -179.941 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 108' ' ' SER . . . . . 0.409 ' N ' ' HG3' ' A' ' 107' ' ' GLN . 37.1 p -69.86 -50.49 42.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.554 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.542 ' HB2' ' NZ ' ' A' ' 65' ' ' LYS . . . -71.54 -30.24 65.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.534 0.683 . . . . 0.0 109.516 178.89 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.744 HD11 HD22 ' A' ' 106' ' ' LEU . 15.9 mt -61.21 -49.33 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.229 179.075 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -66.07 -37.96 87.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.43 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 63.8 m -82.17 -4.94 58.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.959 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? 63.91 64.05 0.79 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.071 0.462 . . . . 0.0 111.07 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -151.59 25.09 0.68 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.52 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -104.89 -9.87 17.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.506 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.417 ' HD3' ' HB1' ' A' ' 63' ' ' ALA . 22.5 ttt180 65.13 86.33 0.14 Allowed Pre-proline 0 C--N 1.332 -0.167 0 CA-C-O 120.799 0.333 . . . . 0.0 110.919 -179.822 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -50.35 99.53 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.568 2.178 . . . . 0.0 112.164 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.41 -45.22 1.22 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.957 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.445 ' CE2' ' HG3' ' A' ' 12' ' ' GLN . 16.3 t80 -177.66 -52.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.952 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.539 ' HB1' HD11 ' A' ' 106' ' ' LEU . . . -53.94 -39.51 65.96 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.243 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.619 HG22 ' CD2' ' A' ' 106' ' ' LEU . 40.2 p -67.05 -40.89 87.24 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.857 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -66.33 -57.87 6.55 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.096 0.474 . . . . 0.0 110.684 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' MET . . . . . 0.583 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -53.1 -29.65 31.84 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.209 179.455 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.904 HD13 ' CD1' ' A' ' 106' ' ' LEU . 0.3 OUTLIER -69.66 -48.69 58.92 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 121.129 0.49 . . . . 0.0 110.03 178.821 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.443 ' HA ' HD12 ' A' ' 128' ' ' LEU . 17.0 mm100 -50.32 -36.27 31.23 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.065 179.285 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -83.21 -32.67 26.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.975 178.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.583 HD13 ' CE ' ' A' ' 123' ' ' MET . 0.2 OUTLIER -62.69 -17.56 60.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.453 179.138 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.443 HD12 ' HA ' ' A' ' 125' ' ' GLN . 12.1 mt . . . . . 0 C--N 1.333 -0.139 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.226 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.781 0.324 . . . . 0.0 110.895 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.1 mm100 -80.64 154.38 27.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.077 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.441 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 9.3 mp0 -113.48 107.61 16.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.789 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.501 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -108.15 127.62 53.98 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.902 0.382 . . . . 0.0 111.039 -179.642 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.507 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 1.4 m-85 -114.09 151.14 32.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.389 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.889 ' HB2' HD22 ' A' ' 80' ' ' LEU . 9.0 m-85 -150.24 157.72 43.39 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.185 0.517 . . . . 0.0 112.062 -179.318 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.643 ' CB ' HG21 ' A' ' 88' ' ' ILE . 34.3 ttp180 -149.21 149.66 31.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.835 179.28 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.525 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -151.47 115.77 3.1 Favored Pre-proline 0 C--N 1.33 -0.272 0 C-N-CA 121.066 -0.254 . . . . 0.0 111.284 -179.858 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.416 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 89.8 Cg_endo -82.85 85.24 1.62 Allowed 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.725 2.284 . . . . 0.0 112.301 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.444 ' CE2' ' HB2' ' A' ' 37' ' ' TRP . 9.0 p90 -103.91 140.47 37.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.998 0.427 . . . . 0.0 110.729 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.629 HG21 ' HB2' ' A' ' 32' ' ' LYS . 17.4 mt -91.47 141.5 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.2 -179.661 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.7 135.91 86.52 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.586 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.477 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 51.4 Cg_exo -54.52 -55.68 3.12 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.388 2.059 . . . . 0.0 112.949 -179.536 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.566 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -51.13 -54.96 20.37 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.71 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.538 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 40.7 m-20 -70.88 -31.04 67.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.158 -179.727 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -52.33 -57.11 10.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.65 -179.474 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.566 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.3 p90 -88.55 -19.14 26.75 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.594 -179.397 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.538 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 1.7 mtpp -56.04 -54.98 38.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.915 0.388 . . . . 0.0 110.801 179.744 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.8 p30 -167.27 144.79 3.92 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.327 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.404 ' HA ' ' HD2' ' A' ' 32' ' ' LYS . 70.6 Cg_endo -73.35 -4.42 15.39 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.709 2.272 . . . . 0.0 112.764 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -98.3 -40.58 8.26 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.856 0.36 . . . . 0.0 110.928 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -109.07 34.3 3.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.803 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.629 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -66.31 -33.22 75.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.08 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.56 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.9 OUTLIER 59.68 108.33 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.78 -179.795 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.418 ' N ' ' HG2' ' A' ' 54' ' ' PRO . 0.2 OUTLIER -88.82 112.93 23.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.565 -179.933 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.438 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -92.67 122.02 6.73 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.621 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.416 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 15.5 m-90 -98.62 121.0 40.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.871 0.367 . . . . 0.0 110.677 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.701 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 21.9 t90 -108.44 117.5 34.32 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.326 -179.429 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.92 ' CE1' HD12 ' A' ' 52' ' ' LEU . 14.2 m-85 -110.98 153.3 25.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.259 179.422 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.625 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -165.79 124.07 1.56 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.131 0.491 . . . . 0.0 111.681 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.507 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 11.7 t-160 -97.65 94.71 7.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.671 179.086 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.755 ' HZ ' HG21 ' A' ' 78' ' ' THR . 13.6 m-85 -78.03 149.19 34.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.472 -179.148 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.471 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 88.0 m-20 -122.64 110.83 16.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.14 178.656 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.47 -132.58 50.04 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.051 -1.071 . . . . 0.0 111.152 -178.424 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.408 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 5.7 Cg_exo -73.64 -18.19 22.62 Favored 'Trans proline' 0 N--CA 1.464 -0.261 0 C-N-CA 122.557 2.171 . . . . 0.0 112.505 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' TRP . . . . . 0.429 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.5 OUTLIER -117.51 -164.76 1.02 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.87 0.366 . . . . 0.0 111.769 -178.492 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.803 HD11 ' O ' ' A' ' 48' ' ' ARG . 3.3 tt -136.66 152.98 29.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.183 -179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.698 ' HB2' HG21 ' A' ' 118' ' ' THR . . . -125.28 -18.9 5.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.071 -179.607 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.803 ' O ' HD11 ' A' ' 46' ' ' ILE . 8.5 mtt180 -132.79 136.63 46.41 Favored 'General case' 0 N--CA 1.458 -0.07 0 CA-C-O 120.854 0.359 . . . . 0.0 111.406 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.449 ' HB3' ' HB3' ' A' ' 61' ' ' LEU . 0.8 OUTLIER -146.74 118.73 8.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.827 179.824 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.543 ' HE1' ' HB ' ' A' ' 96' ' ' ILE . 16.1 ttp -112.83 118.05 33.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.714 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.426 ' O ' ' HA ' ' A' ' 58' ' ' PRO . 8.8 mt-10 -101.52 118.39 36.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.381 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.92 HD12 ' CE1' ' A' ' 38' ' ' TYR . 13.8 mt -119.27 116.53 26.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.627 179.697 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.443 ' HB2' ' HB2' ' A' ' 56' ' ' LYS . 7.9 m-70 -129.94 130.94 23.2 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.63 0.253 . . . . 0.0 111.004 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.418 ' HG2' ' N ' ' A' ' 34' ' ' LYS . 58.8 Cg_exo -51.65 -24.62 17.98 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.399 2.066 . . . . 0.0 112.391 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.6 p-10 -104.15 -22.94 13.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.205 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.443 ' HB2' ' HB2' ' A' ' 53' ' ' HIS . 0.3 OUTLIER -119.66 127.87 26.19 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.63 -0.259 . . . . 0.0 110.946 179.828 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo -49.71 171.65 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.664 2.243 . . . . 0.0 112.451 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.426 ' HA ' ' O ' ' A' ' 51' ' ' GLU . 27.6 Cg_endo -62.68 77.61 0.11 Allowed 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.605 2.203 . . . . 0.0 112.354 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.403 ' HB ' ' HB2' ' A' ' 51' ' ' GLU . 6.7 mt -56.92 100.37 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 121.088 0.471 . . . . 0.0 110.765 179.733 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.519 HD21 ' HA2' ' A' ' 102' ' ' GLY . 0.4 OUTLIER -76.43 131.84 39.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.062 -179.694 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.688 HD21 ' HB3' ' A' ' 69' ' ' GLU . 0.3 OUTLIER -132.19 146.66 52.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.72 179.93 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.748 HG21 HD21 ' A' ' 106' ' ' LEU . 13.6 p -150.75 137.16 12.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.224 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.04 167.68 2.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.273 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.25 -66.52 0.72 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.521 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.46 ' HG3' ' HB1' ' A' ' 109' ' ' ALA . 0.1 OUTLIER -70.1 -66.49 0.59 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.925 0.393 . . . . 0.0 110.949 -179.929 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.507 ' HB3' HD13 ' A' ' 61' ' ' LEU . 16.4 t0 -101.59 56.4 0.83 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.945 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.18 -17.43 62.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.592 -179.77 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 2.4 mtm -77.09 -30.9 55.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.895 0.379 . . . . 0.0 110.748 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.688 ' HB3' HD21 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -98.6 -21.44 16.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.196 179.984 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.3 -176.48 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.169 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.677 ' SG ' HD13 ' A' ' 46' ' ' ILE . 8.1 m -63.61 -47.25 82.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.795 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 70.29 25.35 4.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.112 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.41 ' HB2' HG23 ' A' ' 78' ' ' THR . 0.0 OUTLIER -148.64 154.41 39.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.705 179.833 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -79.54 -170.97 2.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.397 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.866 HD11 ' CZ ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -59.21 -53.1 62.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.252 -179.713 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.75 -44.75 66.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.175 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -54.78 -33.0 60.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.58 -179.397 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.755 HG21 ' HZ ' ' A' ' 41' ' ' PHE . 0.8 OUTLIER -71.35 -69.3 0.39 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.065 -179.646 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 133.48 -19.65 4.24 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.863 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.889 HD22 ' HB2' ' A' ' 15' ' ' PHE . 1.3 mp -51.85 -34.32 40.14 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.85 0.357 . . . . 0.0 111.025 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.778 ' CG2' HD12 ' A' ' 75' ' ' LEU . 0.2 OUTLIER -77.14 -43.07 35.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.654 179.733 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.409 ' HB3' ' NH1' ' A' ' 82' ' ' ARG . 0.1 OUTLIER -60.06 -29.74 68.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.716 179.786 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -168.16 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.889 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.0 77.37 1.24 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.801 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 72.05 68.06 1.7 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.402 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.572 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -96.55 21.16 9.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.691 0.282 . . . . 0.0 111.267 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -86.1 150.18 24.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.924 0.392 . . . . 0.0 111.1 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.643 HG21 ' CB ' ' A' ' 16' ' ' ARG . 1.3 pt -133.67 -179.66 3.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.004 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.921 HD12 ' HB3' ' A' ' 91' ' ' ARG . 0.8 OUTLIER -96.32 141.5 23.22 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.707 179.753 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -66.12 -13.86 41.77 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.577 2.184 . . . . 0.0 112.688 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.921 ' HB3' HD12 ' A' ' 89' ' ' LEU . 2.7 tpm_? -73.39 -49.89 24.77 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.43 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.428 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 0.2 OUTLIER -65.26 -42.93 92.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.968 0.413 . . . . 0.0 110.675 179.824 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -56.54 -53.39 58.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.555 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.27 -19.74 62.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.464 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.428 ' HB2' ' HA ' ' A' ' 92' ' ' GLN . 0.5 OUTLIER -61.25 -50.42 73.14 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.162 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.569 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 19.0 mm -73.72 -33.84 39.27 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.445 179.033 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.446 ' CH2' ' HG ' ' A' ' 60' ' ' LEU . 10.0 t-105 -53.03 -39.45 63.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.242 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -85.89 -30.54 22.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.609 179.325 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.569 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -58.13 -52.12 66.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.23 -179.882 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 32.4 m -78.29 -71.1 0.45 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.089 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 163.38 40.5 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.638 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.519 ' HA2' HD21 ' A' ' 60' ' ' LEU . . . -60.35 -47.86 89.01 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.37 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.681 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.7 mp -56.55 -34.63 42.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.847 0.356 . . . . 0.0 111.426 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -67.84 -48.69 65.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.836 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -67.73 -41.14 83.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.715 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.789 HD12 HD11 ' A' ' 110' ' ' ILE . 0.2 OUTLIER -67.84 -50.63 55.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.945 179.954 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.41 ' HG3' ' N ' ' A' ' 108' ' ' SER . 0.9 OUTLIER -60.78 -29.54 69.5 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.78 179.801 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 108' ' ' SER . . . . . 0.41 ' N ' ' HG3' ' A' ' 107' ' ' GLN . 4.1 m -67.99 -50.81 53.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.604 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.516 ' HB1' ' HB2' ' A' ' 114' ' ' GLN . . . -71.43 -32.33 68.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.413 0.625 . . . . 0.0 109.732 179.021 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.789 HD11 HD12 ' A' ' 106' ' ' LEU . 5.0 mt -56.76 -49.16 79.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.406 179.073 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -69.42 -36.61 76.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.51 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 51.9 m -74.83 -9.29 58.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.282 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 70.86 39.81 1.01 Allowed 'General case' 0 N--CA 1.461 0.079 0 CA-C-O 120.901 0.381 . . . . 0.0 111.033 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 114' ' ' GLN . . . . . 0.516 ' HB2' ' HB1' ' A' ' 109' ' ' ALA . 13.6 mt-30 -111.74 -28.99 7.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.835 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.452 ' HB1' ' CG2' ' A' ' 121' ' ' THR . . . -58.01 -166.81 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.144 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.593 ' O ' HG22 ' A' ' 118' ' ' THR . 5.1 ttt180 -132.56 93.64 24.25 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.03 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -52.8 89.06 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.61 2.207 . . . . 0.0 112.116 179.771 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.698 HG21 ' HB2' ' A' ' 47' ' ' ALA . 4.6 t -132.88 -49.67 0.88 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.237 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.441 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 12.1 t80 -163.21 -62.28 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.889 0.376 . . . . 0.0 111.163 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.572 ' HB1' ' NE ' ' A' ' 48' ' ' ARG . . . -53.85 -38.47 64.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.445 -179.59 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.51 HG22 ' CG1' ' A' ' 110' ' ' ILE . 0.9 OUTLIER -67.38 -44.64 78.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.693 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.56 -58.11 8.72 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.156 0.503 . . . . 0.0 110.696 179.56 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' MET . . . . . 0.759 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -53.56 -29.98 39.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.485 179.512 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.681 HD11 ' HA ' ' A' ' 103' ' ' ILE . 0.2 OUTLIER -66.54 -50.59 62.64 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.037 0.446 . . . . 0.0 109.922 178.863 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.77 -37.52 30.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.74 179.19 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -82.73 -31.46 28.45 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.014 178.862 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.759 HD13 ' CE ' ' A' ' 123' ' ' MET . 0.4 OUTLIER -61.4 -18.81 60.54 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.514 179.21 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.689 ' O ' HD12 ' A' ' 128' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--N 1.333 -0.15 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.066 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.816 0.341 . . . . 0.0 111.069 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -78.97 117.06 19.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.868 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 94.8 mm-40 -84.94 102.66 13.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.899 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.536 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 1.5 mmp_? -119.82 144.0 47.57 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.849 0.357 . . . . 0.0 110.645 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.527 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 0.9 OUTLIER -123.98 134.85 53.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.346 -179.653 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.889 ' HB2' HD22 ' A' ' 80' ' ' LEU . 7.7 m-85 -135.36 152.59 51.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.337 0.589 . . . . 0.0 111.971 -179.012 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.539 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.4 142.62 25.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.691 179.15 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -145.88 127.27 7.53 Favored Pre-proline 0 C--N 1.328 -0.36 0 C-N-CA 120.709 -0.396 . . . . 0.0 111.983 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.415 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 60.7 Cg_endo -89.64 91.19 0.35 Allowed 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 123.176 2.584 . . . . 0.0 111.97 179.683 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.407 ' O ' ' CD1' ' A' ' 19' ' ' PHE . 27.1 p90 -111.27 133.96 53.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.983 0.421 . . . . 0.0 111.238 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.683 HG23 ' O ' ' A' ' 33' ' ' LYS . 17.2 mt -89.94 142.78 12.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.763 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 mtt180 -60.08 130.11 88.83 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.215 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.455 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 9.3 Cg_endo -52.75 -50.93 12.35 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.46 2.107 . . . . 0.0 112.497 -179.567 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.54 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -53.98 -58.33 7.7 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.334 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.59 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 10.3 m-20 -66.0 -33.49 75.92 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.97 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -50.66 -54.63 21.48 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.469 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.54 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.4 p90 -95.8 -12.38 25.41 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.841 -179.529 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.59 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 1.6 mtpp -62.17 -48.61 79.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.93 0.395 . . . . 0.0 110.566 179.704 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -160.95 140.91 8.19 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.155 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -73.19 -5.74 17.7 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.621 2.214 . . . . 0.0 112.592 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -108.17 -33.92 7.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.897 0.38 . . . . 0.0 110.605 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -97.82 30.17 3.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.763 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 15.6 mttt -65.43 -59.98 3.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.976 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.683 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.0 OUTLIER 62.83 121.44 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.519 -179.519 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.98 131.46 45.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.045 -179.315 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -103.88 121.64 7.11 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.187 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.432 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 8.0 m-90 -97.81 119.62 36.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.903 0.382 . . . . 0.0 110.758 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.597 ' HZ3' HD11 ' A' ' 80' ' ' LEU . 21.6 t90 -108.68 117.5 34.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.07 -179.633 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.873 ' CE1' HD12 ' A' ' 52' ' ' LEU . 4.5 m-85 -110.76 154.34 24.05 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.266 179.36 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.826 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.38 123.83 0.69 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.123 0.487 . . . . 0.0 111.554 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.507 ' CG ' ' CE2' ' A' ' 14' ' ' PHE . 9.0 t-160 -95.57 96.05 8.79 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 178.72 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.803 ' HZ ' HG21 ' A' ' 78' ' ' THR . 7.4 m-85 -75.12 159.49 31.59 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.255 0.55 . . . . 0.0 111.433 -178.955 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.54 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.6 OUTLIER -133.09 120.35 21.16 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.113 179.003 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 58.39 -137.43 50.09 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 119.881 -1.152 . . . . 0.0 110.96 -178.395 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.401 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.2 Cg_exo -73.34 -16.23 24.83 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.456 2.104 . . . . 0.0 112.21 179.331 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' TRP . . . . . 0.418 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.8 OUTLIER -119.24 -158.85 0.75 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.344 -178.56 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.826 ' CD1' ' HB1' ' A' ' 39' ' ' ALA . 5.6 tt -130.82 154.84 41.3 Favored 'Isoleucine or valine' 0 C--O 1.231 0.108 0 CA-C-O 121.059 0.457 . . . . 0.0 112.089 -179.439 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -112.29 -35.44 5.6 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.457 -179.224 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.568 ' O ' HD11 ' A' ' 46' ' ' ILE . 0.0 OUTLIER -150.85 158.25 43.91 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 120.255 -0.578 . . . . 0.0 111.781 -179.392 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.504 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 21.8 pt20 -161.17 159.25 28.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.407 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.479 ' HE3' ' N ' ' A' ' 97' ' ' TRP . 0.0 OUTLIER -134.24 122.7 23.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.436 179.46 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.463 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 2.1 mt-10 -90.09 115.71 27.56 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.838 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.873 HD12 ' CE1' ' A' ' 38' ' ' TYR . 33.1 mt -119.09 101.86 8.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.937 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -135.11 136.26 24.44 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.565 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.431 ' HG2' ' HB3' ' A' ' 33' ' ' LYS . 10.0 Cg_endo -51.08 -28.65 25.61 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.713 2.276 . . . . 0.0 112.215 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 15.2 p30 -96.41 -26.37 15.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.816 179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -113.1 112.6 49.73 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.77 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -50.01 175.05 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.468 2.112 . . . . 0.0 112.433 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -60.95 79.38 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.616 2.21 . . . . 0.0 112.357 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.463 ' HB ' ' HB2' ' A' ' 51' ' ' GLU . 7.6 mt -77.49 93.32 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.022 0.439 . . . . 0.0 110.502 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.66 HD13 ' HA2' ' A' ' 102' ' ' GLY . 2.8 mt -75.49 107.44 7.63 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.977 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.881 HD13 ' HA ' ' A' ' 70' ' ' MET . 3.8 mt -98.32 153.41 18.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.912 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.689 HG21 HD21 ' A' ' 106' ' ' LEU . 13.7 p -154.78 142.07 12.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.952 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.67 164.66 1.95 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.397 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 66.68 -76.5 0.15 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.417 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.88 -61.79 2.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.977 0.418 . . . . 0.0 110.808 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.483 ' CB ' HD23 ' A' ' 61' ' ' LEU . 7.5 m-20 -108.14 42.83 1.3 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.672 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.61 -17.4 64.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.434 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -76.81 -28.05 55.42 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.803 0.335 . . . . 0.0 110.669 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.857 ' CG ' HD21 ' A' ' 61' ' ' LEU . 4.2 pm0 -109.19 -23.84 11.42 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.249 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.881 ' HA ' HD13 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -50.4 176.55 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.868 0.366 . . . . 0.0 110.981 179.723 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.507 ' HB3' HG21 ' A' ' 46' ' ' ILE . 7.0 t -52.33 -66.7 0.34 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.802 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 72.37 7.12 5.63 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.516 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.47 157.9 18.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.962 0.41 . . . . 0.0 111.045 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -83.04 168.3 17.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.222 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.464 HD11 ' CE2' ' A' ' 15' ' ' PHE . 4.2 mm? -53.91 -53.58 50.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.747 0.308 . . . . 0.0 111.601 -179.386 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.56 -31.63 68.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.685 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -70.34 -40.8 73.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.462 -179.348 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.803 HG21 ' HZ ' ' A' ' 41' ' ' PHE . 0.2 OUTLIER -54.8 -76.58 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.306 -179.584 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 143.27 -24.21 2.21 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.508 -0.853 . . . . 0.0 113.007 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.889 HD22 ' HB2' ' A' ' 15' ' ' PHE . 1.0 OUTLIER -53.94 -48.58 70.09 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.06 0.457 . . . . 0.0 110.538 179.875 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.53 -48.32 82.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.614 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.76 -30.11 68.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.635 179.605 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.34 177.35 0.5 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.811 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -87.96 78.28 8.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.826 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 69.27 68.51 1.62 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.372 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -90.84 16.31 9.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.465 0.174 . . . . 0.0 111.463 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -84.03 155.15 22.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.953 0.406 . . . . 0.0 111.186 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.539 HG21 ' HB3' ' A' ' 16' ' ' ARG . 0.8 OUTLIER -136.95 179.04 4.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.964 179.748 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.578 ' H ' HD12 ' A' ' 89' ' ' LEU . 1.8 mp -94.07 137.93 22.79 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.607 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.72 -21.18 62.06 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.437 2.092 . . . . 0.0 112.334 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.12 -39.43 72.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.997 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -70.12 -50.44 40.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.009 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.45 ' CZ ' ' HG2' ' A' ' 50' ' ' MET . 16.7 t80 -54.91 -49.42 71.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.767 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.14 -21.93 61.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.748 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.9 -50.44 72.18 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.2 0.524 . . . . 0.0 109.614 179.131 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.438 ' HB ' ' HE3' ' A' ' 50' ' ' MET . 20.8 mm -77.47 -34.11 20.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.671 179.336 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.508 ' CZ3' HD23 ' A' ' 60' ' ' LEU . 53.0 t-105 -52.96 -40.55 63.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.919 179.353 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.15 -30.16 22.7 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.453 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -56.78 -54.15 49.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.221 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 95.3 m -75.8 -82.06 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.003 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -178.62 35.99 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.515 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.66 ' HA2' HD13 ' A' ' 60' ' ' LEU . . . -67.69 -37.66 89.22 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.607 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.655 ' CD1' HD22 ' A' ' 127' ' ' LEU . 30.9 mm -70.21 -39.41 76.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.855 0.359 . . . . 0.0 111.162 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.7 -42.92 97.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.974 0.416 . . . . 0.0 110.425 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -67.53 -42.99 81.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.717 179.729 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.856 HD12 HD11 ' A' ' 110' ' ' ILE . 0.2 OUTLIER -66.49 -50.25 63.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.056 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.422 ' HA ' ' HB ' ' A' ' 110' ' ' ILE . 0.9 OUTLIER -60.9 -29.56 69.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.024 -179.962 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 108' ' ' SER . . . . . 0.401 ' N ' ' HG3' ' A' ' 107' ' ' GLN . 8.5 t -68.87 -50.49 49.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.76 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.09 -31.1 65.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.351 0.596 . . . . 0.0 109.505 178.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.856 HD11 HD12 ' A' ' 106' ' ' LEU . 10.7 mt -56.96 -48.8 80.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.127 179.136 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -69.53 -39.35 77.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.577 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.39 -12.03 61.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.191 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 73.2 35.83 0.89 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.842 0.353 . . . . 0.0 110.908 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -106.8 -28.91 9.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.661 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.99 -170.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.025 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -140.16 96.21 8.15 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.951 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -45.88 107.09 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.509 2.14 . . . . 0.0 112.276 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.7 p -144.69 -45.82 0.24 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.171 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -174.37 -49.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.916 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.436 ' O ' ' HB2' ' A' ' 124' ' ' LEU . . . -58.14 -39.06 77.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.232 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.473 HG22 ' CD1' ' A' ' 106' ' ' LEU . 40.3 p -68.64 -44.76 73.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.746 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.21 -58.26 9.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.089 0.471 . . . . 0.0 110.427 179.475 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' MET . . . . . 0.54 ' HE2' ' N ' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -56.19 -29.59 61.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.18 179.22 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.54 ' N ' ' HE2' ' A' ' 123' ' ' MET . 0.0 OUTLIER -67.65 -51.36 50.84 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.003 0.43 . . . . 0.0 109.943 178.956 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 46.6 mm-40 -49.75 -38.39 33.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.067 179.402 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 -79.63 -34.23 40.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.227 179.128 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.655 HD22 ' CD1' ' A' ' 103' ' ' ILE . 0.3 OUTLIER -61.49 -18.68 60.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.387 179.065 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.626 ' O ' HD12 ' A' ' 128' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--N 1.333 -0.122 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.873 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.819 0.343 . . . . 0.0 111.004 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 87.8 mm-40 -70.23 146.93 50.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.593 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.9 mp0 -112.82 113.73 25.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.918 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.473 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.7 OUTLIER -126.0 124.09 39.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.051 179.842 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.501 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -113.67 134.66 54.6 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.699 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.912 ' HB2' HD22 ' A' ' 80' ' ' LEU . 1.9 m-85 -133.5 160.65 36.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.28 0.562 . . . . 0.0 112.179 -178.685 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.647 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.4 OUTLIER -149.11 144.09 26.42 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.827 179.625 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.462 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -153.22 117.5 2.81 Favored Pre-proline 0 C--N 1.33 -0.269 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.96 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.489 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 1.2 Cg_endo -83.67 89.27 1.05 Allowed 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 123.057 2.504 . . . . 0.0 111.781 179.456 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.421 ' O ' ' CD1' ' A' ' 19' ' ' PHE . 20.8 p90 -103.1 136.58 42.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.944 0.402 . . . . 0.0 110.997 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.558 HG12 ' HG3' ' A' ' 34' ' ' LYS . 10.6 mt -84.81 139.67 17.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.072 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.7 mtp180 -60.66 139.06 93.08 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.261 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.461 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 19.5 Cg_endo -58.29 -50.55 9.51 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.409 2.073 . . . . 0.0 112.301 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.531 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -53.84 -58.34 7.6 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.077 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.541 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 45.4 m-20 -66.38 -32.69 74.23 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.983 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.429 ' HB3' ' O ' ' A' ' 22' ' ' PRO . 0.0 OUTLIER -50.37 -52.45 37.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.347 -179.653 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.531 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.9 p90 -98.17 -15.75 19.77 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.972 -179.317 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.541 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 0.7 OUTLIER -60.92 -46.51 90.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.937 0.398 . . . . 0.0 110.729 179.861 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -161.86 138.44 6.15 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.021 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.29 -7.08 20.57 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.515 2.143 . . . . 0.0 112.729 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -111.26 -29.75 7.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.854 0.359 . . . . 0.0 110.897 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.3 m120 -97.95 29.05 3.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.121 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.437 ' HB3' HG21 ' A' ' 20' ' ' ILE . 17.5 mttt -64.7 -62.32 1.65 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.115 0.484 . . . . 0.0 110.525 179.578 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.9 mmmt 67.77 100.98 0.05 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.505 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.558 ' HG3' HG12 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -81.87 139.17 34.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.457 -179.467 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.441 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -110.49 130.18 9.71 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.05 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.489 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 22.9 m-90 -97.49 112.85 24.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.054 0.454 . . . . 0.0 110.875 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.732 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 26.9 t90 -101.92 117.47 34.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.01 -179.509 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.89 ' CE1' HD12 ' A' ' 52' ' ' LEU . 1.2 m-85 -114.45 156.04 25.26 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.414 179.319 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.94 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -163.53 123.78 2.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.331 0.586 . . . . 0.0 111.852 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.507 ' HB3' ' CB ' ' A' ' 48' ' ' ARG . 2.4 t-160 -90.71 84.51 5.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.208 -0.906 . . . . 0.0 108.841 178.603 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.703 ' CD2' HD12 ' A' ' 75' ' ' LEU . 13.7 m-85 -71.83 149.83 44.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.836 -178.518 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.432 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.5 OUTLIER -133.03 119.13 19.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.432 -0.804 . . . . 0.0 108.898 178.968 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 62.71 -140.52 46.0 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 119.966 -1.111 . . . . 0.0 110.929 -178.354 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.406 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 2.6 Cg_exo -75.89 -1.17 11.07 Favored 'Trans proline' 0 CA--C 1.531 0.33 0 C-N-CA 122.691 2.261 . . . . 0.0 112.421 179.558 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' TRP . . . . . 0.406 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 1.5 m95 -135.5 -158.44 0.87 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.582 -178.374 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.94 ' CD1' ' HB1' ' A' ' 39' ' ' ALA . 4.2 tt -139.31 155.21 25.87 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.099 0 CA-C-O 121.119 0.485 . . . . 0.0 111.861 -179.231 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.447 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -123.85 -24.29 4.48 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.594 -0.73 . . . . 0.0 112.12 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.857 ' O ' HD11 ' A' ' 46' ' ' ILE . 3.2 mtt180 -126.47 133.65 51.14 Favored 'General case' 0 C--O 1.227 -0.099 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.536 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.413 ' NE2' ' HA ' ' A' ' 70' ' ' MET . 0.5 OUTLIER -144.16 137.48 27.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.913 0.387 . . . . 0.0 111.423 -179.943 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.628 ' HE1' ' HB ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -133.62 115.51 14.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.524 179.729 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.414 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.1 OUTLIER -95.46 115.67 27.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.104 -179.73 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.89 HD12 ' CE1' ' A' ' 38' ' ' TYR . 15.1 mt -115.22 101.87 9.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.649 179.684 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.441 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 2.0 m-70 -123.8 133.6 24.74 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.041 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -52.66 -27.33 32.92 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.268 1.979 . . . . 0.0 112.118 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -94.75 -26.92 16.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.936 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.5 mptt -121.2 118.93 29.86 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.999 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.431 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 88.1 Cg_exo -46.09 170.13 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.536 2.157 . . . . 0.0 112.238 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.595 ' O ' HD13 ' A' ' 60' ' ' LEU . 18.0 Cg_endo -58.2 82.22 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.446 2.098 . . . . 0.0 112.3 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.414 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 76.2 mt -61.03 105.36 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.735 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.771 HD11 ' SG ' ' A' ' 100' ' ' CYS . 3.0 mp -81.43 121.38 26.18 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.987 -179.861 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.605 HD22 ' HB3' ' A' ' 66' ' ' ASP . 73.9 mt -129.4 154.17 47.19 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.076 -179.793 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.543 ' HB ' HD21 ' A' ' 106' ' ' LEU . 10.6 p -153.51 143.15 14.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.028 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.492 ' N ' ' HE1' ' A' ' 70' ' ' MET . . . -54.44 147.62 13.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.151 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.72 -50.51 2.3 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.568 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.74 -75.68 0.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.833 0.349 . . . . 0.0 110.888 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.605 ' HB3' HD22 ' A' ' 61' ' ' LEU . 0.4 OUTLIER -85.93 56.14 3.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.916 -179.87 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -68.18 -28.7 67.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.204 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.96 -20.71 34.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.235 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -94.78 -50.07 5.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.287 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.492 ' HE1' ' N ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -58.35 -163.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.153 -179.915 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.696 ' SG ' HD13 ' A' ' 46' ' ' ILE . 1.8 m -73.65 114.36 11.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.595 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -103.14 37.76 1.91 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.886 0.374 . . . . 0.0 110.764 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.415 ' HB2' ' HG3' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -147.09 -179.18 6.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.819 179.954 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -94.67 164.21 13.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.683 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.703 HD12 ' CD2' ' A' ' 41' ' ' PHE . 0.6 OUTLIER -54.92 -32.32 61.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.659 -179.573 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.57 -56.06 7.41 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -179.273 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.415 ' HG3' ' HB2' ' A' ' 73' ' ' LYS . 5.5 pt-20 -77.91 -3.91 44.12 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.595 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.689 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -65.34 -53.56 41.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.755 0.312 . . . . 0.0 110.758 179.911 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 117.79 -25.13 8.62 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.7 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.912 HD22 ' HB2' ' A' ' 15' ' ' PHE . 1.2 mt -56.92 -32.24 65.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.747 0.308 . . . . 0.0 111.005 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 5.1 p -80.04 -34.03 38.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.927 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -67.01 -30.5 70.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.876 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.58 -173.96 0.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.808 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.03 74.46 4.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.976 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 69.25 65.57 2.55 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.602 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.495 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -72.58 -10.26 59.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.637 0.256 . . . . 0.0 111.387 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -52.28 148.07 7.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.898 0.38 . . . . 0.0 111.388 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.647 HG21 ' HB3' ' A' ' 16' ' ' ARG . 1.0 OUTLIER -139.8 179.29 2.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.105 179.897 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.476 HD12 ' CB ' ' A' ' 91' ' ' ARG . 0.4 OUTLIER -98.41 150.19 36.48 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.578 179.664 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.51 -29.94 71.14 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.489 2.126 . . . . 0.0 112.349 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.476 ' CB ' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -57.0 -49.69 74.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.472 -179.723 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.516 ' HA ' ' HG2' ' A' ' 95' ' ' GLU . 4.8 mm-40 -64.37 -46.23 84.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.937 0.399 . . . . 0.0 111.637 -179.366 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.467 ' CZ ' ' HG2' ' A' ' 50' ' ' MET . 15.2 t80 -64.72 -43.93 91.84 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.365 -179.547 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -79.6 -30.02 41.34 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -179.053 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.516 ' HG2' ' HA ' ' A' ' 92' ' ' GLN . 11.8 pt-20 -63.91 -46.43 84.83 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 120.129 -0.628 . . . . 0.0 109.799 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.628 ' HB ' ' HE1' ' A' ' 50' ' ' MET . 38.0 mm -71.21 -37.84 67.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 CA-C-O 121.142 0.496 . . . . 0.0 110.018 178.61 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.461 ' CZ3' ' HG ' ' A' ' 60' ' ' LEU . 47.5 t-105 -52.48 -39.64 61.41 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.228 179.399 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -85.51 -24.57 27.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.729 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.61 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -56.77 -45.7 81.92 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.291 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 100' ' ' CYS . . . . . 0.771 ' SG ' HD11 ' A' ' 60' ' ' LEU . 2.2 p -88.66 -54.63 4.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.606 -179.506 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.408 ' O ' ' HG2' ' A' ' 104' ' ' GLN . . . 148.96 45.88 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.584 -0.817 . . . . 0.0 112.556 -179.835 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.489 ' HA2' HD23 ' A' ' 60' ' ' LEU . . . -71.09 -38.98 63.5 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.932 -0.652 . . . . 0.0 112.387 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.596 HD12 HD22 ' A' ' 127' ' ' LEU . 20.6 mm -62.44 -55.08 26.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.725 0.297 . . . . 0.0 110.951 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 101' ' ' GLY . 0.0 OUTLIER -56.19 -45.06 79.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.561 179.826 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -59.9 -49.36 77.99 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.342 179.37 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.589 HD12 HD11 ' A' ' 110' ' ' ILE . 0.3 OUTLIER -60.01 -46.19 90.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.798 179.816 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.464 ' HG2' HD23 ' A' ' 124' ' ' LEU . 1.1 mm100 -59.41 -29.63 67.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.032 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.84 -50.67 40.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.933 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.13 -31.29 65.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.456 0.646 . . . . 0.0 109.607 178.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.589 HD11 HD12 ' A' ' 106' ' ' LEU . 12.3 mt -58.69 -48.96 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.363 179.139 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -66.38 -42.44 87.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.321 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.74 -15.72 63.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.011 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 75.54 32.53 0.7 Allowed 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 120.921 0.391 . . . . 0.0 110.977 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -100.32 -26.73 13.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.792 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.585 ' HB1' HG21 ' A' ' 121' ' ' THR . . . -59.11 -162.88 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.041 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.471 ' O ' HG22 ' A' ' 118' ' ' THR . 0.0 OUTLIER -138.31 93.38 11.46 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.219 -179.88 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -51.06 89.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.602 2.201 . . . . 0.0 112.035 179.594 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.471 HG22 ' O ' ' A' ' 116' ' ' ARG . 9.0 t -138.23 -47.66 0.53 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.414 -179.605 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.453 ' CE1' ' CE1' ' A' ' 40' ' ' HIS . 14.4 t80 -167.23 -47.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.629 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.451 ' HB1' ' HG3' ' A' ' 48' ' ' ARG . . . -59.97 -52.4 65.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.664 -179.34 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.585 HG21 ' HB1' ' A' ' 115' ' ' ALA . 69.1 p -65.32 -49.12 70.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.718 -179.841 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.86 -48.39 75.62 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.414 0.626 . . . . 0.0 109.799 179.006 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' MET . . . . . 0.832 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -58.01 -31.45 66.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.245 -0.888 . . . . 0.0 109.875 178.762 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.493 HD22 HD12 ' A' ' 110' ' ' ILE . 0.1 OUTLIER -66.39 -49.41 66.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.891 178.837 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 63.7 mm-40 -49.99 -40.65 44.97 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.966 179.204 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -77.95 -32.82 51.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.129 178.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.832 HD13 ' CE ' ' A' ' 123' ' ' MET . 0.2 OUTLIER -63.03 -17.53 62.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.53 179.027 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.476 HD21 HD23 ' A' ' 124' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.15 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.038 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.842 0.353 . . . . 0.0 110.804 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -97.67 167.98 10.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.865 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.47 ' HG2' ' CZ ' ' A' ' 119' ' ' TYR . 4.1 mp0 -119.38 108.3 14.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.902 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.54 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -117.58 120.56 38.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.019 -179.739 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.489 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 0.1 OUTLIER -113.8 148.94 35.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.515 179.897 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.84 ' HB2' HD22 ' A' ' 80' ' ' LEU . 0.2 OUTLIER -152.39 162.8 40.66 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.296 0.569 . . . . 0.0 111.857 179.944 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.695 ' HB3' HG21 ' A' ' 88' ' ' ILE . 7.0 ttp180 -149.26 148.04 29.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.896 179.36 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.492 HG21 ' CD ' ' A' ' 83' ' ' LYS . 0.2 OUTLIER -149.61 124.48 4.8 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 120.72 0.295 . . . . 0.0 111.688 -179.751 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.468 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 67.1 Cg_endo -91.66 97.91 0.21 Allowed 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 123.007 2.471 . . . . 0.0 112.284 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -113.21 143.27 44.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.814 0.34 . . . . 0.0 110.834 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.43 HG12 ' HG2' ' A' ' 34' ' ' LYS . 5.7 mt -85.66 153.02 3.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.372 -179.641 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -80.25 140.57 52.92 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.671 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.485 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 51.8 Cg_exo -55.34 -47.92 23.43 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.558 2.172 . . . . 0.0 112.844 -179.576 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.54 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -54.94 -58.98 5.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.35 -179.383 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.484 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 1.8 m-20 -67.99 -31.18 70.7 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.552 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.42 -50.39 59.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.573 -179.718 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.54 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.3 p90 -102.21 -5.29 24.53 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 -179.268 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.484 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 6.0 mtpp -74.41 -39.11 62.85 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.835 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -174.44 140.79 0.74 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.417 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.469 ' HA ' ' HG2' ' A' ' 32' ' ' LYS . 61.4 Cg_endo -72.3 -22.28 22.14 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.671 2.248 . . . . 0.0 112.288 179.627 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -84.63 -36.95 21.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.169 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -94.47 41.6 1.09 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.821 179.098 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.469 ' HG2' ' HA ' ' A' ' 29' ' ' PRO . 18.2 mmtm -78.08 61.17 2.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.698 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.7 mmtt -46.2 95.5 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.338 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.43 ' HG2' HG12 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -83.89 131.99 34.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.783 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.407 ' HA2' ' HD3' ' A' ' 54' ' ' PRO . . . -115.99 142.51 17.59 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.849 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.468 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 22.0 m-90 -105.82 138.35 42.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.757 0.313 . . . . 0.0 110.732 179.853 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.621 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 41.7 t90 -123.98 116.83 23.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.791 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.858 ' CE1' HD12 ' A' ' 52' ' ' LEU . 3.1 m-85 -109.73 154.53 22.77 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.413 179.693 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.582 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -170.21 125.46 0.77 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.154 0.502 . . . . 0.0 112.041 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.489 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 16.8 t-160 -96.89 96.61 8.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.757 179.016 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.771 ' CZ ' HG21 ' A' ' 78' ' ' THR . 19.5 m-85 -83.91 122.54 28.87 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.579 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.513 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.6 OUTLIER -91.75 111.06 22.43 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 178.289 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.19 -135.6 50.09 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.018 -1.087 . . . . 0.0 110.928 -178.254 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.404 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 8.1 Cg_exo -72.5 -16.68 27.23 Favored 'Trans proline' 0 N--CA 1.463 -0.278 0 C-N-CA 122.444 2.096 . . . . 0.0 112.317 179.424 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' TRP . . . . . 0.404 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 0.8 OUTLIER -115.08 -170.3 1.73 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.597 -178.696 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.589 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 3.5 tt -133.07 153.65 38.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 121.172 0.51 . . . . 0.0 111.998 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.579 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -129.73 -22.21 2.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.492 -0.777 . . . . 0.0 111.959 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.699 ' NE ' ' HB1' ' A' ' 120' ' ' ALA . 3.5 mtt180 -130.22 142.3 50.57 Favored 'General case' 0 N--CA 1.46 0.04 0 CA-C-O 120.77 0.319 . . . . 0.0 111.167 -179.686 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.494 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 0.1 OUTLIER -155.88 129.86 8.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.991 0.424 . . . . 0.0 111.175 179.942 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.642 ' SD ' HD11 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -125.47 120.53 31.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.695 179.891 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.491 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -98.53 132.85 43.63 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.071 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.858 HD12 ' CE1' ' A' ' 38' ' ' TYR . 14.1 mt -135.06 101.98 5.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.846 179.724 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -126.26 138.26 31.92 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.931 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.407 ' HD3' ' HA2' ' A' ' 35' ' ' GLY . 53.3 Cg_exo -52.26 -23.64 18.62 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.439 2.092 . . . . 0.0 112.341 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -98.58 -27.45 14.01 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.233 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 1.9 mttm -118.49 125.41 27.84 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.053 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.53 177.05 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.522 2.148 . . . . 0.0 112.27 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -59.68 84.97 0.07 OUTLIER 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.642 2.228 . . . . 0.0 112.498 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.693 HG22 HD23 ' A' ' 61' ' ' LEU . 67.1 mt -66.21 98.12 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.003 0.43 . . . . 0.0 110.634 179.64 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.557 HD21 ' C ' ' A' ' 101' ' ' GLY . 0.2 OUTLIER -72.92 107.82 5.51 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.933 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.907 HD11 ' CB ' ' A' ' 69' ' ' GLU . 1.1 mm? -110.15 147.46 33.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.959 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.9 p -156.53 140.51 7.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.936 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.579 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -56.08 170.7 0.3 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.025 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.28 -72.28 0.32 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.325 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.405 ' HG2' ' HB3' ' A' ' 114' ' ' GLN . 0.5 OUTLIER -64.28 -54.0 40.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.824 0.345 . . . . 0.0 110.694 179.839 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.428 ' CB ' HD13 ' A' ' 61' ' ' LEU . 59.7 m-20 -114.19 57.46 0.7 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.867 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -20.19 63.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.212 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -85.58 -43.3 13.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.049 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.907 ' CB ' HD11 ' A' ' 61' ' ' LEU . 3.2 mm-40 -68.41 -39.58 81.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.02 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -48.26 167.66 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.905 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.529 ' SG ' HG22 ' A' ' 78' ' ' THR . 0.9 OUTLIER -56.09 -30.66 62.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.864 0.364 . . . . 0.0 111.083 -179.798 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 75.97 -61.07 0.47 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.059 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.2 mptt -53.45 161.49 0.98 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.189 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.55 ' O ' HG23 ' A' ' 78' ' ' THR . 11.1 m120 -77.59 -172.89 2.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.555 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.542 HD11 ' CZ ' ' A' ' 15' ' ' PHE . 28.0 tp -64.47 -51.97 60.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.558 -179.542 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.16 -31.37 68.82 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.837 0.351 . . . . 0.0 111.383 -179.663 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -66.95 -37.9 85.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.611 -179.406 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.771 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 21.0 p -59.41 -74.13 0.07 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.785 0.326 . . . . 0.0 111.122 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 143.03 -17.76 2.34 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.807 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.84 HD22 ' HB2' ' A' ' 15' ' ' PHE . 0.6 OUTLIER -50.49 -41.1 52.84 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.979 0.418 . . . . 0.0 110.756 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -73.94 -26.84 60.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.725 179.727 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.98 -26.91 57.22 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.975 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.492 ' CD ' HG21 ' A' ' 17' ' ' ILE . 0.3 OUTLIER -70.86 -171.08 0.49 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.115 -179.853 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.6 90.93 4.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.951 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 62.5 68.97 1.44 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.559 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -88.14 -22.0 24.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.779 0.323 . . . . 0.0 111.077 179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -53.92 143.26 21.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.307 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.695 HG21 ' HB3' ' A' ' 16' ' ' ARG . 1.6 pt -130.16 169.66 20.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.127 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.6 HD12 ' HB2' ' A' ' 91' ' ' ARG . 0.8 OUTLIER -84.59 147.56 49.65 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.67 179.845 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -66.02 -26.06 51.17 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.558 2.172 . . . . 0.0 112.353 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.6 ' HB2' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -61.16 -54.37 45.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.104 -179.897 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -50.91 71.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.12 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -54.22 -53.07 58.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.713 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.57 -20.8 62.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.502 179.546 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.15 -50.34 74.05 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.013 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.437 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 20.0 mm -75.4 -33.67 28.23 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.303 178.898 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.475 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 14.1 t-105 -52.75 -41.07 63.68 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.972 179.281 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.06 -29.0 23.74 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.381 179.188 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.437 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -61.35 -45.92 92.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.207 -179.813 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 44.3 t -88.02 -83.45 0.21 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.976 -179.664 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.557 ' C ' HD21 ' A' ' 60' ' ' LEU . . . -176.09 34.38 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.63 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.518 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -58.26 -54.89 33.99 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.603 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.869 ' HA ' HD11 ' A' ' 124' ' ' LEU . 1.8 mt -58.33 -34.69 50.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.796 0.331 . . . . 0.0 111.108 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' GLN . . . . . 0.491 ' NE2' ' HA2' ' A' ' 101' ' ' GLY . 1.0 OUTLIER -63.75 -49.16 74.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.604 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -64.18 -42.52 96.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.432 179.611 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.939 ' CD1' HD13 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -64.0 -46.31 85.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.693 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.44 ' HG2' HD21 ' A' ' 124' ' ' LEU . 8.1 mm100 -61.49 -29.72 70.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.77 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 37.7 m -68.33 -50.31 54.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.749 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.27 -33.37 69.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.362 0.601 . . . . 0.0 109.518 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.641 HD11 HD22 ' A' ' 106' ' ' LEU . 8.6 mt -56.91 -48.92 80.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.368 179.146 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -67.86 -38.33 82.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.413 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 1.1 m -78.07 -4.88 49.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.235 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.8 mmt85 65.27 35.88 7.38 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.964 0.411 . . . . 0.0 110.922 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' GLN . . . . . 0.405 ' HB3' ' HG2' ' A' ' 65' ' ' LYS . 0.0 OUTLIER -111.15 -25.2 9.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.873 179.86 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.482 ' HB1' ' CG2' ' A' ' 121' ' ' THR . . . -56.45 -29.93 62.26 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.161 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 72.05 97.65 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.345 179.781 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_exo -52.3 87.85 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.746 2.297 . . . . 0.0 111.932 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.429 HG21 ' HB1' ' A' ' 47' ' ' ALA . 9.0 t -112.22 -43.48 3.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.106 -179.643 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.47 ' CZ ' ' HG2' ' A' ' 12' ' ' GLN . 23.0 t80 -178.89 -63.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.035 179.855 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.699 ' HB1' ' NE ' ' A' ' 48' ' ' ARG . . . -53.67 -36.12 61.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.995 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.502 HG22 ' CG1' ' A' ' 110' ' ' ILE . 0.8 OUTLIER -60.83 -47.09 87.96 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.06 179.467 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -65.79 -46.4 78.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.389 0.614 . . . . 0.0 109.695 178.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' MET . . . . . 0.606 ' HE3' HD12 ' A' ' 127' ' ' LEU . 1.9 tmm? -58.11 -35.81 72.0 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.251 179.087 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.939 HD13 ' CD1' ' A' ' 106' ' ' LEU . 0.6 OUTLIER -67.69 -45.97 73.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.74 178.996 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.747 ' HA ' HD12 ' A' ' 128' ' ' LEU . 21.7 mm100 -50.52 -38.4 44.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.968 179.092 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -76.77 -34.95 58.0 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.065 179.102 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.606 HD12 ' HE3' ' A' ' 123' ' ' MET . 1.2 mt -59.3 -21.13 59.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.084 178.659 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.747 HD12 ' HA ' ' A' ' 125' ' ' GLN . 1.8 mt . . . . . 0 C--N 1.332 -0.169 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.93 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 51.5 mtt-85 . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.92 0.39 . . . . 0.0 110.877 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.71 138.16 31.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.874 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.456 ' HG2' ' CZ ' ' A' ' 119' ' ' TYR . 5.7 mp0 -108.08 102.82 11.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.889 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.483 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 2.5 mtp180 -111.92 133.84 53.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.019 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.505 ' CE2' ' CG ' ' A' ' 40' ' ' HIS . 1.2 m-85 -117.7 134.96 54.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.145 179.799 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.809 ' HB2' HD22 ' A' ' 80' ' ' LEU . 1.4 m-85 -136.31 157.23 47.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.251 0.548 . . . . 0.0 112.003 -179.037 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.707 ' HB3' HG21 ' A' ' 88' ' ' ILE . 16.4 ttp180 -149.38 145.89 27.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.785 179.428 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.685 HG21 ' CE ' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -140.84 125.01 10.48 Favored Pre-proline 0 C--N 1.328 -0.327 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.447 -179.72 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -88.19 96.75 0.4 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.009 2.473 . . . . 0.0 112.186 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.407 ' O ' ' CD1' ' A' ' 19' ' ' PHE . 10.9 p90 -120.39 142.61 49.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.912 0.387 . . . . 0.0 111.107 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.524 HG23 ' O ' ' A' ' 33' ' ' LYS . 17.0 mt -87.9 145.41 7.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.935 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.14 129.26 93.92 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.485 179.647 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.474 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 75.8 Cg_exo -50.04 -48.96 17.59 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.431 2.087 . . . . 0.0 112.659 -179.698 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.543 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -54.37 -58.24 8.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.439 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.554 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 36.9 m-20 -67.38 -31.77 72.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.913 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -51.61 -55.44 19.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.493 -179.574 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.543 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.0 p90 -93.89 -14.28 26.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.728 -179.43 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.554 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 3.0 mtpp -60.97 -47.25 87.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.952 0.406 . . . . 0.0 110.6 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -164.87 142.35 5.13 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.094 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -70.66 -22.42 27.96 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.735 2.29 . . . . 0.0 112.666 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -95.09 -32.83 12.92 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.789 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 30.5 m120 -101.37 48.14 0.9 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.728 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.01 59.53 0.67 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.795 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.524 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -44.25 146.14 0.7 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.259 179.938 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.26 117.49 34.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.013 -179.486 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -92.17 126.33 8.46 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.228 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 8.6 m-90 -102.16 135.21 44.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.902 0.382 . . . . 0.0 111.01 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.73 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 33.7 t90 -117.01 117.21 29.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.048 -179.601 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.868 ' CE1' HD12 ' A' ' 52' ' ' LEU . 12.0 m-85 -111.87 150.91 29.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.122 179.434 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.85 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -169.55 125.05 0.84 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.146 0.498 . . . . 0.0 112.042 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.505 ' CG ' ' CE2' ' A' ' 14' ' ' PHE . 14.4 t-160 -91.92 99.56 12.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.649 178.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.74 ' CZ ' HG21 ' A' ' 78' ' ' THR . 36.9 m-85 -85.23 118.87 25.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.776 -179.085 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.493 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.7 OUTLIER -91.59 115.17 27.82 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.28 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 57.78 -135.82 51.38 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 119.967 -1.111 . . . . 0.0 111.107 -178.341 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -72.38 -18.77 26.05 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.436 2.091 . . . . 0.0 112.353 179.417 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' TRP . . . . . 0.418 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.6 OUTLIER -114.24 -171.56 1.94 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.969 0.414 . . . . 0.0 111.692 -178.752 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.85 ' CD1' ' HB1' ' A' ' 39' ' ' ALA . 1.7 tt -131.03 148.5 33.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.509 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.613 ' CB ' HG21 ' A' ' 118' ' ' THR . . . -122.92 -20.58 5.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.839 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.749 ' O ' HD11 ' A' ' 46' ' ' ILE . 2.3 mtt180 -129.94 138.38 50.85 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.84 0.352 . . . . 0.0 111.333 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.475 ' HB3' ' HB3' ' A' ' 61' ' ' LEU . 7.2 tt0 -147.96 121.06 8.86 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.908 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 7.3 ttm -121.01 112.76 19.14 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.708 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -94.23 129.76 40.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.14 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.868 HD12 ' CE1' ' A' ' 38' ' ' TYR . 8.5 mt -129.05 112.1 13.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.854 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.8 m-70 -128.52 129.97 23.54 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.774 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.408 ' HB2' ' HG2' ' A' ' 33' ' ' LYS . 86.4 Cg_exo -46.68 -27.11 5.05 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.515 2.143 . . . . 0.0 112.543 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -95.08 -33.97 12.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.946 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.1 mtpt -111.95 120.44 42.03 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.954 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -47.56 174.05 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.598 2.199 . . . . 0.0 112.579 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.463 ' HA ' HD23 ' A' ' 52' ' ' LEU . 48.9 Cg_exo -55.95 85.38 0.04 OUTLIER 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.7 2.266 . . . . 0.0 112.341 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 84.5 mt -64.47 92.14 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.097 0.475 . . . . 0.0 110.737 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.591 HD21 ' N ' ' A' ' 102' ' ' GLY . 0.3 OUTLIER -64.68 132.78 50.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.719 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.96 HD11 ' HB3' ' A' ' 69' ' ' GLU . 0.2 OUTLIER -140.88 150.03 42.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.163 -179.52 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.526 HG12 ' HE2' ' A' ' 105' ' ' TYR . 13.3 p -153.36 148.96 13.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.121 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.558 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -60.26 166.92 2.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.974 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.18 -73.39 0.29 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.393 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -58.95 -57.6 12.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.845 0.355 . . . . 0.0 110.8 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.411 ' HB3' HD21 ' A' ' 61' ' ' LEU . 81.5 m-20 -108.96 48.51 0.86 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.639 179.8 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.22 -17.88 65.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.422 -179.938 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 17.9 mmt -82.14 -32.63 29.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.848 0.356 . . . . 0.0 110.563 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.96 ' HB3' HD11 ' A' ' 61' ' ' LEU . 1.2 mp0 -89.24 -40.81 12.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.799 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.434 ' CA ' HD22 ' A' ' 61' ' ' LEU . 32.1 ttm -53.34 162.51 0.74 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.142 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.502 ' SG ' HG22 ' A' ' 78' ' ' THR . 1.7 t -50.08 118.1 2.73 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.941 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -82.98 0.84 42.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.772 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.28 164.56 16.8 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.79 0.329 . . . . 0.0 110.997 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.555 ' O ' HG23 ' A' ' 78' ' ' THR . 7.2 m120 -83.31 -179.84 7.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.974 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.809 HD21 ' CE1' ' A' ' 15' ' ' PHE . 4.3 mt -65.78 -34.24 77.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.444 -179.673 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.5 -42.11 71.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.087 -178.998 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -93.87 -3.75 51.25 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.303 0.482 . . . . 0.0 112.303 -178.683 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.74 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.2 OUTLIER -67.08 -64.11 0.92 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.795 0.331 . . . . 0.0 110.813 179.945 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLY . . . . . 0.405 ' CA ' ' NH1' ' A' ' 82' ' ' ARG . . . 129.82 -15.83 5.63 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.763 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.809 HD22 ' HB2' ' A' ' 15' ' ' PHE . 1.1 mp -68.25 -45.07 74.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.892 0.377 . . . . 0.0 110.892 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.755 HG23 HD22 ' A' ' 75' ' ' LEU . 52.9 p -65.44 -52.16 55.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.174 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.405 ' NH1' ' CA ' ' A' ' 79' ' ' GLY . 0.0 OUTLIER -62.01 -27.59 68.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.961 -179.833 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.685 ' CE ' HG21 ' A' ' 17' ' ' ILE . 0.4 OUTLIER -59.48 -167.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.861 179.83 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.18 73.67 7.17 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.005 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 59.71 65.35 3.47 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.651 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.99 -14.03 62.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.8 0.333 . . . . 0.0 111.492 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.69 143.18 21.13 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.273 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.707 HG21 ' HB3' ' A' ' 16' ' ' ARG . 2.1 pt -127.16 -179.88 3.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.193 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 8.9 mt -81.85 137.96 46.87 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.838 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.5 -51.25 5.43 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.428 2.085 . . . . 0.0 111.986 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.87 -38.26 69.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.19 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -62.33 -52.38 63.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.935 0.398 . . . . 0.0 110.981 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.53 ' HB2' HD11 ' A' ' 88' ' ' ILE . 43.2 t80 -54.27 -53.0 59.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.57 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.404 ' OE2' ' NH1' ' A' ' 48' ' ' ARG . 0.1 OUTLIER -68.8 -21.23 64.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.515 179.436 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.52 -50.64 72.75 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 179.041 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.438 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 17.4 mm -71.96 -32.9 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.351 179.157 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.469 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 19.4 t-105 -55.72 -37.22 68.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.995 179.047 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.68 -27.92 25.03 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.642 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.438 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.2 OUTLIER -56.58 -54.3 47.51 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.348 -179.541 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 40.9 t -83.54 -80.18 0.19 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.025 -179.72 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.566 ' C ' HD21 ' A' ' 60' ' ' LEU . . . 178.85 36.48 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.579 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.591 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -54.29 -55.23 27.6 Favored Glycine 0 N--CA 1.453 -0.188 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.418 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.821 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.6 mp -56.69 -40.49 70.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.768 0.318 . . . . 0.0 111.292 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -59.7 -49.03 79.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.571 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.526 ' HE2' HG12 ' A' ' 62' ' ' VAL . 82.9 t80 -61.26 -42.16 98.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.401 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 1.065 HD13 HD13 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -64.92 -41.56 95.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.63 179.705 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -63.11 -32.72 74.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.727 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -67.97 -50.18 57.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.514 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.4 -35.84 78.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.437 0.636 . . . . 0.0 109.456 178.84 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.637 HD12 HD22 ' A' ' 124' ' ' LEU . 3.8 mt -59.62 -48.87 85.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.357 179.012 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.405 ' HG3' ' N ' ' A' ' 112' ' ' SER . 7.5 pt-20 -67.03 -30.93 71.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.725 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' SER . . . . . 0.405 ' N ' ' HG3' ' A' ' 111' ' ' GLU . 23.4 m -86.23 -7.03 58.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.206 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 22.6 mmt85 70.27 29.01 3.75 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.898 0.38 . . . . 0.0 110.88 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 84.1 mm-40 -99.44 -25.18 14.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.587 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.04 -164.93 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.933 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' ARG . . . . . 0.492 ' O ' HG22 ' A' ' 118' ' ' THR . 5.7 ttt180 -140.48 89.94 10.31 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.102 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' PRO . . . . . 0.405 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 77.9 Cg_exo -51.31 87.91 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.705 2.27 . . . . 0.0 112.349 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.613 HG21 ' CB ' ' A' ' 47' ' ' ALA . 5.7 t -127.35 -45.03 1.53 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.868 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.456 ' CZ ' ' HG2' ' A' ' 12' ' ' GLN . 27.9 t80 -168.56 -61.66 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.886 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.458 ' O ' ' HG3' ' A' ' 123' ' ' MET . . . -54.09 -37.33 64.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.317 -179.73 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.605 HG22 ' CG1' ' A' ' 110' ' ' ILE . 0.2 OUTLIER -68.33 -41.06 81.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.557 179.961 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -65.53 -56.25 13.39 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.523 179.538 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' MET . . . . . 0.568 ' HE1' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -55.38 -29.12 57.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.315 179.293 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 1.065 HD13 HD13 ' A' ' 106' ' ' LEU . 0.3 OUTLIER -64.51 -52.4 58.0 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.079 0.466 . . . . 0.0 110.043 179.055 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 125' ' ' GLN . . . . . 0.753 ' HA ' HD12 ' A' ' 128' ' ' LEU . 11.2 mm100 -53.09 -42.69 66.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.717 179.741 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -78.63 -30.63 46.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.666 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.568 HD13 ' HE1' ' A' ' 123' ' ' MET . 1.3 tt -76.02 -7.81 55.53 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.523 179.269 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.753 HD12 ' HA ' ' A' ' 125' ' ' GLN . 7.0 mt . . . . . 0 C--N 1.332 -0.19 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.24 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.876 0.369 . . . . 0.0 111.034 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.8 mm-40 -61.48 152.72 29.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.786 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.402 ' OE1' ' CE1' ' A' ' 40' ' ' HIS . 93.1 mm-40 -123.89 102.71 7.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.907 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.475 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -112.58 123.64 50.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.023 179.977 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.46 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 2.5 m-85 -108.91 134.89 50.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.012 179.709 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.919 ' HB2' HD22 ' A' ' 80' ' ' LEU . 15.1 m-85 -132.79 148.84 52.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.234 0.54 . . . . 0.0 112.12 -178.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.92 ' HD3' HD12 ' A' ' 88' ' ' ILE . 0.3 OUTLIER -147.2 138.93 24.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.605 179.597 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.668 HG21 ' HG2' ' A' ' 83' ' ' LYS . 0.2 OUTLIER -149.33 123.27 4.63 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-O 120.725 0.298 . . . . 0.0 111.613 -179.582 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.449 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 91.0 Cg_endo -89.16 119.59 0.97 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.016 2.478 . . . . 0.0 111.964 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.432 ' O ' ' N ' ' A' ' 35' ' ' GLY . 11.4 p90 -139.31 154.84 47.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.883 0.373 . . . . 0.0 111.068 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 58.5 mt -105.06 142.19 18.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.769 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -58.76 136.99 86.87 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.47 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.457 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 15.9 Cg_endo -57.46 -46.56 26.79 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.516 2.144 . . . . 0.0 112.585 -179.624 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.523 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -55.44 -58.87 5.97 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.316 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.521 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 2.7 m-20 -66.52 -32.71 74.24 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.684 179.768 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.403 ' HA ' ' HE3' ' A' ' 32' ' ' LYS . 0.4 OUTLIER -50.62 -51.23 50.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.48 -179.696 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.523 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.8 p90 -103.32 -1.64 28.4 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.119 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.521 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 16.0 mtpp -77.89 -40.07 41.13 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.919 -0.313 . . . . 0.0 110.949 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -172.78 143.57 1.18 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.44 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.482 ' HA ' ' HG2' ' A' ' 32' ' ' LYS . 67.8 Cg_endo -73.03 -22.7 19.2 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.807 2.338 . . . . 0.0 112.295 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -83.97 -36.2 23.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.111 179.686 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -94.38 41.79 1.09 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.995 179.057 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.482 ' HG2' ' HA ' ' A' ' 29' ' ' PRO . 13.9 mmtm -80.74 59.93 3.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.779 -179.589 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.1 94.6 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.964 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.17 -170.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.979 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 19' ' ' PHE . . . -170.11 108.52 0.29 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.23 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.482 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 18.0 m-90 -97.58 131.57 44.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.846 0.355 . . . . 0.0 110.682 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.727 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 18.3 t90 -121.02 117.5 27.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.22 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.526 ' HE2' HD22 ' A' ' 52' ' ' LEU . 1.8 m-85 -120.2 148.02 44.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.201 179.34 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.706 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.47 124.64 0.71 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.215 0.531 . . . . 0.0 111.69 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.479 ' HB3' ' CG ' ' A' ' 48' ' ' ARG . 10.9 t-160 -93.22 105.77 17.81 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 178.536 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.719 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 3.0 m-85 -85.45 134.09 34.07 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.62 -178.558 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.498 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 4.5 t70 -97.25 120.93 38.51 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 178.501 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 57.31 -138.65 47.62 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 119.767 -1.206 . . . . 0.0 110.889 -178.385 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.413 ' O ' ' ND2' ' A' ' 74' ' ' ASN . 7.4 Cg_exo -72.26 -18.67 26.55 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.351 2.034 . . . . 0.0 112.089 179.212 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' TRP . . . . . 0.405 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -113.95 -169.34 1.5 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.292 -178.921 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.719 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 8.4 tt -118.34 156.58 20.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 N-CA-C 112.643 0.608 . . . . 0.0 112.643 -179.155 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.436 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -119.78 -36.46 3.3 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.763 -179.533 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.62 ' O ' HD11 ' A' ' 46' ' ' ILE . 6.4 ptp180 -140.07 153.44 46.76 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 120.501 -0.48 . . . . 0.0 111.406 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.472 ' HG3' ' HB2' ' A' ' 39' ' ' ALA . 30.8 tt0 -146.41 153.62 40.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.289 -179.836 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.489 ' HE2' ' HB3' ' A' ' 50' ' ' MET . 20.0 ttp -142.16 111.96 6.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.566 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -95.34 126.45 40.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.957 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.526 HD22 ' HE2' ' A' ' 38' ' ' TYR . 1.4 mp -123.41 113.77 19.25 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.775 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.446 ' HB2' ' HB2' ' A' ' 56' ' ' LYS . 0.7 OUTLIER -134.49 135.53 23.93 Favored Pre-proline 0 C--N 1.332 -0.194 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.974 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.56 -28.11 35.34 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.51 2.14 . . . . 0.0 112.319 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -102.31 -19.72 14.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.149 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.446 ' HB2' ' HB2' ' A' ' 53' ' ' HIS . 5.3 mmmt -117.82 122.32 30.76 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.727 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -52.89 164.92 1.38 Allowed 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.531 2.154 . . . . 0.0 112.237 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -57.11 88.57 0.04 OUTLIER 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.641 2.227 . . . . 0.0 112.381 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.2 mt -69.59 94.54 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.147 0.498 . . . . 0.0 110.496 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.594 HD23 ' CZ3' ' A' ' 97' ' ' TRP . 0.8 OUTLIER -84.42 107.36 16.64 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.978 -179.626 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 29.0 mt -107.68 161.0 15.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.94 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.522 HG21 HD21 ' A' ' 106' ' ' LEU . 12.9 p -153.31 139.84 12.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.085 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.53 137.4 48.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.165 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 100.98 -40.46 2.41 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.438 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.441 ' HG3' ' HB1' ' A' ' 109' ' ' ALA . 0.1 OUTLIER -102.87 -32.2 9.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.781 0.324 . . . . 0.0 110.853 -179.909 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -132.0 44.28 2.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.886 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -59.47 -30.56 68.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.911 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 2.4 mtp -84.91 -29.8 24.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.092 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -78.3 -55.74 5.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.962 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.6 ptm -59.81 -178.12 0.07 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.032 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.507 ' SG ' HG22 ' A' ' 78' ' ' THR . 2.2 t -62.29 118.25 7.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.759 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -98.91 6.41 46.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.459 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -102.74 -175.04 2.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.916 0.389 . . . . 0.0 111.114 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASN . . . . . 0.413 ' ND2' ' O ' ' A' ' 44' ' ' PRO . 21.0 t-20 -109.42 160.41 16.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.25 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.823 HD23 HG21 ' A' ' 81' ' ' THR . 0.2 OUTLIER -43.87 -37.4 2.81 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.506 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -70.77 -56.1 7.12 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.838 0.351 . . . . 0.0 111.73 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -71.37 -16.3 62.41 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.6 HG21 ' CE2' ' A' ' 41' ' ' PHE . 0.4 OUTLIER -64.82 -62.15 1.74 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.79 0.329 . . . . 0.0 111.092 -179.524 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 122.0 -26.5 6.44 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.256 -179.631 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.919 HD22 ' HB2' ' A' ' 15' ' ' PHE . 0.7 OUTLIER -48.92 -42.67 37.96 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.993 0.425 . . . . 0.0 110.649 179.683 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.823 HG21 HD23 ' A' ' 75' ' ' LEU . 39.0 p -70.41 -28.32 64.97 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.372 179.228 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 8.0 mmm-85 -96.25 6.43 48.81 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.019 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.743 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 0.4 OUTLIER -93.81 31.25 1.63 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.695 0.284 . . . . 0.0 111.277 -179.754 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 55.02 72.84 0.45 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.974 0.416 . . . . 0.0 111.263 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.72 65.42 3.56 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.888 -0.673 . . . . 0.0 113.115 179.468 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.743 ' HB2' ' HB3' ' A' ' 83' ' ' LYS . . . -93.85 32.15 1.5 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.84 0.352 . . . . 0.0 111.009 179.442 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -86.87 147.36 25.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.975 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.92 HD12 ' HD3' ' A' ' 16' ' ' ARG . 1.5 tt -130.01 159.44 42.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.802 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.733 HD12 ' HB2' ' A' ' 91' ' ' ARG . 0.4 OUTLIER -82.0 146.4 55.39 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.018 -179.908 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -62.51 -26.5 76.25 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.526 2.151 . . . . 0.0 112.508 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.733 ' HB2' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -60.7 -50.5 73.22 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.918 -179.968 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLN . . . . . 0.416 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 12.8 mm-40 -66.4 -41.52 89.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.943 0.401 . . . . 0.0 110.943 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -57.93 -53.75 54.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.739 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.37 -20.86 62.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.48 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' GLU . . . . . 0.416 ' HB2' ' HA ' ' A' ' 92' ' ' GLN . 1.7 tm-20 -60.14 -50.29 74.27 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 178.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 18.5 mm -73.02 -33.28 42.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.307 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.594 ' CZ3' HD23 ' A' ' 60' ' ' LEU . 4.2 t-105 -54.79 -36.56 65.05 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.881 178.966 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.679 ' OE1' HD11 ' A' ' 103' ' ' ILE . 1.9 mp0 -85.41 -31.16 23.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.584 179.342 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -56.78 -54.61 44.38 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.584 -179.245 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' CYS . . . . . 0.464 ' SG ' HD11 ' A' ' 60' ' ' LEU . 42.3 t -82.37 -79.14 0.19 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.032 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 170.34 38.25 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.557 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.516 ' CA ' HD22 ' A' ' 60' ' ' LEU . . . -58.97 -50.77 64.21 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.575 -0.822 . . . . 0.0 112.182 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.818 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.3 mp -56.37 -53.07 44.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.842 0.354 . . . . 0.0 111.092 179.716 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -56.37 -39.84 73.57 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.994 0.426 . . . . 0.0 110.336 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -65.19 -45.36 85.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.062 179.172 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.906 HD22 HD11 ' A' ' 110' ' ' ILE . 0.4 OUTLIER -62.05 -43.31 99.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.261 179.488 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.513 ' HG2' HD23 ' A' ' 124' ' ' LEU . 0.2 OUTLIER -63.31 -29.83 71.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.722 179.679 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 40.4 t -67.64 -50.53 57.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.705 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.441 ' HB1' ' HG3' ' A' ' 65' ' ' LYS . . . -72.81 -35.03 67.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.487 0.66 . . . . 0.0 109.503 178.911 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.906 HD11 HD22 ' A' ' 106' ' ' LEU . 13.4 mt -57.57 -49.49 80.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.456 179.285 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -72.34 -37.93 68.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.6 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 3.1 m -68.88 -13.39 62.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.073 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 77.26 30.81 0.51 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.902 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -100.75 -29.43 12.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.561 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ALA . . . . . 0.61 ' HB1' ' CG2' ' A' ' 121' ' ' THR . . . -80.88 143.05 33.0 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.927 179.863 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -99.51 118.63 61.85 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.795 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.62 88.68 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.529 2.153 . . . . 0.0 112.504 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 97.6 m -110.56 -70.3 0.82 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.557 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -147.7 -53.54 0.21 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.745 179.643 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.453 ' HB2' ' HE ' ' A' ' 48' ' ' ARG . . . -62.78 -44.66 95.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.875 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.61 ' CG2' ' HB1' ' A' ' 115' ' ' ALA . 0.7 OUTLIER -60.72 -49.1 78.85 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.466 179.702 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.8 -48.03 82.48 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.367 0.603 . . . . 0.0 110.153 179.142 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' MET . . . . . 0.596 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -55.57 -38.52 69.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.527 179.309 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.906 HD13 ' CD1' ' A' ' 106' ' ' LEU . 0.2 OUTLIER -65.67 -44.29 86.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.988 179.163 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -50.9 -39.59 54.62 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.924 179.151 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -81.44 -32.55 32.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.113 179.012 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.596 HD13 ' CE ' ' A' ' 123' ' ' MET . 1.7 tp -60.01 -19.74 54.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.489 179.131 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.4 mt . . . . . 0 C--N 1.332 -0.176 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.032 179.972 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.782 0.325 . . . . 0.0 110.878 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -70.24 130.34 41.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.072 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.462 ' HG3' ' CZ ' ' A' ' 119' ' ' TYR . 69.8 mm-40 -111.79 108.52 17.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.883 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.503 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 13.1 mtp180 -109.8 130.52 55.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.905 0.384 . . . . 0.0 110.915 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' PHE . . . . . 0.515 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 0.8 OUTLIER -115.67 134.85 54.63 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.996 179.879 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.616 ' HE2' HD21 ' A' ' 75' ' ' LEU . 5.9 m-85 -139.58 155.62 47.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.404 0.621 . . . . 0.0 112.313 -178.928 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.581 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.4 OUTLIER -149.26 144.86 26.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.519 179.122 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.72 HD11 HD13 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -136.13 125.58 15.94 Favored Pre-proline 0 C--N 1.327 -0.408 0 C-N-CA 120.893 -0.323 . . . . 0.0 111.834 -179.345 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.423 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 73.8 Cg_endo -89.2 96.92 0.34 Allowed 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.928 2.419 . . . . 0.0 111.664 179.337 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -119.17 153.81 34.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.973 0.416 . . . . 0.0 111.269 -179.457 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.618 HG21 ' HB2' ' A' ' 32' ' ' LYS . 11.2 mt -101.95 140.02 21.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.065 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.9 mtp180 -59.9 133.92 89.75 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.417 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.476 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 50.2 Cg_exo -53.59 -52.05 9.46 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.533 2.155 . . . . 0.0 113.0 -179.515 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.561 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -53.64 -58.78 5.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.522 -179.494 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.543 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 3.4 m-20 -67.71 -28.71 67.9 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.88 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.407 ' HB3' ' O ' ' A' ' 22' ' ' PRO . 0.1 OUTLIER -53.09 -57.34 10.73 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.599 -179.405 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.561 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.9 p90 -87.28 -17.19 33.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.562 -179.432 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.543 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -58.53 -53.23 60.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.899 0.381 . . . . 0.0 110.813 179.684 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -159.75 143.75 10.78 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.17 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -73.2 -7.96 21.31 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.604 2.203 . . . . 0.0 112.724 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -110.48 -36.59 5.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.901 0.382 . . . . 0.0 110.873 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -99.59 32.07 2.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.854 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.618 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -74.33 -30.04 61.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.935 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 42.6 mmtt 58.21 100.9 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.979 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.433 ' HG2' HG12 ' A' ' 20' ' ' ILE . 0.2 OUTLIER -85.0 119.79 25.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.917 179.966 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.422 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -105.85 143.79 15.75 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.907 -179.81 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.423 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 7.3 m-90 -108.99 137.44 46.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.811 0.338 . . . . 0.0 110.907 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.557 ' HZ3' HD21 ' A' ' 80' ' ' LEU . 31.9 t90 -118.79 117.22 28.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.5 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.858 ' CE1' HD12 ' A' ' 52' ' ' LEU . 22.1 m-85 -111.61 149.29 31.69 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.778 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.443 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.37 124.85 0.73 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.088 0.471 . . . . 0.0 111.294 179.815 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.515 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 9.7 t-160 -95.27 103.78 15.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.673 179.35 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.686 ' CE2' HG21 ' A' ' 78' ' ' THR . 4.4 m-85 -89.58 128.84 36.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.164 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.427 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 7.7 p-10 -96.65 114.43 26.07 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 178.623 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 58.23 -137.34 50.09 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.015 -1.088 . . . . 0.0 111.107 -178.505 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo -71.71 -16.46 29.95 Favored 'Trans proline' 0 CA--C 1.529 0.261 0 C-N-CA 122.503 2.135 . . . . 0.0 112.434 179.541 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' TRP . . . . . 0.408 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -114.73 -171.76 1.99 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.891 0.377 . . . . 0.0 111.804 -178.574 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.602 ' HB ' ' CD2' ' A' ' 41' ' ' PHE . 6.7 tt -131.24 153.86 39.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.875 -179.465 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.727 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -132.28 -20.59 2.39 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.811 -0.631 . . . . 0.0 112.317 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.745 ' NE ' ' HB2' ' A' ' 120' ' ' ALA . 4.6 mtm180 -129.03 136.26 50.06 Favored 'General case' 0 C--N 1.334 -0.079 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.052 -179.617 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.433 ' HB3' ' HB2' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -140.97 122.92 15.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.087 -179.958 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.557 ' SD ' HD11 ' A' ' 52' ' ' LEU . 5.2 ttm -125.07 112.59 16.69 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.7 179.732 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.506 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -95.27 133.29 39.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.099 -179.774 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.858 HD12 ' CE1' ' A' ' 38' ' ' TYR . 30.3 mt -135.13 108.77 7.96 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.735 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.422 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 1.7 m-70 -128.39 135.78 28.08 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 120.699 0.285 . . . . 0.0 111.057 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -54.21 -23.46 29.83 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.534 2.156 . . . . 0.0 112.161 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -104.5 -21.42 13.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.04 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.417 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 1.2 mmmm -119.12 125.17 27.78 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.754 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 56' ' ' LYS . 9.4 Cg_endo -52.75 167.58 0.6 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.49 2.126 . . . . 0.0 112.357 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.469 ' HA ' ' O ' ' A' ' 51' ' ' GLU . 20.0 Cg_endo -60.61 88.4 0.08 OUTLIER 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.718 2.279 . . . . 0.0 112.358 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.506 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 58.3 mt -64.97 105.83 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.814 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.678 HD21 ' N ' ' A' ' 102' ' ' GLY . 0.2 OUTLIER -82.11 122.74 28.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.02 -179.905 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.484 HD13 ' HB3' ' A' ' 69' ' ' GLU . 91.1 mt -134.83 151.25 50.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.93 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.8 p -154.2 148.16 13.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.071 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.727 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -60.39 140.17 57.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.957 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.97 -46.78 1.56 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.381 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.568 ' HG3' ' HB2' ' A' ' 109' ' ' ALA . 0.1 OUTLIER -92.32 -55.91 3.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.876 0.369 . . . . 0.0 110.69 179.835 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.45 ' HB3' HD22 ' A' ' 61' ' ' LEU . 1.6 m-20 -109.74 37.63 2.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.775 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -54.14 -28.71 41.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.048 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -83.42 -28.91 28.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.84 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.484 ' HB3' HD13 ' A' ' 61' ' ' LEU . 1.6 mm-40 -77.45 -51.12 11.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.922 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.52 ' HE1' ' N ' ' A' ' 63' ' ' ALA . 4.1 ptp -50.18 175.87 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.832 0.349 . . . . 0.0 111.179 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.7 ' SG ' HG22 ' A' ' 78' ' ' THR . 0.9 OUTLIER -55.64 -49.21 73.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.049 -179.86 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.423 ' CB ' ' O ' ' A' ' 71' ' ' CYS . 20.1 tt0 83.47 -40.58 0.09 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.345 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.614 ' HB2' HG23 ' A' ' 78' ' ' THR . 4.2 mmtt -56.28 -168.74 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.007 0.432 . . . . 0.0 111.13 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -109.78 -174.99 2.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.969 179.42 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.616 HD21 ' HE2' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -60.1 -53.96 51.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.708 0.289 . . . . 0.0 111.643 -179.406 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -71.03 -53.39 14.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.812 0.339 . . . . 0.0 111.846 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -49.08 -36.8 19.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.186 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' THR . . . . . 0.7 HG22 ' SG ' ' A' ' 71' ' ' CYS . 0.9 OUTLIER -62.26 -65.86 0.63 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.755 0.312 . . . . 0.0 111.22 -179.569 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 130.43 -5.47 5.92 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.901 -179.665 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.72 HD13 HD11 ' A' ' 17' ' ' ILE . 3.8 mm? -53.26 -40.32 64.55 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.142 0.496 . . . . 0.0 110.23 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' THR . . . . . 0.452 HG23 HD12 ' A' ' 75' ' ' LEU . 11.4 p -81.05 -33.09 33.74 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.599 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -56.06 -32.26 63.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.558 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.423 ' CD ' ' CG2' ' A' ' 17' ' ' ILE . 1.9 tttp -72.27 179.81 3.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.732 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -96.73 75.25 2.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.893 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 80.42 67.47 1.55 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.631 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.596 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -97.93 20.15 12.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.771 0.32 . . . . 0.0 111.217 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -89.18 151.14 22.34 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.157 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.581 HG21 ' HB3' ' A' ' 16' ' ' ARG . 1.5 pt -133.83 159.44 42.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.11 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.626 HD23 ' H ' ' A' ' 89' ' ' LEU . 0.7 OUTLIER -72.69 151.71 91.32 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.861 179.912 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -72.5 -24.72 18.7 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.765 2.31 . . . . 0.0 112.815 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.549 ' HB3' HD12 ' A' ' 89' ' ' LEU . 0.1 OUTLIER -64.72 -46.78 80.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.75 -179.809 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -67.68 -38.45 83.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.768 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -57.98 -53.23 60.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.817 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -72.28 -21.86 61.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.644 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.26 -50.49 73.82 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.061 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.41 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 17.2 mm -73.0 -33.73 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.168 178.813 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' TRP . . . . . 0.464 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 10.3 t-105 -53.78 -39.28 65.29 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.097 179.071 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -85.92 -27.2 25.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.8 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.41 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 5.8 mtm180 -56.59 -43.97 80.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.098 -179.797 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 42.5 t -93.89 -79.61 0.41 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.871 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.528 ' C ' HD21 ' A' ' 60' ' ' LEU . . . 176.12 36.77 0.05 OUTLIER Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.569 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.678 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -59.33 -50.73 64.6 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.391 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.809 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.3 mp -57.66 -50.01 78.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 120.761 0.315 . . . . 0.0 111.13 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -56.29 -44.41 79.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.933 0.397 . . . . 0.0 110.51 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -62.13 -46.29 89.68 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.14 179.342 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' LEU . . . . . 0.952 HD13 HD13 ' A' ' 124' ' ' LEU . 0.5 OUTLIER -62.02 -40.48 95.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.338 179.486 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.485 ' HG2' HD23 ' A' ' 124' ' ' LEU . 0.1 OUTLIER -64.05 -29.75 70.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.687 179.545 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 35.7 t -69.28 -50.31 48.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.658 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.568 ' HB2' ' HG3' ' A' ' 65' ' ' LYS . . . -72.54 -35.33 68.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.452 0.644 . . . . 0.0 109.567 178.998 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.824 HD11 HD22 ' A' ' 106' ' ' LEU . 13.1 mt -58.26 -49.4 81.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.426 179.195 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -72.56 -38.6 67.91 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.597 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 1.7 m -66.6 -15.67 63.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.184 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 77.16 34.97 0.37 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.972 0.415 . . . . 0.0 110.89 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 49.6 mm-40 -107.16 -28.19 10.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.626 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.67 151.25 39.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.029 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -107.38 108.98 62.49 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.95 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' PRO . . . . . 0.433 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 81.8 Cg_exo -46.29 92.18 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.68 2.253 . . . . 0.0 112.699 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.701 HG21 ' HB2' ' A' ' 47' ' ' ALA . 14.2 m -112.72 -55.69 2.49 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.742 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' TYR . . . . . 0.462 ' CZ ' ' HG3' ' A' ' 12' ' ' GLN . 51.0 t80 -166.55 -57.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.909 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.745 ' HB2' ' NE ' ' A' ' 48' ' ' ARG . . . -54.51 -43.08 71.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.054 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' THR . . . . . 0.468 HG22 ' CD2' ' A' ' 106' ' ' LEU . 9.2 p -58.41 -49.0 78.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.425 179.644 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.98 -49.95 75.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.38 0.61 . . . . 0.0 109.6 178.807 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' MET . . . . . 0.709 ' HE1' HD13 ' A' ' 127' ' ' LEU . 2.2 tmm? -55.95 -30.85 62.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.069 178.915 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.952 HD13 HD13 ' A' ' 106' ' ' LEU . 0.2 OUTLIER -70.02 -46.52 64.91 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.852 178.979 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 59.6 mm-40 -51.45 -38.65 54.79 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.027 179.142 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -77.82 -36.03 50.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.05 179.241 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.709 HD13 ' HE1' ' A' ' 123' ' ' MET . 0.4 OUTLIER -61.34 -18.2 57.51 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.408 178.937 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.603 ' O ' HD12 ' A' ' 128' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.162 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.953 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.842 0.353 . . . . 0.0 111.092 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.862 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -54.22 -56.91 13.7 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.703 179.813 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.16 -36.77 78.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.052 179.415 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.421 ' HA ' ' NE2' ' A' ' 4' ' ' GLN . 5.4 tp60 -56.31 -33.84 65.96 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.334 179.588 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.1 -57.15 4.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.059 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.872 HG12 ' HB2' ' A' ' 122' ' ' ALA . 3.6 mp -56.49 -62.27 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.942 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 24.1 t0 48.15 93.53 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.217 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 2.0 mtm -78.78 65.39 3.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.61 0.719 . . . . 0.0 110.676 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.5 mttm -146.45 36.88 1.0 Allowed 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.777 -1.101 . . . . 0.0 110.955 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.434 ' O ' ' NE2' ' A' ' 12' ' ' GLN . 0.0 OUTLIER -123.47 -175.78 3.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.792 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.49 138.43 35.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.784 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.462 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 3.7 mp0 -124.5 115.76 21.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.994 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.473 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 8.1 mmt85 -134.58 130.79 37.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.002 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.519 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 0.2 OUTLIER -121.58 137.61 54.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.133 179.792 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.636 ' CZ ' HD11 ' A' ' 75' ' ' LEU . 0.1 OUTLIER -144.09 167.01 23.39 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.292 0.567 . . . . 0.0 112.007 -179.824 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.452 ' CD ' HG21 ' A' ' 88' ' ' ILE . 7.2 ptm180 -149.09 153.47 37.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.525 178.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -153.47 113.39 2.62 Favored Pre-proline 0 C--N 1.328 -0.365 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.612 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.429 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 75.5 Cg_endo -87.65 98.97 0.45 Allowed 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 123.026 2.484 . . . . 0.0 112.214 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -118.53 141.83 48.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.96 0.409 . . . . 0.0 111.076 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.547 HG21 ' HB2' ' A' ' 32' ' ' LYS . 14.6 mt -87.1 147.41 5.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.217 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.428 ' HD2' ' CE1' ' A' ' 53' ' ' HIS . 5.4 mtt180 -69.17 133.47 89.64 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.985 179.259 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.502 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 12.0 Cg_endo -55.76 -49.27 16.31 Favored 'Trans proline' 0 N--CA 1.464 -0.215 0 C-N-CA 122.524 2.15 . . . . 0.0 112.462 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.553 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -51.17 -58.69 5.48 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.307 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.51 ' HA ' ' CG ' ' A' ' 27' ' ' LYS . 1.2 m-20 -69.68 -30.29 67.91 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.094 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.439 ' HB3' ' HA ' ' A' ' 22' ' ' PRO . 0.0 OUTLIER -53.17 -46.15 68.81 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.668 -179.065 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.553 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.3 p90 -98.85 -36.45 9.78 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -177.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.511 ' HG2' ' O ' ' A' ' 23' ' ' ALA . 6.5 ptmt -60.95 -32.23 71.77 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.537 -0.465 . . . . 0.0 111.303 -178.854 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.432 ' CB ' ' HB2' ' A' ' 31' ' ' ASN . 43.4 m-20 -155.56 117.13 2.32 Favored Pre-proline 0 C--N 1.329 -0.316 0 C-N-CA 121.014 -0.274 . . . . 0.0 111.426 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -66.69 -24.4 47.76 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.418 2.078 . . . . 0.0 112.187 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.1 mp0 -94.58 -43.17 8.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.636 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.432 ' HB2' ' CB ' ' A' ' 28' ' ' ASP . 27.3 m-80 -88.16 53.96 2.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.439 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.547 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -119.62 70.19 0.85 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.253 -179.563 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.9 mmpt? -40.9 133.27 2.17 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.246 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.52 124.21 41.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.719 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -99.68 129.35 9.87 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.586 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.481 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 21.3 m-90 -102.03 124.79 48.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.955 0.407 . . . . 0.0 110.728 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.534 ' HZ3' HD22 ' A' ' 80' ' ' LEU . 82.6 t90 -114.69 117.01 29.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.149 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.701 ' CE1' HD12 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -117.84 148.89 41.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.087 179.216 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.653 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -157.31 124.68 5.23 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.126 0.489 . . . . 0.0 111.723 -179.104 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.519 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 9.5 t-160 -97.64 93.38 6.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.066 178.75 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.641 ' CZ ' HG21 ' A' ' 78' ' ' THR . 21.7 m-85 -77.53 149.36 34.92 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.535 -179.025 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.485 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 86.8 m-20 -122.83 110.81 15.91 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.08 178.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.535 ' O ' HD23 ' A' ' 75' ' ' LEU . . . 61.9 -134.01 46.54 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 119.921 -1.133 . . . . 0.0 111.074 -178.387 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.407 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.4 Cg_exo -73.68 -14.65 24.51 Favored 'Trans proline' 0 CA--C 1.53 0.294 0 C-N-CA 122.448 2.099 . . . . 0.0 112.644 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' TRP . . . . . 0.414 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.6 OUTLIER -121.93 -162.89 1.02 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.665 -178.413 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.798 HD11 ' O ' ' A' ' 48' ' ' ARG . 2.2 tt -135.21 154.45 35.85 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.129 0 CA-C-O 121.028 0.442 . . . . 0.0 111.688 -179.661 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.423 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -126.55 -19.14 4.65 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.267 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.798 ' O ' HD11 ' A' ' 46' ' ' ILE . 7.2 mtm180 -128.73 133.56 48.17 Favored 'General case' 0 C--O 1.23 0.055 0 CA-C-O 120.951 0.405 . . . . 0.0 111.084 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.509 ' HG2' HD12 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -142.08 137.53 31.08 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.924 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.488 ' HG3' ' HB2' ' A' ' 38' ' ' TYR . 0.6 OUTLIER -146.82 128.5 15.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.614 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.401 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 2.5 mt-10 -117.36 138.76 51.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.196 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.701 HD12 ' CE1' ' A' ' 38' ' ' TYR . 4.7 mt -135.12 120.77 19.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.055 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.428 ' CE1' ' HD2' ' A' ' 21' ' ' ARG . 0.3 OUTLIER -133.61 131.62 21.37 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.5 179.701 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -48.21 -27.05 8.93 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.639 2.226 . . . . 0.0 112.697 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -106.66 -13.87 15.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.27 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.62 120.97 30.25 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.797 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -49.83 168.21 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.585 2.19 . . . . 0.0 112.506 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -60.32 96.96 0.11 Allowed 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.552 2.168 . . . . 0.0 112.405 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.401 ' HB ' ' HB2' ' A' ' 51' ' ' GLU . 7.8 mt -79.1 96.04 2.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.079 0.466 . . . . 0.0 110.755 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.544 HD23 ' CZ3' ' A' ' 97' ' ' TRP . 1.0 OUTLIER -86.83 116.37 24.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.797 -179.903 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.565 HD13 ' HB3' ' A' ' 69' ' ' GLU . 20.1 mt -119.76 151.89 38.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.952 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.885 HG22 ' CE2' ' A' ' 105' ' ' TYR . 16.1 m -143.42 158.5 17.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.114 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.47 148.22 52.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.126 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.51 -55.6 4.18 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.526 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.476 ' HE2' ' HB2' ' A' ' 109' ' ' ALA . 3.4 mttm -80.28 -67.02 0.81 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.864 0.364 . . . . 0.0 110.871 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -97.24 39.82 1.17 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.819 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.85 -28.63 61.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.016 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -82.88 -27.18 30.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.901 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.565 ' HB3' HD13 ' A' ' 61' ' ' LEU . 0.4 OUTLIER -82.45 -54.39 5.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.102 -179.829 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.0 ptp -56.59 174.32 0.15 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.096 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.83 128.12 35.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.989 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.17 43.18 1.41 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.798 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.31 131.45 16.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.801 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -53.96 167.82 0.25 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.017 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.636 HD11 ' CZ ' ' A' ' 15' ' ' PHE . 2.6 mm? -44.04 -53.57 6.2 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.155 -179.342 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -70.38 -32.03 69.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.966 -179.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -80.09 -11.17 59.79 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.82 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.714 ' CG2' HD21 ' A' ' 80' ' ' LEU . 0.1 OUTLIER -74.41 -67.19 0.65 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.88 0.372 . . . . 0.0 111.054 -179.947 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 124.84 -27.94 5.3 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.287 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.714 HD21 ' CG2' ' A' ' 78' ' ' THR . 0.0 OUTLIER -59.55 -35.0 73.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.999 0.428 . . . . 0.0 110.382 179.684 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.439 ' CG2' HD12 ' A' ' 75' ' ' LEU . 0.6 OUTLIER -66.47 -40.97 89.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.56 179.595 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 13.8 mtt180 -67.35 -28.86 68.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.857 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.7 mtpt -55.28 -176.41 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.972 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.44 76.74 5.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.206 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 72.56 66.83 1.97 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.968 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -83.83 -17.62 40.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.764 0.316 . . . . 0.0 110.954 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.446 ' HA ' ' O ' ' A' ' 14' ' ' PHE . 0.6 OUTLIER -52.27 160.16 0.84 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.932 0.396 . . . . 0.0 111.645 -179.708 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.656 HD12 ' O ' ' A' ' 89' ' ' LEU . 1.5 pp -149.73 -179.72 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.899 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.656 ' O ' HD12 ' A' ' 88' ' ' ILE . 1.2 mp -98.69 148.18 34.2 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.668 179.637 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -65.64 -22.0 58.4 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.62 2.213 . . . . 0.0 112.443 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.33 -40.32 93.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.046 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -69.85 -45.57 67.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.905 0.383 . . . . 0.0 110.936 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.431 ' CZ ' ' HB3' ' A' ' 48' ' ' ARG . 14.0 t80 -57.38 -51.59 68.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.746 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.03 -22.83 63.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.78 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.11 -50.45 71.85 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.123 0.487 . . . . 0.0 109.793 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.467 HG21 HD11 ' A' ' 52' ' ' LEU . 20.6 mm -76.98 -33.97 21.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.757 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.544 ' CZ3' HD23 ' A' ' 60' ' ' LEU . 3.4 t-105 -52.42 -41.13 62.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.997 179.464 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -86.33 -30.55 22.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.633 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.423 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -56.83 -29.88 63.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.341 -179.694 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 16.2 m -107.23 -77.9 0.59 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.201 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 172.85 33.57 0.03 OUTLIER Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.621 -0.799 . . . . 0.0 112.743 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.478 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -60.08 -48.54 85.61 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.311 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.942 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.6 mp -52.86 -42.53 43.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.816 0.341 . . . . 0.0 111.102 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -60.91 -44.86 96.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.018 0.437 . . . . 0.0 110.282 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.885 ' CE2' HG22 ' A' ' 62' ' ' VAL . 10.6 t80 -62.58 -43.12 99.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.359 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.884 ' CD1' HD13 ' A' ' 124' ' ' LEU . 0.5 OUTLIER -66.0 -44.6 84.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.89 179.883 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.542 ' CD ' HD21 ' A' ' 128' ' ' LEU . 1.5 mt-30 -61.11 -29.92 70.05 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.987 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.61 -50.44 30.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.894 -179.743 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.617 ' HB3' ' HB2' ' A' ' 115' ' ' ALA . . . -72.41 -31.66 65.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.443 0.64 . . . . 0.0 109.746 179.159 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.754 HD11 HD22 ' A' ' 106' ' ' LEU . 9.3 mt -57.91 -49.01 82.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-N 115.063 -0.972 . . . . 0.0 110.448 179.263 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -70.61 -36.71 73.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.605 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 6.4 p -77.45 -6.61 54.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.214 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 27.6 mmt85 67.89 31.54 5.65 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.864 0.364 . . . . 0.0 110.9 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -107.94 -28.85 9.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.665 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.617 ' HB2' ' HB3' ' A' ' 109' ' ' ALA . . . -59.12 -21.54 59.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.329 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 65.35 82.09 0.21 Allowed Pre-proline 0 C--N 1.332 -0.171 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.851 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.432 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 1.1 Cg_endo -45.36 97.48 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.854 2.37 . . . . 0.0 112.46 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 19.3 m -117.34 -55.81 2.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.91 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.503 ' HA ' HG23 ' A' ' 6' ' ' ILE . 8.2 t80 -160.32 -52.26 0.05 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.189 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.613 ' HB2' ' HE ' ' A' ' 48' ' ' ARG . . . -56.87 -41.88 78.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.313 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.697 HG22 ' CD2' ' A' ' 106' ' ' LEU . 80.6 p -57.93 -49.25 77.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.559 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.872 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -61.24 -49.02 78.8 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.353 0.597 . . . . 0.0 109.56 178.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -57.49 -32.56 67.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.855 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.942 HD11 ' HA ' ' A' ' 103' ' ' ILE . 0.4 OUTLIER -68.6 -46.1 70.22 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.026 179.035 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.696 ' HA ' HD12 ' A' ' 128' ' ' LEU . 28.1 mm100 -51.47 -39.54 57.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.804 -0.634 . . . . 0.0 109.974 179.199 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 43.2 m-20 -78.94 -32.1 45.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.292 179.096 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.2 tp -74.14 -7.34 52.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.925 179.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.696 HD12 ' HA ' ' A' ' 125' ' ' GLN . 38.6 mt -75.34 -25.13 57.52 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.098 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.158 -0.925 . . . . 0.0 111.007 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.774 ' HB1' ' HB2' ' A' ' 4' ' ' GLN . . . . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.883 0.373 . . . . 0.0 110.953 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.928 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -61.3 -64.27 1.0 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.679 179.78 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 3.0 tp60 -53.38 -41.49 65.95 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.727 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.774 ' HB2' ' HB1' ' A' ' 1' ' ' ALA . 10.1 mm100 -59.76 -32.07 70.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.588 179.635 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.459 ' HG3' ' HB2' ' A' ' 117' ' ' PRO . 1.5 tp10 -76.41 -50.75 13.35 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.837 179.446 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.928 HD12 ' O ' ' A' ' 2' ' ' ARG . 3.0 mp -58.67 -63.06 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.407 0.622 . . . . 0.0 109.987 178.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.6 t70 46.75 91.12 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.503 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.449 ' HG2' ' CD2' ' A' ' 119' ' ' TYR . 0.0 OUTLIER -67.02 -80.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.787 179.921 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.2 mmtp 48.11 43.67 18.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.274 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 84.8 mtt-85 -151.34 162.87 40.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.996 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -76.44 163.67 26.73 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.818 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.5 mp0 -121.43 103.0 8.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.041 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.486 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -116.99 122.09 43.25 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.613 -179.88 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.506 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 2.2 m-85 -108.51 148.71 29.84 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.677 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.571 ' HB2' HD22 ' A' ' 80' ' ' LEU . 1.8 m-85 -146.74 149.57 33.65 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.38 0.609 . . . . 0.0 112.186 -179.449 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.445 ' HG3' ' CE2' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -148.69 136.67 20.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.229 179.198 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.649 HG23 ' HB1' ' A' ' 86' ' ' ALA . 0.5 OUTLIER -141.67 131.91 12.86 Favored Pre-proline 0 C--N 1.329 -0.305 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.252 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -90.52 115.52 0.52 Allowed 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 123.183 2.589 . . . . 0.0 111.722 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.438 ' N ' ' CD1' ' A' ' 19' ' ' PHE . 2.1 p90 -134.08 149.56 51.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.89 0.376 . . . . 0.0 110.908 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.581 HG21 ' HB2' ' A' ' 32' ' ' LYS . 12.3 mt -98.77 140.59 18.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.122 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.5 mtp180 -65.01 124.53 86.96 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.296 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.487 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 86.2 Cg_exo -46.43 -50.36 10.41 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.523 2.149 . . . . 0.0 112.853 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.565 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -50.24 -58.46 5.56 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.118 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.529 ' HA ' ' CG ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -68.66 -31.37 70.45 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.161 179.838 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.455 ' HB3' ' HA ' ' A' ' 22' ' ' PRO . 0.0 OUTLIER -53.07 -45.48 68.14 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.757 -178.994 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.565 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.2 p90 -98.08 -36.6 10.04 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -177.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.529 ' CG ' ' HA ' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -59.88 -31.88 70.2 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.353 -179.068 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.443 ' CB ' ' HB2' ' A' ' 31' ' ' ASN . 28.0 m-20 -153.59 125.67 3.84 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 120.835 -0.346 . . . . 0.0 111.475 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -72.97 -28.73 12.77 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.487 2.125 . . . . 0.0 112.014 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.4 mm-40 -94.02 -44.04 8.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.449 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.443 ' HB2' ' CB ' ' A' ' 28' ' ' ASP . 44.5 m-20 -85.67 55.14 3.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.409 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.581 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -122.33 68.77 0.95 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.089 -179.707 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.5 mmpt? -41.5 135.72 2.0 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.123 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.15 109.84 22.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.856 -179.553 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.407 ' O ' ' CD1' ' A' ' 19' ' ' PHE . . . -83.76 123.63 6.26 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.332 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 8.1 m-90 -98.13 132.57 43.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.796 0.331 . . . . 0.0 110.784 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.711 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 27.2 t90 -114.06 117.86 32.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.259 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.908 ' CE1' HD12 ' A' ' 52' ' ' LEU . 3.3 m-85 -110.1 149.72 29.63 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.006 179.345 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.615 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -170.34 124.81 0.73 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.162 0.506 . . . . 0.0 112.132 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.506 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 20.1 t-160 -96.9 99.62 11.17 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.623 178.771 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.731 ' CZ ' HG21 ' A' ' 78' ' ' THR . 18.3 m-85 -85.65 119.95 26.54 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.497 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.448 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 12.1 p-10 -88.18 110.86 21.03 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.327 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.38 -136.29 49.48 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 119.954 -1.117 . . . . 0.0 110.842 -178.16 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_exo -72.09 -16.46 28.69 Favored 'Trans proline' 0 CA--C 1.531 0.33 0 C-N-CA 122.407 2.071 . . . . 0.0 112.335 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' TRP . . . . . 0.414 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.8 OUTLIER -115.81 -173.51 2.36 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.773 0.32 . . . . 0.0 111.795 -178.491 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.615 HD12 ' HB1' ' A' ' 39' ' ' ALA . 3.6 tt -131.02 153.04 38.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 121.227 0.537 . . . . 0.0 112.211 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.449 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -130.33 -22.6 2.76 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.739 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.576 ' O ' HD11 ' A' ' 46' ' ' ILE . 5.2 ttt180 -127.88 140.3 52.1 Favored 'General case' 0 N--CA 1.461 0.084 0 CA-C-O 120.778 0.323 . . . . 0.0 111.159 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.546 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 18.0 tt0 -153.44 136.39 15.45 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.003 0.43 . . . . 0.0 111.136 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.412 ' HG2' ' CZ3' ' A' ' 97' ' ' TRP . 0.0 OUTLIER -136.61 132.65 35.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.63 179.724 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.483 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 0.3 OUTLIER -119.32 125.91 50.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.815 179.865 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.908 HD12 ' CE1' ' A' ' 38' ' ' TYR . 0.8 OUTLIER -125.54 113.53 17.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.965 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.415 ' NE2' HD12 ' A' ' 59' ' ' ILE . 21.1 m-70 -122.23 133.89 24.56 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.703 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -50.69 -24.35 12.87 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.405 2.07 . . . . 0.0 112.518 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -106.38 -22.15 12.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.244 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 4.9 mmtt -115.18 125.95 28.34 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.985 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -49.49 167.55 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.425 2.083 . . . . 0.0 112.614 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.433 ' HB3' HD23 ' A' ' 52' ' ' LEU . 37.4 Cg_exo -60.89 84.07 0.08 OUTLIER 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.715 2.277 . . . . 0.0 112.418 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.564 HG22 HD23 ' A' ' 61' ' ' LEU . 21.5 mt -60.44 106.73 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.679 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.469 ' HG ' ' CH2' ' A' ' 97' ' ' TRP . 0.9 OUTLIER -83.86 117.31 23.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.949 -179.78 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.883 HD11 ' CB ' ' A' ' 69' ' ' GLU . 1.5 mm? -117.14 146.86 42.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.786 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.536 HG21 HD21 ' A' ' 106' ' ' LEU . 13.5 p -155.11 156.66 4.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.338 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.449 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -72.66 138.79 46.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.758 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.4 ' CA ' ' HD3' ' A' ' 116' ' ' ARG . . . 91.21 -62.74 2.82 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.242 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.446 ' HB2' ' HA ' ' A' ' 115' ' ' ALA . 2.2 tmtp? -67.4 -35.16 78.74 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.992 0.425 . . . . 0.0 110.512 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.5 ' CB ' HD13 ' A' ' 61' ' ' LEU . 71.9 m-20 -134.43 58.23 1.78 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.776 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -66.91 -21.6 65.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.35 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -85.34 -38.79 18.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.838 0.352 . . . . 0.0 110.871 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.883 ' CB ' HD11 ' A' ' 61' ' ' LEU . 0.3 OUTLIER -80.13 -33.82 38.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.896 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -48.66 170.09 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.021 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.622 ' SG ' HG22 ' A' ' 78' ' ' THR . 9.3 t -64.47 -40.75 96.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.184 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 77.09 -66.44 0.24 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.947 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.43 171.7 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.314 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -96.78 -169.67 1.92 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.668 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.716 ' HB3' HG21 ' A' ' 81' ' ' THR . 64.9 mt -66.28 -44.75 82.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.585 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -70.06 -31.21 68.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.462 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -85.31 -24.35 27.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.613 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.731 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.7 OUTLIER -63.81 -77.04 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.758 0.313 . . . . 0.0 111.196 -179.781 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.402 ' HA2' ' CG ' ' A' ' 82' ' ' ARG . . . 140.49 -18.17 2.85 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.55 -0.833 . . . . 0.0 113.104 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.711 HD21 ' CZ3' ' A' ' 37' ' ' TRP . 0.6 OUTLIER -65.82 -51.21 60.86 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.929 0.395 . . . . 0.0 110.828 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.716 HG21 ' HB3' ' A' ' 75' ' ' LEU . 54.8 p -56.02 -52.69 63.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.153 -179.766 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.402 ' CG ' ' HA2' ' A' ' 79' ' ' GLY . 1.4 ppt_? -62.29 -27.71 69.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.67 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 10.7 tttt -59.95 -168.56 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.796 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -90.91 77.79 6.12 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.536 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 55.04 69.12 1.36 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.327 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.649 ' HB1' HG23 ' A' ' 17' ' ' ILE . . . -89.6 22.54 2.97 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.98 179.51 4.91 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.761 0.315 . . . . 0.0 110.721 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.511 HG22 ' CA ' ' A' ' 15' ' ' PHE . 3.8 tt -159.58 159.07 2.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.074 0.464 . . . . 0.0 111.103 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.572 ' H ' HD12 ' A' ' 89' ' ' LEU . 4.2 mp -73.42 146.41 86.37 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.811 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.5 -30.8 14.62 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.533 2.155 . . . . 0.0 112.309 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.71 -38.48 73.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.935 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -69.23 -48.28 62.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.845 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.404 ' CZ ' ' CG ' ' A' ' 50' ' ' MET . 14.2 t80 -55.23 -52.97 61.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.549 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -22.68 64.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.478 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -50.37 73.97 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.172 0.511 . . . . 0.0 109.687 179.164 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.41 ' HB ' ' CE ' ' A' ' 50' ' ' MET . 18.2 mm -71.47 -32.96 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.323 179.24 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.469 ' CH2' ' HG ' ' A' ' 60' ' ' LEU . 16.9 t-105 -57.69 -36.74 72.35 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.752 178.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.623 ' HG3' HD11 ' A' ' 103' ' ' ILE . 1.0 OUTLIER -85.11 -25.69 27.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.227 179.136 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 25.0 ttt85 -61.56 -53.62 53.98 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.272 -179.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -81.2 -84.66 0.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.084 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -173.44 36.39 0.13 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.444 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.463 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -54.31 -61.3 7.35 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.538 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.904 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.1 mp -55.31 -46.31 78.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.695 0.283 . . . . 0.0 111.681 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -58.99 -49.26 78.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.941 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.426 ' HB3' HD23 ' A' ' 60' ' ' LEU . 54.4 t80 -60.76 -50.91 71.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.411 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.588 HD12 HD11 ' A' ' 110' ' ' ILE . 0.3 OUTLIER -57.65 -44.79 85.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.787 179.695 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.402 ' HG2' ' CD2' ' A' ' 124' ' ' LEU . 1.8 mm100 -61.43 -29.93 70.25 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.844 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 32.6 t -68.31 -50.67 51.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.968 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.444 ' HB1' ' HB2' ' A' ' 114' ' ' GLN . . . -75.13 -32.37 61.33 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.307 0.575 . . . . 0.0 109.784 179.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.655 HD11 ' HA ' ' A' ' 121' ' ' THR . 7.0 mt -57.71 -48.68 82.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.264 179.353 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -72.42 -36.06 68.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.72 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.5 -8.31 56.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.327 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 15.6 mmt85 72.0 46.6 0.34 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.005 0.431 . . . . 0.0 110.958 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLN . . . . . 0.444 ' HB2' ' HB1' ' A' ' 109' ' ' ALA . 9.2 mm-40 -122.37 -40.41 2.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.67 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.446 ' HA ' ' HB2' ' A' ' 65' ' ' LYS . . . -59.3 -19.88 49.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.413 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.4 ' HD3' ' CA ' ' A' ' 64' ' ' GLY . 26.8 mtp180 62.96 118.1 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.577 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.459 ' HB2' ' HG3' ' A' ' 5' ' ' GLU . 72.3 Cg_exo -49.22 90.9 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.409 2.073 . . . . 0.0 112.625 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 10.8 t -119.35 -165.07 1.11 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.513 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.449 ' CD2' ' HG2' ' A' ' 8' ' ' MET . 13.9 t80 -64.45 -47.62 78.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.733 0.302 . . . . 0.0 110.778 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -60.06 -52.08 66.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.273 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.655 ' HA ' HD11 ' A' ' 110' ' ' ILE . 80.3 p -57.83 -49.13 77.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.594 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.563 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -57.25 -54.02 51.47 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.525 0.679 . . . . 0.0 109.721 179.024 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' MET . . . . . 0.64 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -56.25 -35.41 67.37 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.778 178.663 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.904 HD11 ' HA ' ' A' ' 103' ' ' ILE . 0.3 OUTLIER -65.47 -44.95 85.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.825 178.763 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 60.8 mm-40 -49.97 -44.21 50.61 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.279 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -83.86 -23.71 31.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.782 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.64 HD13 ' CE ' ' A' ' 123' ' ' MET . 4.4 tp -65.73 -19.68 65.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.743 0.306 . . . . 0.0 110.502 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.582 ' O ' HD12 ' A' ' 128' ' ' LEU . 0.9 OUTLIER -126.54 75.82 1.58 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.133 -179.924 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 8.4 mmtp . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.934 179.951 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.887 ' HB1' ' HB2' ' A' ' 4' ' ' GLN . . . . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.879 0.371 . . . . 0.0 110.978 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.923 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -65.65 -67.16 0.46 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.878 179.936 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -53.68 -42.42 67.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.719 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.887 ' HB2' ' HB1' ' A' ' 1' ' ' ALA . 10.3 mm100 -59.05 -35.6 73.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.692 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.03 -52.29 14.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.255 -0.429 . . . . 0.0 109.919 179.525 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.923 HD12 ' O ' ' A' ' 2' ' ' ARG . 2.7 mp -58.26 -63.69 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.071 178.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.4 t0 44.65 91.08 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.214 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.406 ' HG2' ' CD2' ' A' ' 119' ' ' TYR . 0.0 OUTLIER -56.23 -81.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.931 -179.895 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.9 mmtt 47.71 44.8 17.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.318 179.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -155.01 176.47 12.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.175 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.51 156.73 21.55 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.994 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 67.2 mm-40 -131.22 107.46 9.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.027 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.736 ' HD3' HD21 ' A' ' 75' ' ' LEU . 3.0 mtp180 -127.49 139.53 52.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.847 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.515 ' CE2' ' CG ' ' A' ' 40' ' ' HIS . 0.7 OUTLIER -122.47 135.03 54.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.3 -179.652 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.635 ' HB2' HD22 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -138.9 154.93 48.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.288 0.566 . . . . 0.0 111.926 -179.218 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.779 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.22 144.16 26.37 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.608 179.525 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.638 HG21 ' HG2' ' A' ' 83' ' ' LYS . 0.5 OUTLIER -148.97 132.17 8.22 Favored Pre-proline 0 C--N 1.329 -0.301 0 C-N-CA 120.851 -0.34 . . . . 0.0 111.784 -179.693 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.475 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 64.6 Cg_endo -91.65 111.54 0.31 Allowed 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 123.11 2.54 . . . . 0.0 112.25 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.0 p90 -131.11 140.74 50.05 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.795 0.331 . . . . 0.0 110.83 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.647 HD11 ' NZ ' ' A' ' 34' ' ' LYS . 9.3 mt -84.7 143.4 11.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.051 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.401 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 0.0 OUTLIER -64.77 124.73 87.2 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.5 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.636 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 72.1 Cg_exo -39.5 -55.13 1.68 Allowed 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.956 2.437 . . . . 0.0 112.938 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.681 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -44.83 -58.16 3.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.636 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.486 ' HA ' ' CG ' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -63.73 -34.65 78.35 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.969 -178.907 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.636 ' HG3' ' HA ' ' A' ' 22' ' ' PRO . 0.9 OUTLIER -54.99 -51.29 66.67 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -178.393 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.681 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 0.9 OUTLIER -88.23 -40.52 13.6 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -177.862 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.53 ' HG2' ' O ' ' A' ' 23' ' ' ALA . 12.3 ptmt -58.74 -33.01 69.77 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.716 -178.723 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -160.52 123.31 1.85 Allowed Pre-proline 0 C--N 1.328 -0.338 0 C-N-CA 120.766 -0.373 . . . . 0.0 111.606 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -73.13 -25.67 15.72 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.571 2.18 . . . . 0.0 112.206 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -93.06 -44.34 8.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.461 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -88.0 54.44 3.09 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.443 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.534 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -123.5 64.64 1.02 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.489 -179.384 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.84 143.01 5.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.618 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.647 ' NZ ' HD11 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -97.06 157.97 15.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.085 0.469 . . . . 0.0 111.592 -179.352 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -130.07 132.23 6.91 Favored Glycine 0 N--CA 1.451 -0.326 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.966 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.475 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 22.1 m-90 -97.75 131.09 44.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.879 0.371 . . . . 0.0 111.228 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.585 ' CZ3' HD11 ' A' ' 80' ' ' LEU . 39.2 t90 -115.35 117.65 31.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.085 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.809 ' CE1' HD12 ' A' ' 52' ' ' LEU . 1.6 m-85 -109.91 156.9 19.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.055 179.371 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.63 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.37 124.49 0.72 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.126 0.489 . . . . 0.0 111.906 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.515 ' CG ' ' CE2' ' A' ' 14' ' ' PHE . 11.0 t-160 -97.0 92.41 6.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.288 178.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.551 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 8.8 m-85 -74.47 155.76 37.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.077 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.56 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.7 OUTLIER -125.08 110.91 14.72 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.812 -0.811 . . . . 0.0 108.812 178.957 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 59.06 -133.84 52.52 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 119.706 -1.235 . . . . 0.0 110.678 -177.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -72.53 -19.6 24.58 Favored 'Trans proline' 0 CA--C 1.532 0.394 0 C-N-CA 122.359 2.039 . . . . 0.0 112.133 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' TRP . . . . . 0.439 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.7 OUTLIER -113.17 -160.12 0.71 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.567 -178.756 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.838 HD11 ' O ' ' A' ' 48' ' ' ARG . 7.6 tt -140.75 155.74 22.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-O 121.084 0.469 . . . . 0.0 111.849 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.418 ' O ' ' HE1' ' A' ' 70' ' ' MET . . . -128.65 -16.08 4.33 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.712 -0.676 . . . . 0.0 112.197 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.838 ' O ' HD11 ' A' ' 46' ' ' ILE . 4.2 mtt180 -137.06 137.86 39.79 Favored 'General case' 0 C--O 1.231 0.085 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.192 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.501 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 19.4 tt0 -151.56 125.7 9.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.255 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.569 ' SD ' HD11 ' A' ' 52' ' ' LEU . 0.8 OUTLIER -125.02 111.97 16.0 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.154 179.465 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.43 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 4.2 mt-10 -99.76 132.33 45.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.662 -179.256 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.809 HD12 ' CE1' ' A' ' 38' ' ' TYR . 3.6 mt -127.17 101.68 6.62 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.254 179.244 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -125.49 150.04 66.62 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 120.872 0.368 . . . . 0.0 111.332 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -61.69 -31.52 86.31 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.645 2.23 . . . . 0.0 112.198 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -94.7 -8.65 37.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.177 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.701 ' HB3' HD11 ' A' ' 59' ' ' ILE . 0.1 OUTLIER -136.25 114.45 10.65 Favored Pre-proline 0 C--N 1.331 -0.204 0 CA-C-N 116.687 -0.233 . . . . 0.0 110.785 179.974 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -50.96 -176.57 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.459 2.106 . . . . 0.0 112.311 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -59.15 85.2 0.06 OUTLIER 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 122.416 2.077 . . . . 0.0 112.398 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.701 HD11 ' HB3' ' A' ' 56' ' ' LYS . 87.7 mt -76.03 97.47 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.807 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.504 HD13 ' HA2' ' A' ' 102' ' ' GLY . 4.3 mt -83.74 100.53 10.96 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.487 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.797 HD21 ' HB3' ' A' ' 69' ' ' GLU . 0.3 OUTLIER -95.98 152.57 18.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.346 -179.461 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.556 HG21 HD21 ' A' ' 106' ' ' LEU . 11.5 p -152.56 161.64 2.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.656 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.483 ' N ' HG22 ' A' ' 62' ' ' VAL . . . -78.8 158.58 28.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.818 0.342 . . . . 0.0 111.502 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.416 ' HA3' ' HD2' ' A' ' 116' ' ' ARG . . . 70.17 -66.8 0.7 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.459 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.44 ' HB3' HG13 ' A' ' 62' ' ' VAL . 7.5 tptm -62.89 -41.3 99.36 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.836 0.351 . . . . 0.0 110.821 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.427 ' HB3' ' CD1' ' A' ' 61' ' ' LEU . 24.8 m-20 -132.56 56.99 1.81 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.788 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.27 -17.74 62.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.487 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 3.6 mtm -83.12 -30.45 27.91 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.713 0.292 . . . . 0.0 111.147 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.797 ' HB3' HD21 ' A' ' 61' ' ' LEU . 6.0 mm-40 -97.88 -23.75 15.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.242 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.418 ' HE1' ' O ' ' A' ' 47' ' ' ALA . 3.1 ttm -57.44 163.79 2.19 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.863 0.364 . . . . 0.0 111.108 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 8.8 t -46.99 -49.76 20.3 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.332 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 77.2 -57.49 0.51 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.987 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.7 mmtm -55.88 158.84 3.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.018 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -90.81 176.28 6.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.254 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.736 HD21 ' HD3' ' A' ' 13' ' ' ARG . 0.9 OUTLIER -54.75 -51.17 66.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.873 0.368 . . . . 0.0 111.56 -179.617 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -31.52 69.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.283 -179.62 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -81.42 -10.15 59.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.752 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.407 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 1.4 p -91.51 -73.96 0.52 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.77 0.319 . . . . 0.0 111.143 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 139.09 -20.91 3.0 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.785 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.707 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 3.8 mt -49.29 -30.04 6.8 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.991 0.424 . . . . 0.0 110.813 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.405 HG23 ' HG ' ' A' ' 75' ' ' LEU . 63.0 p -80.56 -31.92 36.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.362 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -94.48 7.87 44.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.046 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.638 ' HG2' HG21 ' A' ' 17' ' ' ILE . 2.2 mptt -92.69 32.05 1.29 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.726 0.298 . . . . 0.0 111.216 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 58.46 63.07 1.79 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.964 0.411 . . . . 0.0 111.053 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 62.76 60.38 7.82 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.627 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.707 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -77.32 -3.65 41.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.65 0.262 . . . . 0.0 111.576 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -51.51 168.13 0.08 Allowed 'General case' 0 CA--C 1.528 0.129 0 CA-C-O 120.839 0.352 . . . . 0.0 111.358 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.779 HG21 ' HB3' ' A' ' 16' ' ' ARG . 1.0 OUTLIER -151.23 179.94 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.151 179.872 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.523 HD12 ' HB3' ' A' ' 91' ' ' ARG . 0.2 OUTLIER -97.82 145.82 30.39 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.717 179.871 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.78 -10.48 28.64 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.591 2.194 . . . . 0.0 112.532 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.523 ' HB3' HD12 ' A' ' 89' ' ' LEU . 0.4 OUTLIER -72.05 -51.93 19.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.56 -179.93 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.404 ' N ' ' HG3' ' A' ' 91' ' ' ARG . 0.5 OUTLIER -67.45 -42.91 82.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.039 -179.907 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -56.98 -53.28 59.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.879 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.88 -19.34 61.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.732 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -62.37 -50.52 71.24 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 179.214 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.466 ' HB ' ' HE1' ' A' ' 50' ' ' MET . 19.3 mm -75.95 -33.79 25.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.59 179.326 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.483 ' CZ3' ' CD2' ' A' ' 60' ' ' LEU . 12.9 t-105 -52.45 -40.98 62.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.007 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -86.24 -31.56 21.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.584 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.439 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.1 OUTLIER -57.71 -52.91 63.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.385 -179.637 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 95.0 m -79.77 -82.47 0.11 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.225 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.405 ' C ' HD13 ' A' ' 60' ' ' LEU . . . -178.3 37.89 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.622 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.504 ' HA2' HD13 ' A' ' 60' ' ' LEU . . . -72.02 -41.25 55.1 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.542 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.709 ' HA ' HD11 ' A' ' 124' ' ' LEU . 29.4 mm -64.68 -46.65 91.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.799 0.333 . . . . 0.0 110.897 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.7 mm100 -60.17 -49.12 78.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.492 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -57.61 -49.11 77.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.286 179.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.874 HD12 HD11 ' A' ' 110' ' ' ILE . 0.2 OUTLIER -59.03 -45.02 91.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.361 179.355 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.425 ' HG2' ' CD2' ' A' ' 124' ' ' LEU . 0.9 OUTLIER -61.14 -29.75 69.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.997 179.615 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.36 -50.5 45.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.972 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.408 ' HB1' ' HB2' ' A' ' 114' ' ' GLN . . . -74.0 -31.72 63.08 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.333 0.587 . . . . 0.0 109.716 179.033 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.874 HD11 HD12 ' A' ' 106' ' ' LEU . 11.7 mt -59.0 -49.23 83.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.517 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -72.39 -37.18 68.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.783 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 5.8 m -76.0 -8.33 56.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.358 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 72.11 28.59 2.46 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.806 0.336 . . . . 0.0 110.867 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLN . . . . . 0.413 ' CB ' ' HD3' ' A' ' 65' ' ' LYS . 74.2 mt-30 -98.55 -29.73 12.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.652 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.71 -163.92 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.886 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.416 ' HD2' ' HA3' ' A' ' 64' ' ' GLY . 1.5 tpt180 -133.76 91.74 24.56 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.195 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.516 ' HB3' HG13 ' A' ' 6' ' ' ILE . 75.1 Cg_exo -50.04 90.25 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.578 2.185 . . . . 0.0 111.849 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.479 ' C ' HG23 ' A' ' 6' ' ' ILE . 2.4 p -136.12 -50.46 0.7 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.553 -179.386 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.406 ' CD2' ' HG2' ' A' ' 8' ' ' MET . 10.1 t80 -162.23 -61.6 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.339 . . . . 0.0 111.576 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.482 ' O ' ' HB2' ' A' ' 124' ' ' LEU . . . -53.59 -38.59 64.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.558 -179.203 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.501 HG22 ' CD1' ' A' ' 106' ' ' LEU . 17.7 p -69.3 -35.64 76.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.786 0.327 . . . . 0.0 110.679 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.584 ' HB2' HG21 ' A' ' 6' ' ' ILE . . . -70.22 -55.44 9.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.279 0.562 . . . . 0.0 110.532 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' MET . . . . . 0.503 ' HE1' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -56.44 -29.22 61.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.374 179.207 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.709 HD11 ' HA ' ' A' ' 103' ' ' ILE . 0.3 OUTLIER -69.47 -44.61 70.82 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.095 0.474 . . . . 0.0 109.937 178.96 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.675 ' HA ' HD12 ' A' ' 128' ' ' LEU . 18.0 mm100 -54.03 -44.84 71.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.584 179.649 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.07 -30.11 31.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.707 179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.515 HD23 ' C ' ' A' ' 127' ' ' LEU . 1.2 tt -66.61 -16.05 63.9 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.282 179.039 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.675 HD12 ' HA ' ' A' ' 125' ' ' GLN . 10.0 mt -74.59 -31.12 61.94 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.953 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.918 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.543 ' HB1' ' HB2' ' A' ' 4' ' ' GLN . . . . . . . . 0 N--CA 1.485 1.306 0 CA-C-O 120.844 0.354 . . . . 0.0 111.035 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.93 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -63.99 -66.14 0.58 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.673 179.949 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.33 -40.66 65.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.693 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.543 ' HB2' ' HB1' ' A' ' 1' ' ' ALA . 10.0 mm100 -61.54 -32.68 72.75 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.703 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.4 -50.08 12.37 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.888 179.481 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.93 HD12 ' O ' ' A' ' 2' ' ' ARG . 2.7 mp -58.9 -64.25 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.054 178.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.3 p30 36.73 31.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.031 -0.986 . . . . 0.0 112.327 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.63 ' H ' HG22 ' A' ' 6' ' ' ILE . 0.0 OUTLIER 46.62 94.53 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.049 0.452 . . . . 0.0 111.226 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -86.17 -77.9 0.29 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.423 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -100.16 -178.31 3.79 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.36 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -69.01 177.6 2.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.921 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.441 ' HG3' ' CZ ' ' A' ' 119' ' ' TYR . 12.5 mm100 -127.74 111.91 14.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.948 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.468 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -116.43 135.51 53.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.749 179.882 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.523 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 0.0 OUTLIER -126.85 149.74 49.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.55 -179.524 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.789 ' HB2' HD22 ' A' ' 80' ' ' LEU . 0.2 OUTLIER -154.67 162.46 41.12 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.226 0.536 . . . . 0.0 111.653 179.981 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.48 ' CG ' HG21 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.29 154.08 38.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.627 178.843 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -151.93 127.64 5.0 Favored Pre-proline 0 C--N 1.328 -0.361 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.891 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.453 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 75.3 Cg_endo -87.43 94.73 0.46 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.953 2.435 . . . . 0.0 111.981 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.0 p90 -111.76 155.08 24.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.87 0.366 . . . . 0.0 110.907 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.589 HG12 ' CG ' ' A' ' 34' ' ' LYS . 1.4 mt -100.0 153.11 4.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.344 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 -82.47 134.9 47.32 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.526 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.592 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 72.9 Cg_exo -39.96 -60.25 0.59 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.956 2.438 . . . . 0.0 113.051 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.682 ' HB1' ' HD2' ' A' ' 27' ' ' LYS . . . -46.11 -54.01 9.33 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.826 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.414 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -61.02 -37.53 82.89 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.213 -178.93 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.592 ' HG3' ' HA ' ' A' ' 22' ' ' PRO . 0.9 OUTLIER -55.7 -57.35 12.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.913 0.387 . . . . 0.0 111.805 -178.965 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.627 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.6 p90 -86.47 -9.0 57.14 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.87 -179.238 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.682 ' HD2' ' HB1' ' A' ' 23' ' ' ALA . 2.9 mtpp -70.25 -44.49 68.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.948 0.404 . . . . 0.0 110.366 179.357 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -174.18 138.85 0.7 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.867 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -67.96 -23.44 40.71 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.549 2.166 . . . . 0.0 112.449 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.5 mm100 -95.76 -40.5 9.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.005 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -93.73 48.32 1.28 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.962 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.412 ' HD3' ' O ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -110.0 61.88 0.6 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.671 179.785 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.01 135.62 0.88 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.663 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.589 ' CG ' HG12 ' A' ' 20' ' ' ILE . 8.4 mtmt -104.82 141.15 37.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.519 -179.665 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -112.95 135.75 12.91 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.524 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.453 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 15.6 m-90 -100.47 111.67 23.95 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.929 0.395 . . . . 0.0 110.845 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.607 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 39.0 t90 -95.04 117.66 30.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.808 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.8 ' CE1' HD12 ' A' ' 52' ' ' LEU . 14.5 m-85 -105.58 152.43 23.09 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.372 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.665 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -163.43 123.46 2.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.267 0.556 . . . . 0.0 111.445 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.486 ' HB3' ' CB ' ' A' ' 48' ' ' ARG . 0.1 OUTLIER -99.39 86.89 3.48 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.401 -0.818 . . . . 0.0 108.796 178.801 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.693 ' CG ' ' HB ' ' A' ' 46' ' ' ILE . 7.6 m-85 -71.81 156.41 39.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.747 -178.479 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.536 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 4.3 t70 -130.38 118.25 20.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.317 -0.856 . . . . 0.0 108.81 178.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 58.63 -136.46 51.1 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 119.732 -1.223 . . . . 0.0 110.828 -178.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.415 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.4 Cg_exo -73.71 -15.46 24.16 Favored 'Trans proline' 0 CA--C 1.53 0.292 0 C-N-CA 122.495 2.13 . . . . 0.0 112.332 179.425 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' TRP . . . . . 0.415 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 0.8 OUTLIER -119.83 -157.68 0.71 Allowed 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.714 -178.467 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.863 HD11 ' O ' ' A' ' 48' ' ' ARG . 5.8 tt -137.81 156.54 31.96 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.104 0 CA-C-O 121.149 0.5 . . . . 0.0 112.094 -179.306 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.651 ' CB ' HG21 ' A' ' 118' ' ' THR . . . -129.94 -15.15 3.88 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.521 -0.763 . . . . 0.0 112.166 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.863 ' O ' HD11 ' A' ' 46' ' ' ILE . 11.2 mtt180 -136.28 138.64 41.98 Favored 'General case' 0 C--O 1.23 0.053 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.753 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.452 ' OE1' HD12 ' A' ' 61' ' ' LEU . 0.6 OUTLIER -146.43 130.81 17.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.226 -179.735 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.452 ' HE1' ' HB ' ' A' ' 96' ' ' ILE . 0.2 OUTLIER -127.46 112.81 15.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.608 179.821 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.491 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -89.93 118.94 29.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.053 -179.753 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.8 HD12 ' CE1' ' A' ' 38' ' ' TYR . 43.3 mt -120.38 102.73 8.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.806 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 16.9 m80 -130.82 136.22 28.57 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.914 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -52.25 -25.95 25.41 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.354 2.036 . . . . 0.0 112.28 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -94.87 -28.26 15.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.14 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.3 mttp -119.79 119.5 31.19 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.086 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.453 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 72.6 Cg_exo -48.79 171.0 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.565 2.177 . . . . 0.0 112.121 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.453 ' HD2' ' HB3' ' A' ' 57' ' ' PRO . 19.1 Cg_endo -59.02 83.42 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.462 2.108 . . . . 0.0 112.367 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.594 HG22 ' HG ' ' A' ' 61' ' ' LEU . 63.8 mt -61.39 104.87 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.776 179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.446 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.2 OUTLIER -79.92 100.8 8.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.848 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.594 ' HG ' HG22 ' A' ' 59' ' ' ILE . 84.0 mt -109.51 145.09 36.86 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.735 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.527 HG21 ' HG ' ' A' ' 106' ' ' LEU . 8.5 t -141.66 147.2 22.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.085 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.584 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -59.53 151.74 23.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.01 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.04 -58.87 4.99 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.406 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.531 ' HG3' ' HB1' ' A' ' 109' ' ' ALA . 0.0 OUTLIER -80.12 -31.64 39.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.92 0.39 . . . . 0.0 110.802 179.783 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -123.62 54.13 1.31 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.74 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.38 -30.21 71.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.891 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.24 -40.48 16.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.826 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.407 ' HB3' ' CD2' ' A' ' 61' ' ' LEU . 6.1 mm-40 -73.13 -54.94 7.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.902 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.424 ' HE2' ' C ' ' A' ' 48' ' ' ARG . 46.0 ttm -52.24 163.23 0.41 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.842 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 3.0 t -51.39 136.67 24.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.844 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -119.93 47.25 1.77 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.0 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.52 134.21 10.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.015 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -55.28 164.95 0.82 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.885 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.728 HD11 ' CE1' ' A' ' 15' ' ' PHE . 1.2 tp -50.78 -45.5 59.18 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.721 -179.507 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.21 -31.79 69.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.602 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.26 -21.58 28.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.699 -179.472 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.623 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -62.47 -74.51 0.09 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.85 0.357 . . . . 0.0 111.177 -179.805 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 138.67 -25.19 2.85 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.326 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.789 HD22 ' HB2' ' A' ' 15' ' ' PHE . 0.8 OUTLIER -53.5 -36.21 61.47 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.972 0.415 . . . . 0.0 110.661 179.844 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.5 p -74.21 -30.64 62.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.66 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.3 mmm180 -72.68 -31.95 65.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.609 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.4 mptt -60.9 -168.22 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.812 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.52 73.81 2.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.994 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 72.03 66.38 2.12 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.535 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.0 -10.04 59.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.569 0.223 . . . . 0.0 111.349 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.403 ' HA ' ' O ' ' A' ' 14' ' ' PHE . 8.3 tt0 -52.55 154.7 2.47 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.896 0.379 . . . . 0.0 111.415 -179.666 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.48 HG21 ' CG ' ' A' ' 16' ' ' ARG . 1.2 pt -144.78 168.28 9.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.198 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.57 HD23 ' CD ' ' A' ' 90' ' ' PRO . 2.3 mt -78.81 144.75 64.94 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.554 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' PRO . . . . . 0.57 ' CD ' HD23 ' A' ' 89' ' ' LEU . 11.5 Cg_exo -69.02 -35.4 14.91 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.369 2.046 . . . . 0.0 111.387 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 6.9 mtm180 -55.35 -54.4 44.14 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.344 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -57.62 -45.18 85.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.279 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.423 ' HD2' HD11 ' A' ' 88' ' ' ILE . 14.0 t80 -55.29 -53.09 60.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.824 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.64 -21.15 60.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.825 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -50.77 71.56 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.261 0.553 . . . . 0.0 109.649 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.452 ' HB ' ' HE1' ' A' ' 50' ' ' MET . 16.7 mm -72.9 -34.93 47.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.246 179.032 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.45 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 11.9 t-105 -54.08 -39.08 66.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.142 179.258 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.519 ' HG3' HD13 ' A' ' 103' ' ' ILE . 1.5 tt0 -85.67 -25.96 26.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.604 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.445 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -56.36 -54.3 47.18 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.393 -179.759 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 8.3 t -83.68 -67.52 0.78 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.061 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 160.62 40.91 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.563 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.45 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -60.76 -52.93 49.38 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.349 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.787 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.7 mp -53.86 -42.12 51.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.72 0.295 . . . . 0.0 111.136 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.64 -43.9 97.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.013 0.435 . . . . 0.0 110.2 179.38 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -63.88 -40.97 97.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.132 179.428 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.608 HD13 HD13 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -68.21 -38.52 82.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.659 179.69 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.595 ' CD ' HD22 ' A' ' 128' ' ' LEU . 0.2 OUTLIER -65.58 -30.07 70.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.516 179.607 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.3 m -70.62 -50.05 41.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.342 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.531 ' HB1' ' HG3' ' A' ' 65' ' ' LYS . . . -71.76 -33.5 68.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.33 0.586 . . . . 0.0 109.747 179.051 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.643 ' CD1' HD22 ' A' ' 124' ' ' LEU . 5.1 mt -56.93 -49.18 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.48 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -72.27 -38.08 68.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.598 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 59.0 m -66.39 -15.86 63.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.124 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.0 mmm180 76.81 30.43 0.59 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.892 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 42.2 mm-40 -102.76 -28.69 11.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.586 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.86 158.09 22.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.046 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.442 ' O ' HG22 ' A' ' 118' ' ' THR . 2.1 mtt85 -110.15 95.32 21.03 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.782 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.408 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 87.9 Cg_exo -47.91 129.64 18.26 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.72 2.28 . . . . 0.0 112.588 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.837 ' O ' HG23 ' A' ' 6' ' ' ILE . 1.1 t -161.1 -54.38 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.004 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.441 ' CZ ' ' HG3' ' A' ' 12' ' ' GLN . 68.5 t80 -159.59 -62.17 0.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.081 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.509 ' HB1' ' NE ' ' A' ' 48' ' ' ARG . . . -53.99 -44.18 70.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.276 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.449 HG22 ' CG1' ' A' ' 110' ' ' ILE . 0.5 OUTLIER -62.15 -34.89 77.24 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.912 0.387 . . . . 0.0 110.465 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.85 ' HB2' HD13 ' A' ' 6' ' ' ILE . . . -71.37 -58.7 3.28 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.675 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' MET . . . . . 0.58 ' HE1' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -58.22 -29.41 65.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.325 179.397 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.833 HD23 HD23 ' A' ' 128' ' ' LEU . 7.4 tt -68.23 -48.87 63.97 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.146 0.498 . . . . 0.0 109.971 179.02 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.493 ' HA ' HD21 ' A' ' 128' ' ' LEU . 0.6 OUTLIER -53.15 -36.39 60.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.159 179.33 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 18.5 m-20 -86.65 -29.28 22.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.536 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.58 HD13 ' HE1' ' A' ' 123' ' ' MET . 1.3 tt -72.83 -10.0 59.3 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.879 179.454 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.833 HD23 HD23 ' A' ' 124' ' ' LEU . 4.0 pp -111.55 25.51 11.6 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.763 0.316 . . . . 0.0 111.165 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 16.5 mmtp . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.279 -0.867 . . . . 0.0 111.01 179.992 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.798 ' HB3' ' CB ' ' A' ' 4' ' ' GLN . . . . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.722 0.296 . . . . 0.0 111.061 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.813 ' O ' HD12 ' A' ' 6' ' ' ILE . 2.3 ttm180 -67.18 -69.05 0.33 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.992 0.425 . . . . 0.0 110.548 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -53.26 -30.76 40.13 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.062 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.798 ' CB ' ' HB3' ' A' ' 1' ' ' ALA . 6.0 tp60 -67.17 -39.2 86.43 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.874 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.545 ' HG3' ' N ' ' A' ' 6' ' ' ILE . 6.4 pt-20 -75.19 -43.02 54.42 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.688 0.28 . . . . 0.0 110.764 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.813 HD12 ' O ' ' A' ' 2' ' ' ARG . 3.7 mp -70.93 -58.76 4.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.575 0.702 . . . . 0.0 109.692 178.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.7 t0 43.34 80.06 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 114.515 -1.22 . . . . 0.0 111.376 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 5.2 mtm -64.06 -81.05 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.149 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 51.97 30.45 7.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.052 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.4 mtt85 -138.26 -172.56 3.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.916 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.27 158.99 16.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.931 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.424 ' HG3' ' CE2' ' A' ' 119' ' ' TYR . 89.3 mm-40 -130.14 102.9 6.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.806 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.547 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -122.26 127.95 50.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.097 -179.579 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.498 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 0.4 OUTLIER -115.46 151.34 34.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.296 179.772 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.702 ' HB2' HD22 ' A' ' 80' ' ' LEU . 0.8 OUTLIER -151.51 159.09 44.3 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-O 121.289 0.566 . . . . 0.0 112.041 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.724 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.29 145.67 27.17 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.961 179.332 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.565 ' CD1' HD23 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -153.07 124.69 3.71 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.684 0.278 . . . . 0.0 111.745 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.471 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 68.3 Cg_endo -89.27 103.61 0.38 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.063 2.509 . . . . 0.0 111.914 179.698 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.2 p90 -116.87 138.25 51.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.957 0.408 . . . . 0.0 111.076 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.489 HG12 ' HG3' ' A' ' 34' ' ' LYS . 37.4 mt -78.87 134.42 27.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.117 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.5 ttp180 -58.19 139.88 83.54 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.643 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.462 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 14.3 Cg_endo -56.59 -45.38 37.46 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.395 2.063 . . . . 0.0 112.434 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.533 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -55.92 -58.35 8.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.173 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.57 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 0.6 OUTLIER -68.35 -29.85 68.67 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.765 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.39 -57.08 10.94 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.319 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.533 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.8 p90 -91.74 -13.56 31.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.747 -179.485 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.57 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 0.1 OUTLIER -62.31 -46.31 89.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.844 0.354 . . . . 0.0 110.554 179.785 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -166.39 142.94 4.08 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.244 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -69.75 -26.1 27.98 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.636 2.224 . . . . 0.0 112.258 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -94.95 -36.17 11.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.627 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -98.3 49.88 1.0 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.687 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.466 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -109.66 63.36 0.6 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.826 179.999 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.431 ' HB3' ' HG2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -41.98 142.81 0.64 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.368 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.489 ' HG3' HG12 ' A' ' 20' ' ' ILE . 0.4 OUTLIER -113.42 152.18 30.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.32 -179.618 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.427 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -127.94 138.28 10.32 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.289 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.471 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 28.3 m-90 -97.73 128.32 44.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.887 0.375 . . . . 0.0 110.708 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.554 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 23.2 t90 -113.91 117.36 31.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.309 -179.236 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.587 ' CE1' HD12 ' A' ' 52' ' ' LEU . 1.3 m-85 -111.72 155.34 23.62 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.031 179.189 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.758 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.53 126.74 0.77 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.043 0.449 . . . . 0.0 111.884 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.498 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 17.0 t-160 -98.1 99.12 10.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.608 178.872 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.811 ' CZ ' HG21 ' A' ' 78' ' ' THR . 34.1 m-85 -85.25 114.52 22.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.629 -179.117 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.445 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 51.9 t0 -88.39 113.89 24.45 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.534 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 59.67 -136.04 50.6 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 119.966 -1.111 . . . . 0.0 111.062 -178.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.406 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.4 Cg_exo -73.53 -15.25 24.74 Favored 'Trans proline' 0 N--CA 1.463 -0.28 0 C-N-CA 122.527 2.151 . . . . 0.0 112.266 179.394 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' TRP . . . . . 0.408 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -118.05 -173.99 2.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.965 0.412 . . . . 0.0 111.765 -178.527 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.788 HD11 ' O ' ' A' ' 48' ' ' ARG . 1.5 tt -129.62 147.1 33.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.59 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.503 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -122.5 -21.03 5.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.98 -179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.788 ' O ' HD11 ' A' ' 46' ' ' ILE . 5.3 ttm180 -127.17 139.23 53.1 Favored 'General case' 0 C--N 1.334 -0.089 0 C-N-CA 120.868 -0.333 . . . . 0.0 111.253 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.536 HE21 HD13 ' A' ' 61' ' ' LEU . 1.1 tt0 -154.51 139.24 17.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.786 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.431 ' HE2' ' HB ' ' A' ' 96' ' ' ILE . 1.2 ttm -140.44 116.75 10.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.9 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.444 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -95.95 136.83 35.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.002 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.587 HD12 ' CE1' ' A' ' 38' ' ' TYR . 81.0 mt -134.46 119.13 18.14 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.075 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.427 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 1.7 m-70 -143.24 135.0 12.95 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.915 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.431 ' HG2' ' HB3' ' A' ' 33' ' ' LYS . 9.8 Cg_endo -52.65 -26.86 31.11 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.565 2.177 . . . . 0.0 112.181 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -98.9 -24.46 14.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.968 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.442 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 0.5 OUTLIER -118.01 120.61 32.34 Favored Pre-proline 0 C--O 1.234 0.275 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.84 179.899 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.442 ' HD2' ' HA ' ' A' ' 56' ' ' LYS . 10.8 Cg_endo -54.15 168.89 0.78 Allowed 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.456 2.104 . . . . 0.0 112.204 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.428 ' HA ' ' O ' ' A' ' 51' ' ' GLU . 50.8 Cg_exo -55.52 86.77 0.04 OUTLIER 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.577 2.185 . . . . 0.0 112.38 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.444 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 88.6 mt -67.44 95.56 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.099 0.476 . . . . 0.0 110.62 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.46 HD21 ' N ' ' A' ' 102' ' ' GLY . 0.1 OUTLIER -71.65 127.63 33.18 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.913 -179.774 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.898 HD11 ' HB3' ' A' ' 69' ' ' GLU . 0.3 OUTLIER -132.67 147.18 52.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.085 -179.764 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.489 ' HA ' ' HE1' ' A' ' 70' ' ' MET . 10.5 p -156.24 142.1 10.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.837 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.503 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -56.27 164.03 1.46 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.285 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.408 ' HA3' ' HB2' ' A' ' 116' ' ' ARG . . . 76.24 -70.02 2.17 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.324 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -57.21 6.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.862 0.363 . . . . 0.0 110.654 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.424 ' HB3' ' CD2' ' A' ' 61' ' ' LEU . 11.1 m-20 -110.08 45.61 1.09 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.58 179.719 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.59 -21.71 65.82 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.399 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 5.5 ptp -81.26 -31.81 33.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.89 0.376 . . . . 0.0 110.625 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.898 ' HB3' HD11 ' A' ' 61' ' ' LEU . 27.2 mp0 -85.29 -36.8 20.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.897 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.489 ' HE1' ' HA ' ' A' ' 62' ' ' VAL . 0.8 OUTLIER -46.0 170.07 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.518 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.742 ' SG ' HD13 ' A' ' 46' ' ' ILE . 3.8 m -51.51 -26.6 8.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.109 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 68.16 -78.11 0.04 OUTLIER 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.971 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.51 -178.63 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.22 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -95.4 -164.72 1.19 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.691 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.537 HD21 ' HB3' ' A' ' 41' ' ' PHE . 3.8 mm? -69.48 -49.36 55.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.508 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -62.46 -31.59 72.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.688 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -83.31 -27.94 29.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.505 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.811 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.6 OUTLIER -67.2 -78.42 0.06 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.835 0.35 . . . . 0.0 111.085 -179.763 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 144.44 -21.97 2.04 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.76 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.702 HD22 ' HB2' ' A' ' 15' ' ' PHE . 2.5 mt -51.88 -33.13 35.32 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.91 0.386 . . . . 0.0 111.075 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 68.1 p -83.55 -31.45 26.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.789 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 46.7 mtm-85 -66.45 -29.78 69.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.886 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.412 ' CD ' HG21 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -70.02 -166.5 0.12 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.854 179.977 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -100.61 92.21 5.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.008 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 53.81 74.13 0.34 Allowed Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.803 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -85.41 4.44 35.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.592 0.234 . . . . 0.0 111.56 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.407 ' HA ' ' O ' ' A' ' 14' ' ' PHE . 8.4 tm-20 -59.98 158.09 11.55 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.813 0.339 . . . . 0.0 111.4 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.724 HG21 ' HB3' ' A' ' 16' ' ' ARG . 0.9 OUTLIER -147.38 -179.95 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.177 179.985 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.03 146.59 33.21 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.626 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -68.18 -16.85 44.96 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.6 2.2 . . . . 0.0 112.69 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.07 -54.58 39.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.147 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -70.36 -41.32 73.28 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.916 0.389 . . . . 0.0 110.992 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.43 ' CE2' ' HD2' ' A' ' 48' ' ' ARG . 9.4 t80 -57.8 -53.01 63.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.941 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.65 -21.22 60.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.849 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -60.68 -50.34 73.88 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.283 0.563 . . . . 0.0 109.616 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.538 HG21 HD11 ' A' ' 52' ' ' LEU . 19.9 mm -75.44 -34.9 31.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.636 179.318 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.458 ' CE2' ' HA3' ' A' ' 102' ' ' GLY . 41.4 t-105 -52.92 -40.46 63.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.915 179.307 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -85.94 -28.22 24.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.717 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.429 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.4 OUTLIER -56.75 -44.08 81.38 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.251 -179.75 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 50.2 t -90.09 -76.91 0.41 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.01 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.408 ' C ' HD21 ' A' ' 60' ' ' LEU . . . 173.95 37.45 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.573 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.46 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -68.76 -44.27 70.82 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.499 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.853 HD13 HD21 ' A' ' 127' ' ' LEU . 4.3 mt -60.88 -39.9 83.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.935 0.397 . . . . 0.0 110.922 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -63.39 -45.81 89.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.12 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 21.9 t80 -62.05 -36.22 80.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.174 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 1.043 HD13 HD13 ' A' ' 124' ' ' LEU . 0.3 OUTLIER -71.47 -40.23 70.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.58 179.605 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -64.73 -29.9 70.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.597 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 5.1 m -71.95 -50.06 32.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.475 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.539 ' HB3' ' HB2' ' A' ' 115' ' ' ALA . . . -69.94 -34.07 72.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.5 0.667 . . . . 0.0 109.622 178.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.607 HD11 HD22 ' A' ' 106' ' ' LEU . 5.9 mt -56.95 -49.18 80.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.512 179.278 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -72.13 -34.17 68.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.642 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.406 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 12.3 t -75.79 -8.97 58.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.303 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.406 ' HB2' ' O ' ' A' ' 112' ' ' SER . 5.3 mmm180 68.41 27.66 6.32 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.855 0.359 . . . . 0.0 110.909 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -109.62 -24.11 11.11 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.761 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.539 ' HB2' ' HB3' ' A' ' 109' ' ' ALA . . . -56.96 -21.96 34.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.32 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.408 ' HB2' ' HA3' ' A' ' 64' ' ' GLY . 75.2 ttt180 67.68 92.95 0.06 OUTLIER Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.316 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.455 ' HB3' HG13 ' A' ' 6' ' ' ILE . 82.3 Cg_exo -46.66 90.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.877 2.385 . . . . 0.0 112.305 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -114.06 -63.41 1.45 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.183 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.424 ' CE2' ' HG3' ' A' ' 12' ' ' GLN . 9.5 t80 -161.8 -55.75 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.037 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.672 ' HB2' ' HE ' ' A' ' 48' ' ' ARG . . . -53.73 -30.12 42.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.18 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.435 ' HA ' HD11 ' A' ' 110' ' ' ILE . 22.2 p -69.79 -37.9 76.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.747 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -68.48 -54.06 19.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.011 0.434 . . . . 0.0 110.704 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' MET . . . . . 0.64 ' HE1' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -57.92 -29.63 65.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.564 179.519 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 1.043 HD13 HD13 ' A' ' 106' ' ' LEU . 0.2 OUTLIER -67.08 -50.13 62.71 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.084 0.469 . . . . 0.0 110.312 179.012 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.566 ' HA ' HD12 ' A' ' 128' ' ' LEU . 44.8 mm-40 -53.42 -41.62 66.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.618 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ASN . . . . . 0.416 ' HA ' ' HD3' ' A' ' 129' ' ' LYS . 68.0 m-80 -80.95 -31.13 35.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.39 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.853 HD21 HD13 ' A' ' 103' ' ' ILE . 0.9 OUTLIER -70.36 -12.04 61.31 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.534 179.073 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.566 HD12 ' HA ' ' A' ' 125' ' ' GLN . 8.7 mt -91.33 -10.53 40.93 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.382 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.416 ' HD3' ' HA ' ' A' ' 126' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.19 -0.909 . . . . 0.0 111.008 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.418 ' CB ' ' HB3' ' A' ' 4' ' ' GLN . . . . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.909 0.385 . . . . 0.0 111.051 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.815 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.4 OUTLIER -69.11 -62.49 1.36 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.101 -179.889 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -53.63 -30.27 42.02 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.573 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.418 ' HB3' ' CB ' ' A' ' 1' ' ' ALA . 6.9 tp60 -69.26 -43.37 74.07 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.892 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.481 ' HG3' ' N ' ' A' ' 6' ' ' ILE . 5.2 pt-20 -70.1 -39.71 75.35 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.87 0.367 . . . . 0.0 110.934 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.871 HD13 ' HB2' ' A' ' 122' ' ' ALA . 2.9 mp -76.51 -58.98 3.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 121.774 0.797 . . . . 0.0 109.67 178.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.1 t70 41.88 70.59 0.26 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.319 -1.31 . . . . 0.0 111.553 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.7 ptp -58.02 -53.61 56.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.191 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 51.2 49.2 21.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.24 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.86 -169.25 3.32 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.05 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -95.18 170.46 9.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.098 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.48 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 1.6 mp0 -131.25 102.81 6.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.936 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.534 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 3.2 mtt-85 -122.08 126.6 48.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.002 0.43 . . . . 0.0 111.015 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.511 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 2.7 m-85 -108.77 134.84 50.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.811 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.808 ' CE2' HG22 ' A' ' 81' ' ' THR . 2.9 m-85 -131.43 153.49 49.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.38 0.61 . . . . 0.0 112.542 -178.307 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.503 ' CB ' HG21 ' A' ' 88' ' ' ILE . 0.8 OUTLIER -145.99 142.78 28.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.622 179.21 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.983 HD11 HD22 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -151.35 114.68 3.08 Favored Pre-proline 0 C--N 1.328 -0.362 0 C-N-CA 120.759 -0.377 . . . . 0.0 111.628 -179.456 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.451 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 74.7 Cg_endo -87.49 98.12 0.45 Allowed 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.894 2.396 . . . . 0.0 111.956 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 42.9 p90 -116.72 137.9 51.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.925 0.393 . . . . 0.0 111.059 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.63 HD11 ' NZ ' ' A' ' 34' ' ' LYS . 24.2 mt -78.92 145.72 9.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.325 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.16 142.32 94.86 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.429 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.446 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 19.1 Cg_endo -58.68 -50.78 8.45 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.508 2.139 . . . . 0.0 112.22 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.509 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -55.25 -58.23 8.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.066 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.524 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 1.1 m-20 -65.37 -30.25 71.06 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.0 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.51 -56.05 20.3 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.393 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.509 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.7 p90 -94.52 -5.0 47.03 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.976 -179.392 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.524 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 5.3 mtpp -73.02 -46.58 51.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.885 0.374 . . . . 0.0 110.818 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -162.59 141.48 6.87 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.287 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -73.18 -9.28 23.16 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.686 2.258 . . . . 0.0 112.543 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 78.5 mm-40 -110.83 -33.8 6.43 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.958 0.409 . . . . 0.0 110.814 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 67.3 m-20 -97.44 37.07 1.39 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.761 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.495 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -71.36 -35.02 70.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.412 -179.753 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 46.96 93.35 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.196 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.63 ' NZ ' HD11 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -77.9 149.9 34.17 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.479 -179.763 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.436 ' HA3' ' CD2' ' A' ' 53' ' ' HIS . . . -121.79 132.94 9.18 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.247 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.451 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 21.5 m-90 -98.26 124.23 42.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.894 0.378 . . . . 0.0 110.957 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.422 ' CD1' ' HG2' ' A' ' 51' ' ' GLU . 63.4 t90 -107.64 117.13 33.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.973 -179.497 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.864 ' CE1' HD12 ' A' ' 52' ' ' LEU . 22.5 m-85 -111.54 151.43 28.7 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.432 179.544 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.487 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -169.99 124.07 0.75 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.078 0.466 . . . . 0.0 111.343 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.511 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 16.8 t-160 -99.83 96.17 7.4 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.73 179.307 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.606 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 5.1 m-85 -79.09 143.39 35.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.225 -179.268 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.553 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.3 OUTLIER -113.37 111.71 22.44 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.822 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.87 -133.21 49.5 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 119.907 -1.139 . . . . 0.0 111.224 -178.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_exo -73.36 -16.78 24.53 Favored 'Trans proline' 0 CA--C 1.531 0.325 0 C-N-CA 122.509 2.139 . . . . 0.0 112.517 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' TRP . . . . . 0.425 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.5 OUTLIER -119.06 -163.48 0.97 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.751 -178.501 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.606 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 4.9 tt -134.85 155.53 38.49 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.693 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.604 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -131.59 -20.88 2.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.427 -179.362 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.558 ' O ' HD11 ' A' ' 46' ' ' ILE . 14.5 mtt180 -128.9 134.8 48.39 Favored 'General case' 0 C--O 1.23 0.064 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.764 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.458 ' NE2' ' O ' ' A' ' 38' ' ' TYR . 0.0 OUTLIER -143.98 122.61 12.54 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.971 0.415 . . . . 0.0 111.466 -179.564 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.432 ' HE1' ' HB ' ' A' ' 96' ' ' ILE . 24.2 ttp -122.77 115.6 22.3 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.038 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.44 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 1.4 mt-10 -105.2 129.61 53.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.005 0.431 . . . . 0.0 111.69 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.864 HD12 ' CE1' ' A' ' 38' ' ' TYR . 5.2 mt -128.75 106.43 8.93 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.312 179.456 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.44 ' HB2' ' HG2' ' A' ' 56' ' ' LYS . 0.2 OUTLIER -131.7 138.7 33.17 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.543 -0.298 . . . . 0.0 111.13 -179.635 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.43 -23.91 26.09 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.381 2.054 . . . . 0.0 112.202 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -88.46 -32.85 18.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.129 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.514 ' HB2' HD11 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -127.12 125.74 24.17 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.09 -179.983 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.421 ' CB ' ' CD ' ' A' ' 58' ' ' PRO . 76.9 Cg_exo -50.81 -175.66 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.692 2.261 . . . . 0.0 112.485 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.421 ' CD ' ' CB ' ' A' ' 57' ' ' PRO . 33.3 Cg_exo -58.7 81.3 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.584 2.189 . . . . 0.0 112.498 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.514 HD11 ' HB2' ' A' ' 56' ' ' LYS . 94.6 mt -65.56 95.29 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.092 0.472 . . . . 0.0 110.441 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.452 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.4 OUTLIER -78.0 117.55 19.43 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.108 -179.608 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.425 ' HB2' ' HB3' ' A' ' 49' ' ' GLN . 53.9 mt -121.52 151.37 40.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.732 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.771 HG21 HD21 ' A' ' 106' ' ' LEU . 11.8 p -151.63 145.74 16.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.091 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.604 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -61.38 139.89 58.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.916 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.403 ' HA3' ' HG3' ' A' ' 116' ' ' ARG . . . 98.83 -47.43 1.4 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.394 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.543 ' HG3' ' HB1' ' A' ' 109' ' ' ALA . 0.0 OUTLIER -92.67 -42.46 9.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.901 0.381 . . . . 0.0 110.685 179.829 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -121.32 47.9 1.76 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.699 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.53 -29.84 70.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.045 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -85.38 -30.33 23.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.201 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -79.41 -50.11 11.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.196 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.4 ' HE1' ' N ' ' A' ' 63' ' ' ALA . 2.1 ptp -52.93 -177.47 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.157 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.48 -50.92 61.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.764 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 75.17 -57.8 0.59 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.311 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -46.26 154.77 0.25 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.326 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -74.83 174.11 9.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.922 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.486 HD12 ' CZ ' ' A' ' 15' ' ' PHE . 4.0 mm? -58.19 -45.99 86.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.473 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -69.71 -40.84 76.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.925 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -65.82 -22.63 66.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.547 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.422 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -77.45 -69.94 0.5 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.722 0.296 . . . . 0.0 110.921 -179.898 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 126.11 -19.83 6.39 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.684 -0.769 . . . . 0.0 112.671 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.983 HD22 HD11 ' A' ' 17' ' ' ILE . 0.1 OUTLIER -51.14 -53.11 37.58 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.851 0.358 . . . . 0.0 110.713 -179.916 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.808 HG22 ' CE2' ' A' ' 15' ' ' PHE . 11.6 p -58.06 -49.88 75.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.665 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -58.17 -27.15 63.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.456 179.483 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -163.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.578 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -99.71 82.22 2.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.792 0.33 . . . . 0.0 110.81 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.67 70.27 1.03 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.565 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -95.93 32.62 1.85 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.602 0.239 . . . . 0.0 111.164 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.487 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 0.7 OUTLIER -113.07 141.38 46.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.35 -179.891 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.503 HG21 ' CB ' ' A' ' 16' ' ' ARG . 0.1 OUTLIER -124.67 157.28 32.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.78 179.545 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.595 HD12 ' H ' ' A' ' 92' ' ' GLN . 0.3 OUTLIER -61.52 145.63 90.93 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.506 179.747 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -60.6 -23.38 75.54 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.599 2.199 . . . . 0.0 112.51 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -53.3 57.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.22 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.595 ' H ' HD12 ' A' ' 89' ' ' LEU . 6.1 mm-40 -57.71 -56.34 23.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.28 -179.656 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -50.18 -53.35 28.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.806 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.36 -20.45 62.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.525 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.403 ' HB2' ' HA ' ' A' ' 92' ' ' GLN . 0.4 OUTLIER -60.59 -50.01 75.23 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 109.541 -0.541 . . . . 0.0 109.541 179.089 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.432 ' HB ' ' HE1' ' A' ' 50' ' ' MET . 15.0 mm -72.38 -35.41 51.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.579 179.206 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.439 ' CH2' ' HG ' ' A' ' 60' ' ' LEU . 12.7 t-105 -52.58 -41.93 64.05 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.125 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -85.99 -26.46 25.43 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.655 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.17 -53.24 60.45 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.449 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 70.9 m -86.85 -87.16 0.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.341 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -167.23 48.64 0.25 Allowed Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.543 -0.837 . . . . 0.0 112.683 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.452 ' HA2' ' CD2' ' A' ' 60' ' ' LEU . . . -69.37 -39.56 80.87 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.565 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.79 HD12 HD22 ' A' ' 127' ' ' LEU . 16.7 mm -70.08 -44.95 77.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.799 0.333 . . . . 0.0 111.288 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.03 -49.21 78.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.813 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 94.0 t80 -59.5 -50.45 73.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.053 0.454 . . . . 0.0 110.407 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.771 HD21 HG21 ' A' ' 62' ' ' VAL . 0.2 OUTLIER -57.29 -46.53 83.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.393 179.508 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.408 ' HG2' HD23 ' A' ' 124' ' ' LEU . 2.8 mm-40 -59.67 -29.82 68.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.663 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 15.1 m -67.11 -50.32 61.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.777 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.543 ' HB1' ' HG3' ' A' ' 65' ' ' LYS . . . -70.32 -33.78 71.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.564 0.697 . . . . 0.0 109.436 178.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.553 ' CG1' HG22 ' A' ' 121' ' ' THR . 9.5 mt -56.31 -48.73 79.25 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.258 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -72.0 -32.56 67.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.245 179.303 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.46 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 0.3 OUTLIER -74.71 -9.28 58.41 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.062 179.491 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.46 ' HB2' ' O ' ' A' ' 112' ' ' SER . 15.7 mmm180 69.66 31.37 3.63 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.966 0.413 . . . . 0.0 110.998 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLN . . . . . 0.406 ' HB3' ' CG ' ' A' ' 65' ' ' LYS . 11.2 mt-30 -108.9 -29.97 8.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.555 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.51 ' HB1' ' CG2' ' A' ' 121' ' ' THR . . . -71.38 102.15 2.56 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.866 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.907 ' O ' HG22 ' A' ' 118' ' ' THR . 39.2 mtt85 -58.04 109.78 2.06 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.191 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.865 ' O ' HG23 ' A' ' 6' ' ' ILE . 75.6 Cg_exo -50.5 89.82 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.676 2.25 . . . . 0.0 112.187 179.467 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.907 HG22 ' O ' ' A' ' 116' ' ' ARG . 1.5 t -141.58 81.77 1.79 Allowed 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.834 0.349 . . . . 0.0 111.822 -179.553 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.63 ' H ' HG21 ' A' ' 6' ' ' ILE . 7.8 t80 65.13 -64.34 0.17 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 179.003 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.401 ' N ' ' O ' ' A' ' 118' ' ' THR . . . -53.54 -52.22 60.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.921 0.391 . . . . 0.0 111.397 -179.184 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.6 ' OG1' ' HA ' ' A' ' 117' ' ' PRO . 0.6 OUTLIER -65.26 -46.58 79.95 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.677 179.669 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.871 ' HB2' HD13 ' A' ' 6' ' ' ILE . . . -54.85 -56.27 21.24 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.387 0.613 . . . . 0.0 110.256 179.372 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' MET . . . . . 0.828 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -53.69 -33.66 56.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.335 179.17 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.492 HD13 ' CG ' ' A' ' 106' ' ' LEU . 0.1 OUTLIER -63.72 -49.04 74.64 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.15 0.5 . . . . 0.0 109.818 178.997 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 40.7 mm-40 -50.79 -40.2 54.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.909 178.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -79.3 -32.0 43.38 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.068 178.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.828 HD13 ' CE ' ' A' ' 123' ' ' MET . 0.3 OUTLIER -59.31 -21.43 59.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.118 178.922 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.472 ' O ' HD12 ' A' ' 128' ' ' LEU . 0.8 OUTLIER -143.01 77.93 1.59 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.952 179.929 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 6.9 mmmt . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.941 -179.996 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.767 0.318 . . . . 0.0 111.058 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.919 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.1 OUTLIER -57.14 -60.1 4.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.987 0.423 . . . . 0.0 110.546 179.824 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -53.84 -35.57 61.63 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.654 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.3 mm100 -61.63 -36.63 81.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.365 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -73.86 -56.47 4.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.093 179.224 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.919 HD12 ' O ' ' A' ' 2' ' ' ARG . 3.1 mp -57.72 -61.74 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.188 179.025 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 39.37 30.26 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.908 -1.042 . . . . 0.0 112.24 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.713 ' H ' HG22 ' A' ' 6' ' ' ILE . 0.0 OUTLIER 51.48 99.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.004 0.43 . . . . 0.0 111.166 179.759 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.9 mttt -53.31 -58.15 8.1 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.939 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.431 ' HD2' ' HA2' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -177.43 -157.71 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.023 179.925 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -44.76 147.4 0.63 Allowed 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.951 0.405 . . . . 0.0 111.705 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.436 ' HB3' ' HE2' ' A' ' 40' ' ' HIS . 74.2 mm-40 -118.91 112.64 19.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.952 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.594 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 1.1 mtp180 -115.4 132.36 56.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.006 0.432 . . . . 0.0 110.767 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.498 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 1.3 m-85 -115.59 135.21 54.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.399 -179.617 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.601 ' HB3' HD12 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -136.76 154.17 50.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.289 0.566 . . . . 0.0 112.007 -178.759 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.477 ' HD2' ' CE2' ' A' ' 38' ' ' TYR . 0.6 OUTLIER -149.21 147.16 28.08 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.767 179.872 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.746 HD13 HD13 ' A' ' 80' ' ' LEU . 0.4 OUTLIER -153.28 127.63 4.58 Favored Pre-proline 0 C--O 1.233 0.213 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.781 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.411 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 66.2 Cg_endo -91.87 114.83 0.37 Allowed 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 123.222 2.614 . . . . 0.0 111.573 179.17 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.7 p90 -131.31 142.95 50.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.955 0.407 . . . . 0.0 111.573 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.716 HD13 ' HE3' ' A' ' 32' ' ' LYS . 23.4 mt -88.03 134.2 28.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.801 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -56.21 122.84 51.29 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.571 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.467 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 84.5 Cg_exo -44.5 -46.82 11.73 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.568 2.178 . . . . 0.0 112.787 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.529 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -54.74 -58.24 8.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.109 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.541 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 7.0 m-20 -67.96 -29.39 68.43 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.853 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.67 -55.04 25.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.273 -179.677 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.529 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.1 p90 -94.03 -14.31 25.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.91 -179.353 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.541 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 3.3 mtpt -62.98 -50.95 68.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.797 0.332 . . . . 0.0 110.768 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 179.07 144.53 0.34 Allowed Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.347 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.44 ' HA ' ' HG2' ' A' ' 32' ' ' LYS . 71.9 Cg_endo -73.55 -2.29 11.94 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.756 2.304 . . . . 0.0 112.824 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.38 -46.55 8.65 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.026 0.441 . . . . 0.0 110.575 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -95.33 33.55 1.56 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.195 179.15 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.716 ' HE3' HD13 ' A' ' 20' ' ' ILE . 2.8 mmtt -45.83 -76.59 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.518 -179.729 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 61.83 93.87 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.727 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.641 ' NZ ' HD11 ' A' ' 20' ' ' ILE . 1.2 ttmt -91.06 138.28 31.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.375 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -107.66 134.63 12.31 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.269 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.42 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 11.4 m-90 -98.61 134.58 41.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.879 0.371 . . . . 0.0 110.82 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.411 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 26.2 t90 -113.39 117.27 31.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.06 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.787 ' CE1' HD12 ' A' ' 52' ' ' LEU . 53.2 m-85 -116.28 142.74 46.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.053 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.718 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -164.97 124.22 1.8 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.279 0.561 . . . . 0.0 111.883 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.507 ' HB3' ' HG3' ' A' ' 48' ' ' ARG . 5.5 t-160 -90.81 95.75 10.29 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.341 -0.845 . . . . 0.0 108.733 178.403 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.629 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 7.7 m-85 -76.98 158.57 30.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.544 -178.437 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.609 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 3.5 t70 -126.32 115.09 19.14 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.431 ' HA2' ' HD2' ' A' ' 10' ' ' ARG . . . 57.65 -135.61 51.55 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 119.804 -1.189 . . . . 0.0 111.124 -178.452 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_exo -71.7 -18.26 28.86 Favored 'Trans proline' 0 CA--C 1.53 0.289 0 C-N-CA 122.53 2.154 . . . . 0.0 112.278 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' TRP . . . . . 0.402 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.7 OUTLIER -116.15 -159.34 0.72 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.391 -178.83 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.837 HD11 ' O ' ' A' ' 48' ' ' ARG . 4.7 tt -131.62 157.73 43.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 CA-C-O 121.304 0.573 . . . . 0.0 112.255 -179.287 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.446 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -112.45 -37.3 5.0 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.013 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.837 ' O ' HD11 ' A' ' 46' ' ' ILE . 0.1 OUTLIER -146.38 160.32 42.2 Favored 'General case' 0 CA--C 1.523 -0.084 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.964 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.508 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 9.1 tt0 -149.9 150.55 32.06 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.158 0.504 . . . . 0.0 111.646 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.418 ' HE1' ' N ' ' A' ' 97' ' ' TRP . 3.3 ttm -138.85 122.51 17.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.134 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.402 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 4.3 mt-10 -111.44 139.75 46.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.043 0.449 . . . . 0.0 111.583 -179.302 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.787 HD12 ' CE1' ' A' ' 38' ' ' TYR . 0.7 OUTLIER -135.08 101.77 4.98 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.364 179.652 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -116.68 138.05 24.21 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.096 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -52.06 -26.6 26.19 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.662 2.241 . . . . 0.0 112.331 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -98.89 -25.04 14.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.968 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.613 ' CB ' HD11 ' A' ' 59' ' ' ILE . 0.1 OUTLIER -117.06 118.98 35.53 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.774 -179.807 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.403 ' O ' ' N ' ' A' ' 59' ' ' ILE . 73.1 Cg_exo -48.72 177.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.405 2.07 . . . . 0.0 112.261 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -56.75 82.4 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.536 2.157 . . . . 0.0 112.345 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.613 HD11 ' CB ' ' A' ' 56' ' ' LYS . 5.8 mt -65.01 107.05 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.861 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.654 HD23 ' HB2' ' A' ' 105' ' ' TYR . 0.3 OUTLIER -83.28 136.96 34.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.893 -179.93 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.813 HD21 ' HB3' ' A' ' 69' ' ' GLU . 0.2 OUTLIER -132.68 145.79 51.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.024 -179.804 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.928 HG21 HD21 ' A' ' 106' ' ' LEU . 12.0 p -150.37 131.91 5.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.982 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.67 164.7 1.02 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.414 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.79 -70.71 1.15 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.407 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.473 ' HG3' ' HB1' ' A' ' 109' ' ' ALA . 0.0 OUTLIER -64.62 -55.67 18.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.948 0.404 . . . . 0.0 110.788 179.868 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.446 ' CB ' HD13 ' A' ' 61' ' ' LEU . 66.6 m-20 -99.13 59.33 1.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.864 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -69.04 -23.97 64.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.203 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 7.1 mmt -85.25 -37.87 19.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.994 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.813 ' HB3' HD21 ' A' ' 61' ' ' LEU . 6.0 mt-10 -81.69 -36.59 28.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.202 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.418 ' N ' HD11 ' A' ' 61' ' ' LEU . 63.4 tpp -52.11 158.62 1.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.18 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 5.4 t -49.1 -58.7 4.51 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.105 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 66.03 19.36 11.19 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.216 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.61 ' HB2' HG23 ' A' ' 78' ' ' THR . 15.6 mmtt -123.69 131.67 53.66 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.782 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -58.64 166.4 1.85 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.41 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.438 HD23 ' HA ' ' A' ' 75' ' ' LEU . 12.2 mt -58.8 -53.11 62.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.682 0.277 . . . . 0.0 111.432 -179.458 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -62.87 -31.93 73.07 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.275 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -77.82 -36.67 49.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.322 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.61 HG23 ' HB2' ' A' ' 73' ' ' LYS . 0.7 OUTLIER -62.8 -73.27 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.118 -179.808 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 140.23 -6.6 2.81 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.532 -0.842 . . . . 0.0 113.101 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.746 HD13 HD13 ' A' ' 17' ' ' ILE . 2.6 mm? -63.12 -38.15 90.02 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.249 0.547 . . . . 0.0 110.161 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 69.0 p -87.56 -28.52 21.91 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.978 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.04 -36.11 82.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.612 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.624 ' HD3' ' HB2' ' A' ' 86' ' ' ALA . 0.3 OUTLIER -80.24 -164.61 0.71 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.753 179.824 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -109.86 112.88 25.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.911 0.386 . . . . 0.0 111.302 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.82 82.6 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.954 -0.641 . . . . 0.0 113.227 179.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -118.63 15.19 13.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.718 0.294 . . . . 0.0 111.163 179.397 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.423 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 14.6 mt-10 -87.02 166.4 15.07 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.895 0.378 . . . . 0.0 111.286 -179.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.472 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 0.8 OUTLIER -146.98 168.11 5.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.008 179.688 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.867 HD12 ' HB2' ' A' ' 91' ' ' ARG . 0.8 OUTLIER -90.01 140.82 27.61 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.742 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.13 -16.47 54.62 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.632 2.221 . . . . 0.0 112.649 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.867 ' HB2' HD12 ' A' ' 89' ' ' LEU . 0.6 OUTLIER -71.76 -54.06 11.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.205 -179.817 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.435 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 0.0 OUTLIER -66.95 -39.83 87.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.972 -179.803 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -58.5 -53.21 60.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.477 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.75 -19.32 62.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.411 179.321 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.435 ' HB2' ' HA ' ' A' ' 92' ' ' GLN . 0.1 OUTLIER -61.82 -50.18 73.35 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.117 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.404 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 14.0 mm -72.23 -37.76 60.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.405 179.11 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.441 ' O ' ' N ' ' A' ' 102' ' ' GLY . 41.2 t-105 -52.88 -42.15 65.01 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.152 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -85.72 -21.9 28.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.699 179.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.404 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 4.9 tpt180 -58.24 -54.07 51.1 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.356 -179.698 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 41.6 t -86.12 -83.01 0.19 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.29 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.577 ' C ' HD21 ' A' ' 60' ' ' LEU . . . -165.84 31.45 0.22 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.601 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.532 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -52.64 -48.06 56.73 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.65 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.731 ' HA ' HD11 ' A' ' 124' ' ' LEU . 24.2 mm -66.29 -43.13 91.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.742 0.306 . . . . 0.0 111.056 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.86 -39.43 74.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.97 0.415 . . . . 0.0 110.552 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.654 ' HB2' HD23 ' A' ' 60' ' ' LEU . 17.7 t80 -64.2 -53.48 48.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.637 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.928 HD21 HG21 ' A' ' 62' ' ' VAL . 1.5 mt -61.59 -37.66 84.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.632 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.519 ' HG2' HD21 ' A' ' 124' ' ' LEU . 0.3 OUTLIER -64.36 -31.05 72.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.702 179.757 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 14.7 m -70.14 -50.33 41.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.642 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.473 ' HB1' ' HG3' ' A' ' 65' ' ' LYS . . . -72.06 -31.91 66.57 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.246 0.546 . . . . 0.0 109.729 179.063 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.595 ' CD1' HD22 ' A' ' 124' ' ' LEU . 4.6 mt -56.89 -47.14 83.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.247 179.007 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -69.59 -39.31 77.35 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.436 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.57 -14.1 62.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.111 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.401 ' NH1' ' HB3' ' A' ' 113' ' ' ARG . 3.6 mmm180 72.45 29.47 2.11 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.817 0.341 . . . . 0.0 111.004 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -111.81 -21.32 11.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.05 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.403 ' HA ' ' HB2' ' A' ' 65' ' ' LYS . . . -56.68 -26.36 56.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.443 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 56.7 mtt180 60.74 96.56 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.631 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -47.11 92.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.592 2.195 . . . . 0.0 112.566 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 23.8 m -106.24 -59.54 1.77 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.59 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -165.59 -56.26 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.151 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.406 ' CB ' HD11 ' A' ' 106' ' ' LEU . . . -53.8 -40.85 66.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.191 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.623 HG22 HD22 ' A' ' 106' ' ' LEU . 6.6 p -60.79 -40.68 93.5 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.164 179.628 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.784 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -63.99 -54.26 37.17 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.42 0.628 . . . . 0.0 109.424 178.426 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' MET . . . . . 0.561 ' CE ' HD13 ' A' ' 127' ' ' LEU . 2.5 tmm? -56.35 -33.63 65.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.662 178.527 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.781 HD13 ' HB3' ' A' ' 106' ' ' LEU . 1.2 tt -67.55 -44.81 77.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.04 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.693 ' HA ' HD12 ' A' ' 128' ' ' LEU . 46.3 mm-40 -52.88 -38.73 61.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.014 179.296 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 49.9 m-20 -80.99 -34.28 33.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.345 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.561 HD13 ' CE ' ' A' ' 123' ' ' MET . 1.7 tp -68.98 -11.25 60.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.823 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.693 HD12 ' HA ' ' A' ' 125' ' ' GLN . 14.5 mt -77.6 -17.59 57.67 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.224 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.989 179.888 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.4 ' HB1' ' HB2' ' A' ' 4' ' ' GLN . . . . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.829 0.347 . . . . 0.0 111.006 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.893 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -62.84 -65.11 0.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.721 179.958 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -53.94 -39.36 65.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.753 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.4 ' HB2' ' HB1' ' A' ' 1' ' ' ALA . 10.1 mm100 -60.96 -34.01 74.09 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.751 179.74 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.54 -49.39 14.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.266 179.482 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.893 HD12 ' O ' ' A' ' 2' ' ' ARG . 2.8 mp -62.38 -62.91 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.195 179.096 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.404 ' C ' ' O ' ' A' ' 6' ' ' ILE . 6.4 p-10 29.49 76.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.18 -0.918 . . . . 0.0 112.118 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.737 ' HE3' HG23 ' A' ' 6' ' ' ILE . 16.1 mmt -79.93 -78.97 0.15 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.051 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.3 mttp 53.88 28.98 9.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.017 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.6 ttm-85 -103.54 54.58 0.75 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.01 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 63.67 133.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.108 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.422 ' HG3' ' CZ ' ' A' ' 119' ' ' TYR . 90.6 mm-40 -125.0 102.82 7.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.69 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.477 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 18.3 mtp180 -117.53 129.35 55.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.159 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.504 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 1.3 m-85 -113.46 134.64 54.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.982 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.828 ' HB2' HD22 ' A' ' 80' ' ' LEU . 2.2 m-85 -134.67 153.49 51.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.215 0.531 . . . . 0.0 112.019 -178.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.466 ' HB3' ' CG2' ' A' ' 88' ' ' ILE . 0.6 OUTLIER -149.17 146.11 27.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.803 179.486 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.507 HG12 HD23 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -143.06 122.31 7.56 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 120.656 0.265 . . . . 0.0 111.359 -179.589 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.463 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 74.3 Cg_endo -88.44 89.49 0.47 Allowed 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.938 2.425 . . . . 0.0 112.354 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 29.1 p90 -109.15 144.78 36.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.819 0.342 . . . . 0.0 110.878 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.814 HG23 ' O ' ' A' ' 33' ' ' LYS . 4.8 mt -90.77 144.96 8.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.045 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.409 ' O ' ' CG ' ' A' ' 25' ' ' GLN . 7.5 mtt180 -70.12 134.4 87.41 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.503 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.583 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 85.3 Cg_exo -41.26 -60.81 0.58 Allowed 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.949 2.432 . . . . 0.0 113.19 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.698 ' HB1' ' HD2' ' A' ' 27' ' ' LYS . . . -46.22 -53.89 9.77 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.899 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.546 ' HB3' ' HA ' ' A' ' 32' ' ' LYS . 1.4 m-20 -60.34 -36.79 78.79 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.651 -0.704 . . . . 0.0 112.072 -178.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.583 ' HG3' ' HA ' ' A' ' 22' ' ' PRO . 1.3 mt-30 -56.92 -57.59 11.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.723 -179.147 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.645 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.8 p90 -86.36 -3.03 58.92 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.71 -179.403 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.698 ' HD2' ' HB1' ' A' ' 23' ' ' ALA . 0.4 OUTLIER -76.85 -43.69 35.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.865 0.364 . . . . 0.0 110.424 179.353 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.434 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 3.4 t70 -168.39 148.69 4.29 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.121 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 2.8 Cg_exo -73.44 -30.38 10.14 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.758 2.305 . . . . 0.0 111.781 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -94.6 -41.97 9.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.802 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -87.35 53.59 2.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.642 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.546 ' HA ' ' HB3' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -122.34 62.09 0.97 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.859 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.814 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -43.02 148.7 0.24 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.313 -179.921 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.92 117.65 34.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.332 -179.44 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -85.39 124.34 6.75 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.793 -0.718 . . . . 0.0 111.948 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.463 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 24.2 m-90 -97.88 131.31 44.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.038 0.447 . . . . 0.0 111.258 -179.518 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.697 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 33.2 t90 -116.2 117.15 29.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.636 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.737 ' CE1' HD12 ' A' ' 52' ' ' LEU . 11.7 m-85 -110.11 152.08 26.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.622 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.511 ' HB3' ' HE1' ' A' ' 41' ' ' PHE . . . -170.3 124.26 0.72 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.013 0.435 . . . . 0.0 111.319 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.504 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 14.1 t-160 -97.11 101.0 12.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.75 179.349 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.631 ' CE2' HG21 ' A' ' 78' ' ' THR . 7.7 m-85 -87.96 123.38 32.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.495 -179.263 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.459 ' OD2' ' HB3' ' A' ' 47' ' ' ALA . 38.3 m-20 -95.87 121.45 37.62 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 56.09 -137.77 46.36 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 119.944 -1.122 . . . . 0.0 111.042 -178.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.404 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 7.2 Cg_exo -73.33 -16.06 24.93 Favored 'Trans proline' 0 CA--C 1.531 0.355 0 C-N-CA 122.38 2.053 . . . . 0.0 112.28 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' TRP . . . . . 0.405 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -117.26 -170.25 1.81 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.943 0.401 . . . . 0.0 111.89 -178.434 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.638 HD11 ' O ' ' A' ' 48' ' ' ARG . 3.9 tt -128.28 154.65 39.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.878 -179.334 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.459 ' HB3' ' OD2' ' A' ' 42' ' ' ASP . . . -131.97 -19.37 2.58 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.132 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.638 ' O ' HD11 ' A' ' 46' ' ' ILE . 5.9 mtm180 -130.27 142.65 50.54 Favored 'General case' 0 C--N 1.337 0.054 0 CA-C-O 120.85 0.357 . . . . 0.0 111.039 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.604 HE22 ' HE1' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -147.38 132.88 18.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.207 -179.76 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.403 ' HB3' ' HB2' ' A' ' 38' ' ' TYR . 14.1 ttp -133.4 120.71 21.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.331 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.552 ' HB3' HD12 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -105.24 135.0 47.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.267 -179.648 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.737 HD12 ' CE1' ' A' ' 38' ' ' TYR . 54.7 mt -135.15 101.88 5.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.71 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.413 ' HB2' ' HB2' ' A' ' 56' ' ' LYS . 0.4 OUTLIER -120.75 155.4 57.19 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.015 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.16 -30.03 81.53 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.757 2.305 . . . . 0.0 112.457 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -109.82 9.67 24.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.478 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.54 ' HB3' HD11 ' A' ' 59' ' ' ILE . 0.9 OUTLIER -142.3 113.12 6.16 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.792 179.895 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -50.92 -179.9 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.432 2.088 . . . . 0.0 112.336 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.25 82.69 0.07 OUTLIER 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.665 2.244 . . . . 0.0 112.488 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.552 HD12 ' HB3' ' A' ' 51' ' ' GLU . 7.1 mt -64.8 98.48 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.991 0.424 . . . . 0.0 110.709 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.567 HD21 ' N ' ' A' ' 102' ' ' GLY . 0.2 OUTLIER -76.1 112.69 12.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.773 -179.74 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.792 HD21 ' HB3' ' A' ' 69' ' ' GLU . 0.9 OUTLIER -115.74 152.6 32.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.847 -179.719 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.677 HG21 HD21 ' A' ' 106' ' ' LEU . 12.1 p -158.79 146.47 7.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.048 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.22 162.03 2.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.026 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.401 ' CA ' ' HD3' ' A' ' 116' ' ' ARG . . . 75.09 -65.75 2.26 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.065 -179.623 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.3 -36.4 66.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.034 0.445 . . . . 0.0 110.342 179.489 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -119.49 54.83 0.98 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.505 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.44 -34.22 77.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.203 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 36.5 mmm -85.71 -38.94 17.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.881 0.372 . . . . 0.0 110.777 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.792 ' HB3' HD21 ' A' ' 61' ' ' LEU . 0.3 OUTLIER -72.58 -44.9 61.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.976 -179.804 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.416 ' HG3' ' HG3' ' A' ' 49' ' ' GLN . 21.3 ttm -52.32 163.51 0.4 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.927 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.484 ' SG ' HG22 ' A' ' 78' ' ' THR . 1.8 t -46.7 -55.07 8.36 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.208 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.425 ' CB ' ' O ' ' A' ' 71' ' ' CYS . 2.7 tt0 84.04 -21.89 0.24 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.786 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.47 -179.69 5.87 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.922 0.391 . . . . 0.0 111.163 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -99.26 -171.58 2.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.463 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.558 HD11 ' HB2' ' A' ' 41' ' ' PHE . 3.6 mm? -67.3 -49.99 61.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.568 -179.441 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.27 -41.72 73.08 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.854 0.359 . . . . 0.0 111.338 -179.394 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -61.81 -38.4 88.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.684 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.631 HG21 ' CE2' ' A' ' 41' ' ' PHE . 1.0 OUTLIER -59.82 -72.42 0.11 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.146 -179.643 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 132.88 -19.4 4.42 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.551 -179.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.828 HD22 ' HB2' ' A' ' 15' ' ' PHE . 1.5 mp -52.79 -42.83 65.4 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.032 0.444 . . . . 0.0 110.765 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 28.3 p -71.2 -39.63 71.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.649 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -60.87 -30.41 70.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.557 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.6 mtpp -60.11 -177.11 0.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.691 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.54 68.88 2.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.767 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.56 64.55 1.68 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.638 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -92.6 26.25 2.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.709 0.29 . . . . 0.0 111.233 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.99 155.65 16.65 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.85 0.357 . . . . 0.0 110.928 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.466 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 1.0 OUTLIER -133.56 178.69 5.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.072 179.818 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.593 HD23 ' H ' ' A' ' 89' ' ' LEU . 0.9 OUTLIER -93.75 158.45 36.51 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.828 179.821 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo -73.0 -35.81 4.98 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.736 2.291 . . . . 0.0 112.107 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.592 ' HB2' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -53.96 -54.26 41.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.223 -179.781 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.441 ' HG3' HD21 ' A' ' 89' ' ' LEU . 0.5 OUTLIER -64.3 -45.87 86.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.18 -179.78 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -55.33 -53.25 58.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.014 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -72.6 -20.22 61.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.679 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.408 ' HB2' ' HA ' ' A' ' 92' ' ' GLN . 1.3 tm-20 -59.93 -49.63 76.93 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.468 HG21 HD11 ' A' ' 52' ' ' LEU . 16.7 mm -73.76 -35.06 42.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.366 179.023 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.449 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 5.8 t-105 -54.65 -39.7 68.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.991 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.63 -25.59 26.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.531 179.272 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.8 -53.7 54.8 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.085 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 52.3 t -83.96 -76.65 0.29 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.026 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 175.01 39.0 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.598 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.567 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -58.9 -62.22 6.48 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.429 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.619 ' H ' HD12 ' A' ' 103' ' ' ILE . 3.7 mp -52.93 -38.37 28.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.784 0.326 . . . . 0.0 111.258 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -66.96 -40.13 87.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.982 0.42 . . . . 0.0 110.515 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -69.72 -41.55 75.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.496 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.719 HD12 HD11 ' A' ' 110' ' ' ILE . 0.3 OUTLIER -68.22 -50.31 54.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.876 179.888 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -29.68 70.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.037 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 4.0 m -68.52 -50.51 51.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.793 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.518 ' HB1' ' HB2' ' A' ' 114' ' ' GLN . . . -71.29 -35.1 71.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.645 0.736 . . . . 0.0 109.389 178.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.719 HD11 HD12 ' A' ' 106' ' ' LEU . 15.9 mt -56.24 -45.23 81.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.534 179.13 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -70.34 -41.16 73.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.031 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.501 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 21.6 p -76.55 -4.63 43.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.424 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.501 ' HB2' ' O ' ' A' ' 112' ' ' SER . 24.2 mmm180 75.38 24.12 1.43 Allowed 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.79 0.329 . . . . 0.0 111.332 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLN . . . . . 0.518 ' HB2' ' HB1' ' A' ' 109' ' ' ALA . 0.0 OUTLIER -90.38 -24.19 20.87 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.386 179.082 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -102.11 107.7 18.87 Favored 'General case' 0 N--CA 1.456 -0.136 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.873 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.648 ' HG3' HG23 ' A' ' 118' ' ' THR . 0.2 OUTLIER -56.17 135.15 74.92 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.937 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_exo -52.42 84.95 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.596 2.197 . . . . 0.0 112.517 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.648 HG23 ' HG3' ' A' ' 116' ' ' ARG . 3.6 p -107.62 -176.59 3.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.413 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.422 ' CZ ' ' HG3' ' A' ' 12' ' ' GLN . 40.2 t80 -59.17 -36.35 75.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.87 0.367 . . . . 0.0 110.77 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.482 ' HB2' ' HE ' ' A' ' 48' ' ' ARG . . . -69.15 -52.08 31.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.116 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.595 ' HA ' HD11 ' A' ' 110' ' ' ILE . 60.5 p -58.63 -49.28 78.09 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.835 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.665 ' HB2' HG21 ' A' ' 6' ' ' ILE . . . -57.97 -48.54 79.69 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.244 0.545 . . . . 0.0 109.826 179.115 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' MET . . . . . 0.621 ' HE1' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -62.14 -33.37 74.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.883 178.785 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.509 HD21 ' O ' ' A' ' 103' ' ' ILE . 0.1 OUTLIER -63.97 -50.26 69.28 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.168 179.2 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.408 ' HA ' HD12 ' A' ' 128' ' ' LEU . 28.7 mm100 -52.92 -42.57 65.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.359 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -79.06 -29.84 43.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.638 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.621 HD13 ' HE1' ' A' ' 123' ' ' MET . 1.3 tt -76.73 -7.02 54.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.647 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.408 HD12 ' HA ' ' A' ' 125' ' ' GLN . 20.3 mt -75.71 -35.34 60.3 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.896 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.188 -0.91 . . . . 0.0 111.113 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.843 ' HB1' ' HB3' ' A' ' 4' ' ' GLN . . . . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.964 0.411 . . . . 0.0 111.026 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.791 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -60.67 -66.63 0.5 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.55 179.88 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.74 -36.73 62.62 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.549 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.843 ' HB3' ' HB1' ' A' ' 1' ' ' ALA . 6.5 tp60 -58.31 -36.31 73.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.668 179.584 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.536 ' HG2' ' HB2' ' A' ' 117' ' ' PRO . 0.3 OUTLIER -73.02 -55.68 6.18 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.901 179.403 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.791 HD12 ' O ' ' A' ' 2' ' ' ARG . 4.5 mp -52.91 -64.61 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.48 0.657 . . . . 0.0 109.61 178.609 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 29.4 t70 49.58 96.94 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.057 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.407 ' HE2' ' HB3' ' A' ' 8' ' ' MET . 3.1 ptp -87.53 20.22 3.0 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.575 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.48 -31.27 63.66 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.849 0.356 . . . . 0.0 110.999 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 18.6 mtt180 -57.0 173.18 0.22 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.029 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.2 134.14 42.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.943 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 89.7 mm-40 -119.1 102.68 8.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.941 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.498 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -122.34 143.23 49.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.787 179.868 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.543 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 0.7 OUTLIER -124.34 134.74 53.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.709 -179.621 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.498 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 0.2 OUTLIER -143.56 155.53 44.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.236 0.541 . . . . 0.0 111.881 -179.695 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.854 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.6 153.4 37.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.897 178.71 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.634 HG21 ' CD ' ' A' ' 83' ' ' LYS . 0.1 OUTLIER -148.79 133.09 8.82 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.757 0.313 . . . . 0.0 111.535 -179.776 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.428 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 70.7 Cg_endo -91.97 120.25 0.54 Allowed 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.183 2.589 . . . . 0.0 111.777 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.7 p90 -144.59 155.99 43.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.99 0.424 . . . . 0.0 111.154 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.513 HG23 ' O ' ' A' ' 33' ' ' LYS . 2.2 mt -108.9 150.53 11.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.812 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -69.23 123.22 87.82 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.25 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.635 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 67.2 Cg_exo -40.0 -50.79 3.3 Favored 'Trans proline' 0 C--O 1.239 0.554 0 C-N-CA 122.952 2.435 . . . . 0.0 112.996 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.683 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -47.6 -59.09 3.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.879 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.492 ' HA ' ' HG2' ' A' ' 27' ' ' LYS . 0.8 OUTLIER -62.63 -33.59 75.33 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.505 -0.77 . . . . 0.0 112.833 -178.831 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.635 ' HG3' ' HA ' ' A' ' 22' ' ' PRO . 0.5 OUTLIER -55.89 -53.89 51.28 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -178.314 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.683 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.9 p90 -88.88 -40.72 12.91 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -178.016 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.545 ' HG2' ' O ' ' A' ' 23' ' ' ALA . 11.0 ptmt -58.34 -36.26 73.17 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 -178.633 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -156.91 116.67 2.06 Favored Pre-proline 0 C--N 1.33 -0.28 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.893 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.27 -7.01 19.85 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.617 2.212 . . . . 0.0 112.366 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -95.8 -36.14 11.26 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.947 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -88.99 46.02 1.35 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.441 178.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.431 ' HD3' ' HA ' ' A' ' 25' ' ' GLN . 3.9 mmtp -78.86 59.65 2.64 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.948 -179.272 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.513 ' O ' HG23 ' A' ' 20' ' ' ILE . 12.2 mmtm -53.8 100.7 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.025 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.92 121.35 31.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.949 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -113.66 144.48 18.18 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.727 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.451 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 11.2 m-90 -106.21 132.73 51.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.843 0.354 . . . . 0.0 110.745 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.513 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 22.4 t90 -115.05 117.56 30.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.222 -179.427 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.833 ' CE1' HD12 ' A' ' 52' ' ' LEU . 0.4 OUTLIER -117.24 152.28 35.16 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.32 179.146 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.61 ' HB3' ' HE1' ' A' ' 41' ' ' PHE . . . -170.58 130.29 0.86 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.203 0.525 . . . . 0.0 111.807 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.575 ' HB3' ' HG3' ' A' ' 48' ' ' ARG . 8.4 t-160 -96.68 103.68 15.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.496 -0.775 . . . . 0.0 108.997 178.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.759 ' CE2' HG21 ' A' ' 78' ' ' THR . 7.1 m-85 -90.3 127.42 36.16 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.589 -179.043 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.428 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 1.1 m-20 -93.88 113.36 25.36 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 178.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 57.48 -136.51 50.6 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.025 -1.084 . . . . 0.0 110.959 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -71.17 -19.2 29.89 Favored 'Trans proline' 0 N--CA 1.465 -0.192 0 C-N-CA 122.385 2.056 . . . . 0.0 112.08 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' TRP . . . . . 0.404 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -111.4 -174.0 2.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.505 -178.864 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.675 HG21 ' SG ' ' A' ' 71' ' ' CYS . 1.4 tt -121.44 149.33 24.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.172 0.51 . . . . 0.0 112.198 -179.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.415 ' N ' HG13 ' A' ' 46' ' ' ILE . . . -105.42 -40.33 5.84 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.832 -179.433 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.575 ' HG3' ' HB3' ' A' ' 40' ' ' HIS . 1.6 ptp180 -149.58 153.24 36.8 Favored 'General case' 0 CA--C 1.523 -0.084 0 C-N-CA 120.542 -0.463 . . . . 0.0 111.512 -179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.71 ' OE1' HD12 ' A' ' 61' ' ' LEU . 6.7 tt0 -148.23 156.11 42.17 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.896 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.782 ' HE1' HD11 ' A' ' 52' ' ' LEU . 22.8 ptm -142.61 122.64 13.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.297 179.523 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.477 ' O ' ' HA ' ' A' ' 58' ' ' PRO . 0.0 OUTLIER -98.78 126.51 44.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.324 -179.405 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.833 HD12 ' CE1' ' A' ' 38' ' ' TYR . 20.4 mt -128.21 112.05 14.09 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.752 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -140.02 134.63 15.87 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.2 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -50.99 -26.19 17.95 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.399 2.066 . . . . 0.0 112.234 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -96.68 -28.76 14.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.949 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.44 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 5.5 mttp -116.26 121.68 33.23 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.79 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.44 ' HD2' ' HA ' ' A' ' 56' ' ' LYS . 9.5 Cg_endo -50.94 169.63 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.341 2.028 . . . . 0.0 112.111 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.477 ' HA ' ' O ' ' A' ' 51' ' ' GLU . 19.2 Cg_endo -60.84 78.54 0.07 OUTLIER 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.536 2.157 . . . . 0.0 112.477 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 11.8 mt -65.46 89.96 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 121.075 0.464 . . . . 0.0 110.7 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.504 HD13 ' HA2' ' A' ' 102' ' ' GLY . 7.2 mt -68.68 113.72 6.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.558 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.932 HD21 ' HB3' ' A' ' 69' ' ' GLU . 5.7 mt -101.96 155.72 17.98 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.399 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.588 HG13 ' O ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -164.52 140.08 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.867 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.12 161.2 7.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.928 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.403 ' HA3' ' HB2' ' A' ' 116' ' ' ARG . . . 79.39 -69.86 2.92 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.84 -179.581 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -45.12 73.12 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.043 0.449 . . . . 0.0 110.426 179.561 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.479 ' OD2' HD23 ' A' ' 61' ' ' LEU . 21.9 m-20 -114.35 52.64 0.83 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.569 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -62.46 -38.22 88.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.107 -179.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 75.7 mmm -85.64 -31.08 22.75 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.949 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.932 ' HB3' HD21 ' A' ' 61' ' ' LEU . 0.3 OUTLIER -75.52 -36.54 60.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.049 -179.754 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.86 ' HA ' HD13 ' A' ' 61' ' ' LEU . 0.2 OUTLIER -47.42 172.45 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.244 179.861 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.675 ' SG ' HG21 ' A' ' 46' ' ' ILE . 21.5 p -45.88 -41.55 11.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.181 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.424 ' CB ' ' O ' ' A' ' 71' ' ' CYS . 10.5 tt0 82.19 -13.78 0.83 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.84 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.88 -176.41 3.05 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.908 0.385 . . . . 0.0 110.864 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -106.4 174.07 6.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.463 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.496 HD11 ' CZ ' ' A' ' 15' ' ' PHE . 32.4 tp -56.21 -44.21 79.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.461 -179.604 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -70.96 -46.18 62.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.714 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.48 -28.88 65.33 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -178.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.759 HG21 ' CE2' ' A' ' 41' ' ' PHE . 0.9 OUTLIER -56.49 -67.28 0.32 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.736 0.303 . . . . 0.0 111.243 -179.589 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 131.46 -20.28 4.69 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.876 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.582 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 6.7 mt -53.22 -29.91 34.95 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.977 0.418 . . . . 0.0 110.822 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 11.2 p -86.24 -43.36 13.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.737 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.53 -30.18 69.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.703 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.634 ' CD ' HG21 ' A' ' 17' ' ' ILE . 43.6 mttt -67.45 -177.25 0.69 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.978 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 20.5 mmt85 -81.62 73.75 8.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.1 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.92 65.05 3.81 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.65 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.582 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -76.82 -5.35 47.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.573 0.225 . . . . 0.0 111.501 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -55.03 150.03 11.02 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.973 0.416 . . . . 0.0 111.147 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.854 HG21 ' HB3' ' A' ' 16' ' ' ARG . 9.8 pt -136.46 169.45 20.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.135 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.893 HD12 ' HB2' ' A' ' 91' ' ' ARG . 1.0 OUTLIER -82.58 146.17 52.79 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.757 179.789 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -67.34 -24.78 42.92 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.557 2.171 . . . . 0.0 112.534 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.893 ' HB2' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -60.35 -54.1 49.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.992 -179.926 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.414 ' HG3' HD21 ' A' ' 89' ' ' LEU . 5.9 mm-40 -58.61 -49.0 79.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.006 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -55.66 -53.32 58.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.714 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.83 -21.82 65.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.791 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.74 -50.59 68.48 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.059 0.457 . . . . 0.0 109.862 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.405 ' HB ' ' CE ' ' A' ' 50' ' ' MET . 18.8 mm -77.85 -34.48 19.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.71 179.376 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.56 ' HZ2' HD12 ' A' ' 106' ' ' LEU . 28.0 t-105 -52.59 -40.68 62.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.909 179.421 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -86.12 -30.91 22.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.425 179.089 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -57.34 -54.23 49.19 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.424 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 73.7 m -74.69 -75.85 0.15 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.162 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.418 ' C ' HD13 ' A' ' 60' ' ' LEU . . . 171.25 38.32 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.619 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.504 ' HA2' HD13 ' A' ' 60' ' ' LEU . . . -69.21 -41.7 78.61 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.342 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.583 HG23 ' HG ' ' A' ' 124' ' ' LEU . 37.1 mm -65.15 -44.08 95.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.757 0.313 . . . . 0.0 110.824 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -49.09 78.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.328 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.421 ' CE2' ' CG2' ' A' ' 62' ' ' VAL . 2.2 t80 -62.6 -37.89 88.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.065 179.36 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.68 HD13 ' CD1' ' A' ' 124' ' ' LEU . 0.1 OUTLIER -69.1 -35.72 76.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.442 179.462 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.91 -33.24 75.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.306 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 2.6 m -68.78 -49.92 54.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.3 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.418 ' HB3' ' HB2' ' A' ' 115' ' ' ALA . . . -69.07 -34.79 75.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.398 0.618 . . . . 0.0 109.772 179.008 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.727 HD11 ' HA ' ' A' ' 121' ' ' THR . 2.6 mt -56.94 -47.13 83.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.61 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -72.15 -33.1 67.47 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.562 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 10.0 t -77.57 -8.94 58.6 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.23 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 112' ' ' SER . 74.1 mmt-85 68.81 26.83 5.9 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 120.907 0.384 . . . . 0.0 111.105 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -108.92 -21.9 12.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.774 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.418 ' HB2' ' HB3' ' A' ' 109' ' ' ALA . . . -56.81 -22.62 37.64 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.365 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.549 ' HG2' HG23 ' A' ' 118' ' ' THR . 2.2 ttt180 68.49 81.83 0.2 Allowed Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.835 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.536 ' HB2' ' HG2' ' A' ' 5' ' ' GLU . 68.7 Cg_exo -51.85 89.42 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.654 2.236 . . . . 0.0 112.489 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.549 HG23 ' HG2' ' A' ' 116' ' ' ARG . 71.5 p -117.9 -36.64 3.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.889 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.439 ' HA ' HG23 ' A' ' 6' ' ' ILE . 12.0 t80 -176.3 -49.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.126 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -55.02 -52.14 64.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.215 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.727 ' HA ' HD11 ' A' ' 110' ' ' ILE . 70.5 p -59.58 -45.21 92.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.629 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.703 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -54.94 -55.48 30.18 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 121.662 0.744 . . . . 0.0 109.627 179.118 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' MET . . . . . 0.467 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -57.58 -32.75 67.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.784 178.492 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.68 ' CD1' HD13 ' A' ' 106' ' ' LEU . 0.1 OUTLIER -67.82 -41.98 82.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.079 178.724 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.466 ' HA ' HD12 ' A' ' 128' ' ' LEU . 29.0 mm100 -52.66 -44.53 66.25 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.329 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ASN . . . . . 0.432 ' OD1' ' HA ' ' A' ' 123' ' ' MET . 0.9 OUTLIER -81.08 -27.73 35.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.66 179.465 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.467 HD13 ' CE ' ' A' ' 123' ' ' MET . 1.0 OUTLIER -64.82 -19.26 65.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.851 0.358 . . . . 0.0 110.344 178.958 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.466 HD12 ' HA ' ' A' ' 125' ' ' GLN . 17.8 mt -73.23 -19.93 60.97 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.241 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 3.2 mptt . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.002 -179.992 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.806 0.336 . . . . 0.0 111.008 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.928 ' O ' HD12 ' A' ' 6' ' ' ILE . 88.0 mtm-85 -58.37 -59.0 6.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.056 0.455 . . . . 0.0 110.994 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.445 ' H ' ' HG2' ' A' ' 3' ' ' GLN . 1.9 mm100 -54.13 -34.48 60.44 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.117 0.484 . . . . 0.0 110.065 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.1 mm100 -66.34 -38.9 88.7 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.184 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.438 ' HG2' ' HA ' ' A' ' 2' ' ' ARG . 16.7 pt-20 -79.14 -44.28 22.31 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.785 0.326 . . . . 0.0 110.904 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.928 HD12 ' O ' ' A' ' 2' ' ' ARG . 2.8 mp -72.68 -58.82 4.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.531 0.681 . . . . 0.0 109.898 178.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.6 t70 38.4 83.13 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.575 -1.193 . . . . 0.0 111.738 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -76.24 0.07 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.877 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.9 29.73 0.77 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.397 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -140.73 -168.36 2.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.003 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.84 153.36 17.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.023 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.437 ' HG2' ' CZ ' ' A' ' 119' ' ' TYR . 13.5 mp0 -122.1 102.94 8.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.888 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.503 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -108.99 136.99 47.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.007 0.432 . . . . 0.0 110.833 -179.822 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.508 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 0.4 OUTLIER -119.55 138.87 52.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.189 -179.701 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.826 ' HB2' HD13 ' A' ' 80' ' ' LEU . 5.5 m-85 -142.3 152.15 42.69 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.463 0.649 . . . . 0.0 112.685 -178.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.493 ' HA ' ' O ' ' A' ' 37' ' ' TRP . 8.2 ttp180 -149.59 147.41 28.11 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 114.836 -1.074 . . . . 0.0 109.59 179.14 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.671 HD13 HD23 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -153.4 129.53 5.35 Favored Pre-proline 0 C--N 1.331 -0.235 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.455 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 52.8 Cg_endo -91.88 117.57 0.45 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 123.23 2.62 . . . . 0.0 111.621 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -135.76 160.03 39.81 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.12 0.486 . . . . 0.0 111.558 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.605 HG12 ' HD3' ' A' ' 34' ' ' LYS . 1.9 mt -102.18 147.24 9.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.186 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.9 mtp180 -75.25 141.51 74.03 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.118 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.476 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 11.5 Cg_endo -55.13 -52.36 8.07 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.584 2.189 . . . . 0.0 112.702 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.568 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -53.46 -58.83 5.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.377 -179.551 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.559 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 20.2 m-20 -67.09 -30.7 70.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.109 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.59 -56.54 14.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.469 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.568 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.3 p90 -91.39 -16.85 26.74 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.659 -179.483 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.559 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 0.6 OUTLIER -59.51 -45.16 92.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.794 0.331 . . . . 0.0 110.784 179.668 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -168.11 133.18 1.51 Allowed Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.267 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -67.43 -13.49 39.38 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.57 2.18 . . . . 0.0 112.271 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -98.1 -34.29 10.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.383 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -98.54 26.63 5.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.823 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.464 ' HB3' HG21 ' A' ' 20' ' ' ILE . 40.9 mttt -57.98 -67.18 0.37 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.457 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.1 mmmm 60.06 116.4 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.925 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.605 ' HD3' HG12 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -108.38 143.49 37.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.002 0.429 . . . . 0.0 110.964 179.788 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -95.45 139.01 14.27 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.21 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.483 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 12.8 m-90 -97.68 111.08 23.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.112 0.482 . . . . 0.0 110.495 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.575 ' HZ3' HD11 ' A' ' 80' ' ' LEU . 12.1 t90 -95.7 117.5 30.63 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.551 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.805 ' CE1' HD12 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -117.86 144.8 45.08 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.153 179.001 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.692 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.32 124.5 0.72 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.122 0.487 . . . . 0.0 111.696 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.503 ' HB3' ' HG3' ' A' ' 48' ' ' ARG . 8.8 t-160 -92.64 104.34 16.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.341 178.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.645 ' CE2' HG21 ' A' ' 78' ' ' THR . 3.5 m-85 -86.86 153.02 21.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.179 0.514 . . . . 0.0 111.658 -178.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.453 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 28.1 p-10 -123.19 114.06 19.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.073 178.714 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 59.23 -135.49 51.61 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 119.892 -1.147 . . . . 0.0 111.151 -178.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.402 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 7.6 Cg_exo -72.7 -17.61 25.92 Favored 'Trans proline' 0 N--CA 1.464 -0.227 0 C-N-CA 122.506 2.137 . . . . 0.0 112.469 179.541 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' TRP . . . . . 0.421 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.7 OUTLIER -116.02 -165.91 1.09 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.514 -178.584 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.82 HD11 ' O ' ' A' ' 48' ' ' ARG . 2.4 tt -128.1 151.87 35.47 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-O 121.122 0.487 . . . . 0.0 111.927 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -103.03 -40.78 6.34 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.531 -0.758 . . . . 0.0 111.816 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.82 ' O ' HD11 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -144.85 154.28 42.49 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 120.7 -0.4 . . . . 0.0 111.396 -179.535 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.412 ' OE1' ' CZ2' ' A' ' 37' ' ' TRP . 7.9 tt0 -141.13 141.73 34.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.362 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.418 ' SD ' HD11 ' A' ' 52' ' ' LEU . 5.3 ttm -135.99 111.64 9.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.178 179.412 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.489 ' HB3' ' HB ' ' A' ' 59' ' ' ILE . 4.5 tt0 -102.82 137.41 41.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.892 0.377 . . . . 0.0 111.523 -179.451 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.805 HD12 ' CE1' ' A' ' 38' ' ' TYR . 3.2 mt -133.79 124.78 27.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.8 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.421 ' CD2' ' HG2' ' A' ' 51' ' ' GLU . 25.6 m-70 -139.33 134.61 16.61 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.537 -0.302 . . . . 0.0 111.1 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -50.64 -25.71 15.45 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.54 2.16 . . . . 0.0 112.245 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -99.53 -27.37 13.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.006 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -114.47 118.99 40.8 Favored Pre-proline 0 C--O 1.234 0.262 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.826 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -49.7 177.37 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.565 2.177 . . . . 0.0 112.559 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -58.67 85.74 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.699 2.266 . . . . 0.0 112.216 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.489 ' HB ' ' HB3' ' A' ' 51' ' ' GLU . 44.4 mt -71.34 101.28 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.77 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.496 HD21 ' N ' ' A' ' 102' ' ' GLY . 1.1 mp -78.66 144.66 35.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.096 -179.687 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.804 HD13 ' HA ' ' A' ' 70' ' ' MET . 84.5 mt -146.21 151.17 37.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.966 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.5 p -156.48 149.88 10.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.987 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.69 140.47 58.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.209 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.56 -49.46 1.46 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.332 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.492 ' HD2' ' HB2' ' A' ' 109' ' ' ALA . 0.1 OUTLIER -88.08 -63.03 1.36 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.885 0.374 . . . . 0.0 110.727 179.809 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.779 ' HB3' HD22 ' A' ' 61' ' ' LEU . 18.6 m-20 -101.24 55.01 0.83 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.8 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.06 -27.26 63.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.971 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 50.0 mtp -84.77 -28.9 25.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.991 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -87.49 -42.08 13.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.09 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.804 ' HA ' HD13 ' A' ' 61' ' ' LEU . 4.8 ptm -57.25 -166.92 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.074 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.574 ' SG ' HG22 ' A' ' 78' ' ' THR . 17.0 t -81.52 104.5 11.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.087 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -73.77 -17.96 61.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.935 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -78.84 177.12 8.96 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.018 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.526 ' O ' HG23 ' A' ' 78' ' ' THR . 9.4 m120 -105.37 -173.59 2.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.857 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.696 HD11 HG21 ' A' ' 81' ' ' THR . 0.7 OUTLIER -54.72 -53.08 59.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.744 -179.462 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -71.58 -54.36 10.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.871 0.367 . . . . 0.0 111.787 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.03 -38.2 36.57 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.496 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.645 HG21 ' CE2' ' A' ' 41' ' ' PHE . 2.0 p -48.12 -61.56 1.92 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.777 0.322 . . . . 0.0 111.543 -179.245 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 125.15 -28.68 5.04 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.703 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.826 HD13 ' HB2' ' A' ' 15' ' ' PHE . 1.1 mt -49.05 -45.55 43.07 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.998 0.428 . . . . 0.0 110.737 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.696 HG21 HD11 ' A' ' 75' ' ' LEU . 0.6 OUTLIER -74.89 -32.26 61.8 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.46 179.695 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 5.9 mmm180 -61.74 -32.07 72.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.493 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.686 ' HD2' ' HB2' ' A' ' 86' ' ' ALA . 0.1 OUTLIER -86.3 -174.65 5.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.631 179.82 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 8.4 mpt_? -102.47 119.48 38.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.946 0.403 . . . . 0.0 111.123 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 60.65 85.25 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.749 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.686 ' HB2' ' HD2' ' A' ' 83' ' ' LYS . . . -130.92 19.79 5.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.639 0.257 . . . . 0.0 111.244 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.48 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 30.5 mt-10 -99.83 160.0 14.64 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.959 0.409 . . . . 0.0 111.239 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.468 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 0.8 OUTLIER -138.16 174.51 10.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.042 179.916 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.479 HD12 ' H ' ' A' ' 92' ' ' GLN . 0.4 OUTLIER -98.06 147.99 33.85 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.545 179.584 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -66.97 -22.98 47.43 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.483 2.122 . . . . 0.0 112.7 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -54.79 40.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.786 0.327 . . . . 0.0 111.082 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.479 ' H ' HD12 ' A' ' 89' ' ' LEU . 0.9 OUTLIER -70.51 -34.84 72.78 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.03 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.472 ' CE1' ' HD3' ' A' ' 48' ' ' ARG . 21.8 t80 -62.64 -53.23 57.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.482 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.81 -22.05 63.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.548 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.11 -50.82 71.67 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 179.157 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.564 HG21 HD11 ' A' ' 52' ' ' LEU . 17.5 mm -71.53 -35.93 58.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.259 178.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.436 ' CZ3' ' HG ' ' A' ' 60' ' ' LEU . 18.4 t-105 -53.45 -40.49 65.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.029 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -85.72 -23.93 27.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.816 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.427 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 7.4 mtt-85 -56.85 -54.1 50.28 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.053 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 43.1 t -81.51 -81.32 0.14 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.037 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -173.98 39.64 0.13 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.553 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.496 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -61.33 -55.23 30.36 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.634 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.453 HD12 HD22 ' A' ' 127' ' ' LEU . 10.1 mm -57.18 -42.95 80.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.769 0.318 . . . . 0.0 111.173 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -65.25 -49.28 70.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.681 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -60.57 -40.07 90.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.514 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.795 HD12 HD11 ' A' ' 110' ' ' ILE . 0.2 OUTLIER -70.38 -45.93 65.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.87 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.446 ' HG2' HD23 ' A' ' 124' ' ' LEU . 0.9 OUTLIER -61.88 -29.95 70.54 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.988 179.918 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 54.6 p -72.55 -50.32 26.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.805 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.492 ' HB2' ' HD2' ' A' ' 65' ' ' LYS . . . -68.93 -35.9 77.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.579 0.704 . . . . 0.0 109.161 178.833 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.795 HD11 HD12 ' A' ' 106' ' ' LEU . 13.6 mt -58.59 -44.3 89.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.912 178.772 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.96 -43.13 83.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.535 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 5.9 m -72.58 -10.09 59.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.246 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.435 ' HB2' ' O ' ' A' ' 112' ' ' SER . 16.3 mmt180 75.39 27.28 1.07 Allowed 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.909 0.385 . . . . 0.0 110.987 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -92.31 -28.67 16.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.384 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.511 ' HB1' ' CG2' ' A' ' 121' ' ' THR . . . -82.95 94.66 7.78 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.749 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.8 ptt180 -53.29 118.37 14.1 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.218 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -52.96 88.53 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.519 2.146 . . . . 0.0 112.124 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 5.2 t -110.2 -46.29 3.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.052 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.437 ' CZ ' ' HG2' ' A' ' 12' ' ' GLN . 9.8 t80 -177.36 -54.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.187 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.468 ' O ' ' HG3' ' A' ' 123' ' ' MET . . . -53.82 -40.31 66.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.863 0.363 . . . . 0.0 111.177 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.527 HG22 ' CD1' ' A' ' 106' ' ' LEU . 62.6 p -69.27 -43.74 73.29 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.481 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.659 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -58.57 -58.12 9.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.172 0.511 . . . . 0.0 110.239 179.186 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' MET . . . . . 0.612 ' HE2' ' N ' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -55.36 -29.93 59.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.046 179.119 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.612 ' N ' ' HE2' ' A' ' 123' ' ' MET . 0.1 OUTLIER -67.17 -48.94 66.46 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 121.022 0.439 . . . . 0.0 109.852 178.805 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.513 ' HA ' HD12 ' A' ' 128' ' ' LEU . 75.7 mm-40 -50.01 -39.62 41.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.796 179.188 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -80.09 -35.16 37.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.059 178.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.453 HD22 HD12 ' A' ' 103' ' ' ILE . 0.6 OUTLIER -57.81 -20.29 34.63 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.652 179.046 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.513 HD12 ' HA ' ' A' ' 125' ' ' GLN . 9.6 mt -82.51 -23.02 34.82 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.141 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 12.2 mmtp . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.164 -0.922 . . . . 0.0 110.927 179.906 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.413 ' HB1' ' HB3' ' A' ' 4' ' ' GLN . . . . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.832 0.349 . . . . 0.0 111.095 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.943 ' O ' HD12 ' A' ' 6' ' ' ILE . 1.5 mtm180 -55.5 -57.45 11.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.832 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.82 -40.55 66.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.851 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.413 ' HB3' ' HB1' ' A' ' 1' ' ' ALA . 4.7 tp-100 -58.08 -37.41 74.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.613 179.69 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -71.49 -56.85 5.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.987 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.943 HD12 ' O ' ' A' ' 2' ' ' ARG . 2.8 mp -54.05 -62.69 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.349 179.025 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.0 t70 47.72 92.19 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.083 -179.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.0 mtm -87.51 67.2 9.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.565 0.698 . . . . 0.0 110.715 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.3 mttp -148.69 34.25 0.77 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.791 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -121.58 -166.61 1.4 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.012 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -93.04 125.25 37.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.986 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.447 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 3.7 mp0 -111.96 102.8 11.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.974 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.538 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 2.9 mtt180 -113.92 126.8 55.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.977 0.418 . . . . 0.0 110.953 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.493 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 2.2 m-85 -109.0 134.99 50.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.884 179.715 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.819 ' CB ' HD22 ' A' ' 80' ' ' LEU . 2.6 m-85 -131.25 152.65 50.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.29 0.567 . . . . 0.0 112.335 -178.374 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.523 ' CB ' HG21 ' A' ' 88' ' ' ILE . 41.3 ttp85 -149.28 148.06 29.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.92 179.68 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.616 HG23 ' HB1' ' A' ' 86' ' ' ALA . 0.3 OUTLIER -152.08 121.73 3.45 Favored Pre-proline 0 C--N 1.329 -0.286 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.646 179.905 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -86.15 88.41 0.78 Allowed 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.93 2.42 . . . . 0.0 112.32 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.7 p90 -116.0 139.66 50.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.931 0.396 . . . . 0.0 111.02 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.735 HG23 ' O ' ' A' ' 33' ' ' LYS . 13.2 mt -86.85 142.58 12.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.927 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.8 110.22 2.35 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.118 179.369 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.499 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 76.4 Cg_exo -39.76 -51.84 2.83 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.795 2.33 . . . . 0.0 112.863 -179.393 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.545 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -50.07 -58.76 4.83 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.871 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.555 ' HA ' ' HG2' ' A' ' 27' ' ' LYS . 6.1 m-20 -67.07 -33.05 74.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.24 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.421 ' HB3' ' HA ' ' A' ' 22' ' ' PRO . 0.0 OUTLIER -52.07 -43.55 63.89 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.736 -178.904 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.545 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.7 p90 -104.59 -34.93 8.02 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -178.031 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.555 ' HG2' ' HA ' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -61.84 -32.31 72.63 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.664 -0.415 . . . . 0.0 111.601 -178.774 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.406 ' CB ' ' HB2' ' A' ' 31' ' ' ASN . 67.7 m-20 -150.2 120.32 3.83 Favored Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 120.844 -0.343 . . . . 0.0 111.523 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -72.67 -7.84 21.47 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.539 2.159 . . . . 0.0 112.321 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -109.81 -32.41 7.08 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.937 0.399 . . . . 0.0 110.394 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.406 ' HB2' ' CB ' ' A' ' 28' ' ' ASP . 84.2 m-20 -97.72 28.18 3.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.658 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.641 ' HB3' HG21 ' A' ' 20' ' ' ILE . 13.5 mttt -59.83 -59.05 6.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.918 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.735 ' O ' HG23 ' A' ' 20' ' ' ILE . 17.8 mmtt 70.54 113.78 0.05 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.599 -179.58 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.409 ' HD2' HG12 ' A' ' 20' ' ' ILE . 0.3 OUTLIER -83.01 110.86 18.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.489 -179.938 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.592 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -91.34 117.59 5.22 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.833 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 10.1 m-90 -97.84 126.24 43.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.853 0.359 . . . . 0.0 110.431 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.541 ' CZ3' HD11 ' A' ' 80' ' ' LEU . 11.2 t90 -113.65 119.87 38.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.614 -179.192 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.799 ' CE1' HD12 ' A' ' 52' ' ' LEU . 4.1 m-85 -115.96 150.46 37.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.941 178.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.535 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -170.45 123.75 0.68 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.161 0.505 . . . . 0.0 111.61 179.81 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.493 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 18.0 t-160 -93.17 98.28 11.19 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.451 178.736 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.669 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 20.4 m-85 -85.93 127.31 34.58 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.426 -179.146 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.551 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 25.0 p-10 -93.7 110.99 22.59 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 178.53 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 58.93 -134.53 52.44 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.053 -1.07 . . . . 0.0 111.122 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo -71.66 -19.64 27.62 Favored 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 122.489 2.126 . . . . 0.0 112.204 179.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' TRP . . . . . 0.423 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.6 OUTLIER -112.82 -170.11 1.61 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.274 -178.851 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.686 HD13 ' SG ' ' A' ' 71' ' ' CYS . 3.2 tt -127.35 151.69 34.49 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-O 121.263 0.554 . . . . 0.0 112.114 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -111.6 -32.64 6.61 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.917 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.47 ' CZ ' ' CE2' ' A' ' 93' ' ' PHE . 4.2 ptm180 -157.19 154.97 30.11 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.46 -179.678 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.679 ' HB3' HD11 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -161.55 159.02 27.26 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.242 179.801 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.467 ' HE1' ' HB ' ' A' ' 96' ' ' ILE . 11.3 ttp -134.46 154.84 51.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.852 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.464 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.2 OUTLIER -129.49 117.67 20.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.897 179.694 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.799 HD12 ' CE1' ' A' ' 38' ' ' TYR . 1.3 mt -120.35 106.18 11.62 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.876 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.592 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 1.1 m80 -127.54 134.12 25.84 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.698 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -51.94 -23.44 16.58 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.342 2.028 . . . . 0.0 112.262 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -100.34 -26.95 13.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.113 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.443 ' HB2' ' HB2' ' A' ' 53' ' ' HIS . 7.9 mttt -117.84 126.02 27.61 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.977 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -54.9 173.46 0.27 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.767 2.312 . . . . 0.0 112.463 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -60.25 88.02 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.714 2.276 . . . . 0.0 112.383 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.701 HG22 ' CD2' ' A' ' 61' ' ' LEU . 75.0 mt -70.4 100.57 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.799 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.44 ' HG ' ' CH2' ' A' ' 97' ' ' TRP . 0.3 OUTLIER -77.97 123.99 27.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.693 -179.966 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.701 ' CD2' HG22 ' A' ' 59' ' ' ILE . 2.8 mm? -121.02 139.55 53.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.25 -179.626 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.2 p -149.14 139.26 16.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.951 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.616 ' HB2' ' HE1' ' A' ' 70' ' ' MET . . . -59.16 155.95 13.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.988 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.416 ' HA3' ' HB2' ' A' ' 116' ' ' ARG . . . 85.76 -63.49 4.25 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.112 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.19 -67.93 0.6 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.997 0.427 . . . . 0.0 110.483 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.467 ' CB ' HD13 ' A' ' 61' ' ' LEU . 5.6 m-20 -97.11 47.16 1.04 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.404 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.463 ' HA ' ' HG2' ' A' ' 70' ' ' MET . 1.4 t0 -63.31 -25.35 68.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.438 -179.601 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -85.56 -35.73 20.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.753 0.311 . . . . 0.0 111.151 -179.696 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.536 ' CB ' HD11 ' A' ' 61' ' ' LEU . 1.1 mp0 -80.18 -36.22 35.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.256 -179.626 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.616 ' HE1' ' HB2' ' A' ' 63' ' ' ALA . 0.7 OUTLIER -56.0 -169.36 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.876 0.37 . . . . 0.0 111.146 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.686 ' SG ' HD13 ' A' ' 46' ' ' ILE . 3.5 m -68.19 -44.38 76.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.571 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 69.23 -64.65 0.33 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.101 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 11.0 mptt -54.3 178.91 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.113 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -94.67 -168.69 1.88 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.604 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.666 HD22 HG23 ' A' ' 81' ' ' THR . 7.8 mt -71.99 -53.38 13.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.386 -179.635 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -31.69 70.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.219 -179.63 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -80.5 -36.37 33.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.327 -179.554 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.642 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 1.0 OUTLIER -61.54 -80.06 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.051 -179.772 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 147.53 -16.43 1.45 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.507 -0.854 . . . . 0.0 113.038 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.819 HD22 ' CB ' ' A' ' 15' ' ' PHE . 5.3 mt -53.89 -35.24 61.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.905 0.383 . . . . 0.0 110.915 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.666 HG23 HD22 ' A' ' 75' ' ' LEU . 22.6 p -81.81 -39.92 23.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.594 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.5 mmm180 -63.97 -30.54 71.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.545 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -165.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.728 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -102.23 83.48 2.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.778 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.15 71.26 0.78 Allowed Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.336 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.616 ' HB1' HG23 ' A' ' 17' ' ' ILE . . . -98.17 34.42 1.96 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.666 0.269 . . . . 0.0 110.978 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -90.9 147.81 22.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.224 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.523 HG21 ' CB ' ' A' ' 16' ' ' ARG . 1.3 pt -139.09 179.46 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.057 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.605 HD12 ' CB ' ' A' ' 91' ' ' ARG . 0.4 OUTLIER -106.33 149.9 38.81 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.648 179.594 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -61.98 -30.7 83.67 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.506 2.137 . . . . 0.0 112.215 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.605 ' CB ' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -56.51 -54.0 50.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.351 -179.845 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -64.02 -53.84 43.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.418 -179.685 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.47 ' CE2' ' CZ ' ' A' ' 48' ' ' ARG . 6.2 t80 -52.65 -53.23 50.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.189 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.402 ' OE2' ' NH1' ' A' ' 48' ' ' ARG . 1.2 tt0 -66.58 -22.75 66.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.39 179.562 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.09 -50.36 73.56 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.161 0.505 . . . . 0.0 109.756 179.186 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.467 ' HB ' ' HE1' ' A' ' 50' ' ' MET . 17.0 mm -71.48 -34.5 53.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.662 179.362 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.467 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 25.5 t-105 -54.33 -38.14 65.67 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.031 179.27 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.644 ' HG3' HD13 ' A' ' 103' ' ' ILE . 1.4 tt0 -85.55 -27.85 25.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.659 179.335 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.3 mtp85 -56.82 -50.65 71.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.13 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 76.6 m -84.97 -80.79 0.2 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.153 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -178.99 37.55 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.614 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.467 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -59.66 -59.59 10.27 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.492 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.923 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.8 mp -52.8 -30.39 15.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.808 0.337 . . . . 0.0 111.477 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.83 -45.34 74.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.003 0.43 . . . . 0.0 110.578 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -68.23 -39.44 82.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.42 179.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.889 ' CD1' HD13 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -69.68 -50.97 38.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.03 -179.852 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -29.59 69.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.87 0.366 . . . . 0.0 110.789 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 6.1 m -69.01 -50.12 51.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.653 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.64 -32.73 68.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.507 0.67 . . . . 0.0 109.854 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.633 HD11 ' HA ' ' A' ' 121' ' ' THR . 9.3 mt -58.97 -48.48 86.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 114.869 -1.059 . . . . 0.0 110.584 179.428 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -70.57 -35.78 73.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.578 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.5 -15.39 62.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.055 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 9.5 mmm180 74.97 35.27 0.62 Allowed 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.876 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -108.67 -27.35 9.87 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.792 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.14 -172.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.149 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.416 ' HB2' ' HA3' ' A' ' 64' ' ' GLY . 3.2 ttt180 -129.66 93.7 34.11 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.906 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -50.41 89.47 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.532 2.155 . . . . 0.0 112.323 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 6.5 p -129.07 -51.97 1.21 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.878 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.447 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 13.4 t80 -165.56 -55.49 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.265 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.436 ' O ' ' HG3' ' A' ' 123' ' ' MET . . . -53.96 -42.61 69.1 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.273 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.633 ' HA ' HD11 ' A' ' 110' ' ' ILE . 10.2 p -66.6 -38.74 87.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.686 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.907 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -67.73 -58.41 4.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.145 0.498 . . . . 0.0 110.688 179.727 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' MET . . . . . 0.436 ' HG3' ' O ' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -53.04 -29.6 30.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.414 179.521 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.923 HD11 ' HA ' ' A' ' 103' ' ' ILE . 0.4 OUTLIER -66.39 -52.74 43.62 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.02 0.438 . . . . 0.0 109.944 178.961 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -49.87 -37.04 29.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.012 179.316 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -80.99 -34.19 33.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.227 179.124 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.06 -18.85 60.08 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.398 179.082 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.9 mt -86.34 -30.25 22.35 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.88 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.146 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.853 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.537 ' HB1' ' HB3' ' A' ' 4' ' ' GLN . . . . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 121.006 0.431 . . . . 0.0 110.966 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.902 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.1 OUTLIER -56.25 -59.4 4.99 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.741 -179.998 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.29 -39.63 64.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.731 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.537 ' HB3' ' HB1' ' A' ' 1' ' ' ALA . 4.7 tp-100 -57.87 -36.74 72.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.358 179.487 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.469 ' HB2' ' HB2' ' A' ' 117' ' ' PRO . 1.0 OUTLIER -70.97 -57.04 4.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.099 179.443 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.902 HD12 ' O ' ' A' ' 2' ' ' ARG . 3.7 mp -52.45 -61.03 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.498 0.665 . . . . 0.0 109.996 178.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 53.8 t0 43.65 88.31 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.524 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.8 ptp -89.94 50.69 1.92 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.811 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.0 mttm -87.66 -35.24 18.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.904 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -180.0 3.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.93 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -82.42 158.14 23.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.015 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.445 ' HG2' ' CZ ' ' A' ' 119' ' ' TYR . 3.5 mp0 -122.02 103.45 8.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.907 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.514 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -110.79 130.0 55.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.948 0.404 . . . . 0.0 110.893 179.829 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.518 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 0.9 OUTLIER -115.27 135.15 54.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.307 -179.946 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.6 ' CE1' HD11 ' A' ' 75' ' ' LEU . 0.3 OUTLIER -140.4 153.57 46.38 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.365 0.602 . . . . 0.0 112.219 -179.713 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.675 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.58 143.0 25.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.393 179.112 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.55 HG23 ' HB1' ' A' ' 86' ' ' ALA . 0.3 OUTLIER -141.05 135.63 15.42 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 120.857 0.36 . . . . 0.0 111.919 -179.376 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.492 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 61.7 Cg_endo -92.07 103.28 0.21 Allowed 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 123.301 2.667 . . . . 0.0 112.296 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 15.1 p90 -123.31 148.79 45.6 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.937 0.398 . . . . 0.0 110.934 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.459 HG21 ' HB2' ' A' ' 32' ' ' LYS . 3.8 mt -94.3 149.25 4.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.016 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -71.86 131.13 86.01 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.678 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.575 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 77.6 Cg_exo -40.21 -60.16 0.62 Allowed 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.974 2.449 . . . . 0.0 113.138 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.635 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -45.85 -53.8 9.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.866 -179.596 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.466 ' HB3' ' HA ' ' A' ' 32' ' ' LYS . 4.3 m-20 -62.96 -34.49 77.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.257 -178.87 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.575 ' HG3' ' HA ' ' A' ' 22' ' ' PRO . 1.1 mt-30 -58.12 -57.49 12.59 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.703 0.287 . . . . 0.0 111.631 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.635 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.6 p90 -84.71 -7.5 59.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.641 -179.313 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.542 ' HD2' ' HB1' ' A' ' 23' ' ' ALA . 4.0 mtpp -74.1 -42.93 59.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.843 0.354 . . . . 0.0 110.56 179.409 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -173.07 139.0 0.85 Allowed Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.037 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.81 -21.54 33.11 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.6 2.2 . . . . 0.0 112.366 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -97.97 -31.72 12.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.715 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -100.25 42.63 1.1 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.778 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.466 ' HA ' ' HB3' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -102.26 60.44 0.84 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.508 179.703 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.411 ' HB3' ' HG2' ' A' ' 54' ' ' PRO . 13.9 mmtp -36.92 115.82 0.4 Allowed 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.679 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -85.22 134.04 34.16 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.207 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.452 ' HA2' ' HD3' ' A' ' 54' ' ' PRO . . . -120.93 138.58 12.76 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.648 -0.786 . . . . 0.0 112.531 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.492 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 29.3 m-90 -97.91 148.05 23.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.905 0.383 . . . . 0.0 110.82 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.441 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 86.4 t90 -130.93 117.36 19.14 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.909 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.891 ' CE1' HD12 ' A' ' 52' ' ' LEU . 2.2 m-85 -112.67 152.81 28.56 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.847 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.677 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.77 124.74 0.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.302 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.518 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 12.1 t-160 -93.92 101.74 13.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.151 179.336 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.758 ' CZ ' HG21 ' A' ' 78' ' ' THR . 11.0 m-85 -85.86 126.19 33.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.513 -179.51 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.469 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 4.2 m-20 -100.09 116.92 33.24 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 178.621 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 59.63 -140.09 48.18 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 119.986 -1.102 . . . . 0.0 111.014 -178.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -72.1 -12.68 28.25 Favored 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.489 2.126 . . . . 0.0 112.208 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' TRP . . . . . . . . . . . . . 1.2 m95 -118.22 -168.25 1.49 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.936 0.398 . . . . 0.0 111.95 -178.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.677 ' CD1' ' HB1' ' A' ' 39' ' ' ALA . 4.3 tt -134.73 156.12 39.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.576 -179.429 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.703 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -132.45 -28.32 1.67 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.123 -179.472 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.472 ' CB ' ' HB3' ' A' ' 40' ' ' HIS . 6.5 ttm180 -115.57 133.53 55.94 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.828 0.347 . . . . 0.0 111.107 -179.559 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.467 ' HB3' ' HB3' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -137.63 134.14 35.15 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.853 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 3.1 ttm -141.16 111.77 6.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.724 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.644 ' HB3' HD12 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -96.76 135.76 38.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.997 -179.74 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.891 HD12 ' CE1' ' A' ' 38' ' ' TYR . 38.3 mt -131.13 102.14 5.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.744 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -121.66 138.4 28.4 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.918 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.452 ' HD3' ' HA2' ' A' ' 35' ' ' GLY . 50.3 Cg_exo -54.44 -29.4 58.87 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.45 2.1 . . . . 0.0 112.388 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 37.2 p30 -95.75 -20.71 18.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.193 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.8 mttt -124.2 115.16 27.5 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.834 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -47.17 173.34 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.512 2.141 . . . . 0.0 112.451 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -54.53 88.5 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.489 2.126 . . . . 0.0 112.356 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.644 HD12 ' HB3' ' A' ' 51' ' ' GLU . 5.4 mt -65.77 104.6 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.906 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.629 ' HG ' ' HA2' ' A' ' 102' ' ' GLY . 0.0 OUTLIER -76.43 133.22 39.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.804 -179.995 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.971 HD21 ' HB3' ' A' ' 69' ' ' GLU . 0.7 OUTLIER -141.32 154.43 45.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.087 -179.928 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.5 p -157.63 144.09 9.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.826 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.703 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -55.68 151.63 10.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.855 0.359 . . . . 0.0 111.198 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.404 ' HA3' ' HB2' ' A' ' 116' ' ' ARG . . . 84.08 -63.3 4.46 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.217 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.95 -31.54 63.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.939 0.399 . . . . 0.0 110.573 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.426 ' CB ' ' HG ' ' A' ' 61' ' ' LEU . 9.3 m-20 -119.56 56.72 0.93 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.664 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.05 -32.22 73.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.071 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.57 -34.33 21.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.274 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.971 ' HB3' HD21 ' A' ' 61' ' ' LEU . 11.9 mp0 -81.15 -51.65 8.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.123 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.433 ' CE ' ' N ' ' A' ' 63' ' ' ALA . 28.0 tpp -38.36 152.1 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.415 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.42 ' O ' ' CB ' ' A' ' 72' ' ' GLU . 0.5 OUTLIER -42.04 -60.15 1.52 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.221 179.97 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.42 ' CB ' ' O ' ' A' ' 71' ' ' CYS . 0.0 OUTLIER 83.51 -21.79 0.26 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.934 179.647 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.5 ' O ' HG23 ' A' ' 78' ' ' THR . 0.7 OUTLIER -94.74 122.48 37.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.644 0.259 . . . . 0.0 110.834 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.411 ' N ' ' CG ' ' A' ' 77' ' ' GLU . 7.2 m120 -50.83 176.09 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.886 0.374 . . . . 0.0 111.053 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.89 HD12 HG23 ' A' ' 81' ' ' THR . 0.6 OUTLIER -50.65 -46.71 58.52 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.2 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.92 -56.31 12.4 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.537 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.422 ' HG3' ' CA ' ' A' ' 73' ' ' LYS . 1.1 pm0 -61.45 -18.08 57.34 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.581 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.758 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.3 OUTLIER -74.81 -63.62 1.21 Allowed 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.917 179.843 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 122.83 -12.85 8.67 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.586 -0.816 . . . . 0.0 113.101 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.9 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 3.4 mm? -54.13 -36.67 63.51 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.267 0.556 . . . . 0.0 110.387 179.778 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.89 HG23 HD12 ' A' ' 75' ' ' LEU . 45.9 p -83.94 -21.51 31.8 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.912 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 7.7 mtt180 -84.52 -11.89 55.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.592 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.624 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 0.3 OUTLIER -93.34 24.7 3.75 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.958 0.409 . . . . 0.0 111.34 -179.849 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.5 mmt85 37.73 93.94 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 77.64 46.53 9.66 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.764 -0.732 . . . . 0.0 113.585 178.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.9 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -101.82 16.6 25.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.79 0.295 . . . . 0.0 111.011 179.324 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.555 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -89.27 167.08 13.36 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.898 0.38 . . . . 0.0 111.353 -179.673 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.675 HG21 ' HB3' ' A' ' 16' ' ' ARG . 0.9 OUTLIER -143.45 -179.95 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.999 179.843 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.596 HD12 ' HB2' ' A' ' 91' ' ' ARG . 0.2 OUTLIER -101.76 155.77 36.01 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.743 179.742 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.29 -22.87 24.85 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.499 2.132 . . . . 0.0 112.404 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.596 ' HB2' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -57.91 -54.04 51.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.116 -179.847 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 10.0 mm100 -66.4 -38.28 87.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.903 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.452 ' CE1' ' HD2' ' A' ' 48' ' ' ARG . 15.3 t80 -58.28 -53.15 61.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.919 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.411 ' OE1' ' NH1' ' A' ' 48' ' ' ARG . 0.2 OUTLIER -70.13 -23.56 63.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.782 179.852 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.27 -50.95 72.03 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 179.04 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.4 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 20.5 mm -74.8 -30.79 24.89 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.954 178.695 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.436 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 24.2 t-105 -57.6 -36.4 71.7 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.737 178.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -85.41 -29.4 24.42 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.289 179.204 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.4 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 7.7 mtm180 -56.66 -52.97 62.87 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.108 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 42.6 t -83.5 -82.02 0.16 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.3 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -177.02 37.47 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.525 -0.845 . . . . 0.0 112.791 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.629 ' HA2' ' HG ' ' A' ' 60' ' ' LEU . . . -56.08 -64.39 4.43 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.416 179.691 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.935 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.7 mp -52.94 -33.54 19.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.974 0.416 . . . . 0.0 111.181 179.682 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -68.17 -45.42 73.53 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.514 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -68.03 -41.69 81.75 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.424 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.927 ' CD1' HD13 ' A' ' 124' ' ' LEU . 0.3 OUTLIER -66.91 -51.13 59.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.83 179.86 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.425 ' HA ' ' HB ' ' A' ' 110' ' ' ILE . 0.9 OUTLIER -60.39 -29.23 68.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.846 179.919 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.404 ' N ' ' HG3' ' A' ' 107' ' ' GLN . 12.3 t -68.23 -50.69 52.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.735 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.99 -33.94 70.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.5 0.667 . . . . 0.0 109.35 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.495 HD12 HD22 ' A' ' 124' ' ' LEU . 10.3 mt -56.61 -46.11 82.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.009 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -68.63 -37.7 79.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.147 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.446 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 5.2 t -72.27 -10.51 59.88 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.9 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 112' ' ' SER . 3.6 mpp_? 69.65 32.51 3.29 Favored 'General case' 0 C--O 1.23 0.079 0 CA-C-O 121.015 0.436 . . . . 0.0 111.097 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.5 mt-30 -106.3 -25.92 11.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.398 179.341 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -75.99 90.57 3.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.078 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.404 ' HB2' ' HA3' ' A' ' 64' ' ' GLY . 12.2 mtt180 -48.86 105.57 0.52 Allowed Pre-proline 0 C--N 1.331 -0.198 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.833 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.469 ' HB2' ' HB2' ' A' ' 5' ' ' GLU . 50.0 Cg_exo -53.44 98.84 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.392 2.061 . . . . 0.0 112.566 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.438 HG21 ' HB2' ' A' ' 47' ' ' ALA . 79.5 m -112.63 -43.86 3.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.609 179.788 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.622 ' HA ' HG23 ' A' ' 6' ' ' ILE . 14.8 t80 -178.23 -47.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.951 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.461 ' O ' ' HG3' ' A' ' 123' ' ' MET . . . -56.31 -39.21 72.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.265 -179.814 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.65 HG22 HD22 ' A' ' 106' ' ' LEU . 37.7 p -68.98 -37.26 78.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.506 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.632 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -59.96 -58.35 8.93 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.214 0.53 . . . . 0.0 110.332 179.406 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' MET . . . . . 0.564 ' HE1' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -58.17 -29.4 65.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.167 178.934 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.935 HD11 ' HA ' ' A' ' 103' ' ' ILE . 0.3 OUTLIER -70.28 -46.93 63.35 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.145 0.498 . . . . 0.0 109.875 178.982 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -50.73 -40.98 55.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.652 -0.703 . . . . 0.0 109.807 179.176 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 28.4 m-20 -76.1 -34.35 59.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.857 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.634 HD22 HG12 ' A' ' 103' ' ' ILE . 0.1 OUTLIER -60.14 -20.0 56.36 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.374 178.893 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.476 ' O ' HD12 ' A' ' 128' ' ' LEU . 1.0 OUTLIER -148.5 81.82 1.46 Allowed 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.938 179.991 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.988 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.914 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.453 ' HB1' ' HB3' ' A' ' 4' ' ' GLN . . . . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.989 0.423 . . . . 0.0 111.015 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.898 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.1 OUTLIER -58.44 -59.2 5.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.951 179.999 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.58 -38.28 59.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.738 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.453 ' HB3' ' HB1' ' A' ' 1' ' ' ALA . 1.2 tm0? -57.51 -47.36 82.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.885 0.374 . . . . 0.0 110.29 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -55.82 -53.54 55.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.134 -0.485 . . . . 0.0 109.931 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.898 HD12 ' O ' ' A' ' 2' ' ' ARG . 3.3 mp -56.24 -58.79 4.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.231 179.009 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.404 ' C ' ' O ' ' A' ' 6' ' ' ILE . 1.0 OUTLIER 30.79 72.91 0.06 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.904 -1.044 . . . . 0.0 111.853 -179.923 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.703 ' HG3' HG22 ' A' ' 6' ' ' ILE . 3.9 mtm -66.58 -72.8 0.15 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.163 -179.778 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.0 mtmm 50.27 29.72 3.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.137 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.6 176.12 8.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.997 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -81.59 137.28 35.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.995 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.445 ' HG3' ' CE2' ' A' ' 119' ' ' TYR . 33.7 mm-40 -100.72 102.74 13.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.751 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.572 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -110.27 124.75 52.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.031 -179.45 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.502 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 1.1 m-85 -110.77 152.91 26.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.473 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.777 ' HB2' HD22 ' A' ' 80' ' ' LEU . 4.4 m-85 -152.2 152.73 32.61 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.367 0.603 . . . . 0.0 112.178 -179.559 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.721 ' NH1' HD12 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -148.96 139.43 22.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.394 179.217 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.506 HG23 ' HB1' ' A' ' 86' ' ' ALA . 0.1 OUTLIER -142.25 125.72 9.6 Favored Pre-proline 0 C--N 1.329 -0.295 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.731 -179.319 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.501 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 67.9 Cg_endo -89.86 101.71 0.32 Allowed 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 123.065 2.51 . . . . 0.0 112.155 179.764 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.1 p90 -120.02 145.42 46.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.856 0.36 . . . . 0.0 110.912 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.481 HG12 ' HG3' ' A' ' 34' ' ' LYS . 3.0 mt -89.63 150.34 3.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.925 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.402 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 0.5 OUTLIER -72.15 126.65 91.1 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.719 179.963 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.596 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 70.3 Cg_exo -39.83 -60.33 0.57 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.043 2.495 . . . . 0.0 113.097 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.672 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -44.87 -52.71 8.33 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.837 -179.576 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.516 ' HB3' ' HA ' ' A' ' 32' ' ' LYS . 2.1 m-20 -65.62 -37.06 85.52 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.508 -178.829 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.596 ' HG3' ' HA ' ' A' ' 22' ' ' PRO . 4.0 mt-30 -54.91 -57.53 11.27 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -178.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.672 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.0 p90 -83.75 -16.75 43.6 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.706 -179.22 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.436 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -60.98 -47.1 88.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.755 0.312 . . . . 0.0 110.286 179.564 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 177.08 141.28 0.24 Allowed Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.124 179.378 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.42 -19.01 66.08 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.621 2.214 . . . . 0.0 112.289 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -86.34 -39.43 16.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.589 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -105.87 57.83 0.66 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.69 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.516 ' HA ' ' HB3' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -111.7 54.76 0.68 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.607 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.455 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.2 OUTLIER -41.58 138.46 1.35 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.549 -179.844 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.481 ' HG3' HG12 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -107.93 144.03 35.75 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.046 0.451 . . . . 0.0 111.862 -179.42 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -121.28 129.44 7.76 Favored Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.807 179.142 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.501 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 28.9 m-90 -98.08 133.99 41.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.013 0.435 . . . . 0.0 111.146 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.649 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 15.6 t90 -113.48 117.27 31.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.965 -179.537 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.686 ' CE1' HD12 ' A' ' 52' ' ' LEU . 10.9 m-85 -110.38 147.57 33.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.219 179.534 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.843 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -170.13 124.71 0.75 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.059 0.457 . . . . 0.0 111.992 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.504 ' HB3' ' CB ' ' A' ' 48' ' ' ARG . 12.7 t-160 -97.68 98.04 9.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.375 178.776 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.777 ' CZ ' HG21 ' A' ' 78' ' ' THR . 11.8 m-85 -85.32 119.34 25.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.715 -178.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.463 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 3.3 p-10 -91.21 114.8 27.43 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 178.451 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 57.69 -135.95 51.23 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 119.908 -1.139 . . . . 0.0 111.153 -178.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -72.62 -17.31 26.44 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 122.536 2.158 . . . . 0.0 112.444 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -115.36 -172.67 2.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.946 0.403 . . . . 0.0 111.8 -178.595 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.771 HD11 ' O ' ' A' ' 48' ' ' ARG . 2.8 tt -131.98 153.67 38.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.726 -179.567 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.409 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -127.24 -26.77 3.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.646 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.771 ' O ' HD11 ' A' ' 46' ' ' ILE . 2.1 ttp180 -117.5 136.77 53.0 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-O 120.817 0.341 . . . . 0.0 111.295 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.843 ' NE2' ' HB2' ' A' ' 39' ' ' ALA . 0.7 OUTLIER -145.12 132.48 20.65 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.887 179.967 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 2.5 ttm -143.48 129.45 19.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.677 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.482 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -114.11 140.71 48.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.165 -179.61 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.686 HD12 ' CE1' ' A' ' 38' ' ' TYR . 31.1 mt -135.29 108.53 7.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.811 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 -135.85 138.2 27.29 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.858 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.406 ' HG2' ' HB3' ' A' ' 33' ' ' LYS . 9.9 Cg_endo -52.8 -23.88 22.03 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.602 2.201 . . . . 0.0 112.254 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -96.18 -28.71 14.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.999 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 1.8 mtpp -118.3 122.14 30.51 Favored Pre-proline 0 C--O 1.233 0.229 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.844 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.36 -179.99 0.07 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.582 2.188 . . . . 0.0 112.237 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.417 ' O ' HD13 ' A' ' 60' ' ' LEU . 42.4 Cg_exo -56.75 85.08 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.545 2.163 . . . . 0.0 112.332 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.57 HG22 ' HG ' ' A' ' 61' ' ' LEU . 91.1 mt -65.42 98.06 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.8 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.469 HD21 ' N ' ' A' ' 102' ' ' GLY . 0.4 OUTLIER -82.2 112.83 19.58 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.703 -179.975 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.57 ' HG ' HG22 ' A' ' 59' ' ' ILE . 71.9 mt -123.6 148.24 46.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.071 0.462 . . . . 0.0 111.324 -179.64 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.641 HG12 ' HE2' ' A' ' 105' ' ' TYR . 13.4 p -149.43 150.66 13.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.787 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.417 ' HB1' ' HD3' ' A' ' 116' ' ' ARG . . . -58.38 145.81 36.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.846 0.355 . . . . 0.0 111.305 -179.698 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.409 ' HA3' ' HB2' ' A' ' 116' ' ' ARG . . . 87.92 -61.41 4.05 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.159 -179.743 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.542 ' NZ ' ' HB2' ' A' ' 109' ' ' ALA . 0.8 OUTLIER -72.23 -68.38 0.47 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.896 0.379 . . . . 0.0 110.603 179.735 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.427 ' HB3' HD22 ' A' ' 61' ' ' LEU . 0.7 OUTLIER -98.91 36.56 1.66 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.607 179.753 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.5 -21.28 36.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.284 -179.746 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 3.6 mpp? -82.13 -31.92 30.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.848 0.356 . . . . 0.0 110.659 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.449 ' HB3' HD13 ' A' ' 61' ' ' LEU . 1.9 mm-40 -84.69 -43.91 13.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.718 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.523 ' HE2' ' HB2' ' A' ' 49' ' ' GLN . 47.5 ttm -55.55 163.47 1.29 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.608 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.735 ' SG ' HG22 ' A' ' 78' ' ' THR . 0.5 OUTLIER -55.72 120.53 7.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.819 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -88.15 8.14 28.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.384 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.467 ' O ' HG23 ' A' ' 78' ' ' THR . 0.0 OUTLIER -117.4 144.71 44.69 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.901 179.884 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.456 ' O ' HG23 ' A' ' 78' ' ' THR . 8.7 m120 -65.59 -176.63 0.36 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.666 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.642 HD11 ' CZ ' ' A' ' 15' ' ' PHE . 28.1 tp -64.98 -43.83 91.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.407 -179.652 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.46 -31.87 69.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.066 -179.676 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -86.95 -26.03 24.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.666 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.777 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.7 OUTLIER -58.84 -76.44 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.771 0.32 . . . . 0.0 111.101 -179.762 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 140.27 -22.32 2.75 Favored Glycine 0 N--CA 1.453 -0.18 0 C-N-CA 120.51 -0.853 . . . . 0.0 113.005 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.777 HD22 ' HB2' ' A' ' 15' ' ' PHE . 1.0 OUTLIER -49.01 -42.8 39.26 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.89 0.376 . . . . 0.0 110.914 -179.908 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 45.7 p -71.75 -34.5 69.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.714 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -59.1 -33.47 70.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.6 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.96 179.69 0.5 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.915 179.719 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.9 mpp_? -93.91 73.34 4.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.572 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 78.63 66.62 1.7 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.232 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.591 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -93.31 24.94 3.59 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.689 0.281 . . . . 0.0 111.524 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.424 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 47.1 mt-10 -80.61 167.81 19.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.793 0.33 . . . . 0.0 110.889 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.721 HD12 ' NH1' ' A' ' 16' ' ' ARG . 2.4 tt -148.41 159.65 6.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.106 0.479 . . . . 0.0 110.86 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.472 ' N ' ' CG1' ' A' ' 88' ' ' ILE . 5.1 mp -78.54 145.15 66.86 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.877 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.76 -23.75 25.86 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.604 2.202 . . . . 0.0 112.441 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.15 -40.47 74.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.045 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -69.0 -45.88 69.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.911 0.386 . . . . 0.0 110.844 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.438 ' CE2' ' HB3' ' A' ' 38' ' ' TYR . 7.6 t80 -56.09 -53.13 60.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.609 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.411 ' OE2' ' NH1' ' A' ' 48' ' ' ARG . 0.0 OUTLIER -68.2 -23.34 64.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.675 179.689 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.21 -50.2 74.59 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 121.246 0.546 . . . . 0.0 109.55 179.086 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.452 HG21 HD11 ' A' ' 52' ' ' LEU . 17.5 mm -74.41 -35.26 38.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.384 179.114 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.44 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 9.7 t-105 -53.12 -40.14 63.97 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.953 179.246 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.645 ' HG3' HD13 ' A' ' 103' ' ' ILE . 10.2 tt0 -85.69 -26.97 25.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.748 179.225 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.84 -45.75 82.18 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.131 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 40.6 t -91.24 -79.22 0.37 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.039 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 179.18 36.95 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.686 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.469 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -59.9 -57.81 17.43 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.344 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.846 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.7 mp -53.03 -34.9 21.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.797 0.332 . . . . 0.0 111.233 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.04 -43.36 82.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.022 0.439 . . . . 0.0 110.29 179.492 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.641 ' HE2' HG12 ' A' ' 62' ' ' VAL . 92.7 t80 -67.97 -38.89 83.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.493 179.685 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.904 ' CD1' HD13 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -70.63 -50.85 32.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.856 179.96 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.419 ' HA ' ' HB ' ' A' ' 110' ' ' ILE . 0.9 OUTLIER -59.97 -29.48 68.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.811 -179.941 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.409 ' N ' ' HG3' ' A' ' 107' ' ' GLN . 37.1 p -69.86 -50.49 42.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.554 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.542 ' HB2' ' NZ ' ' A' ' 65' ' ' LYS . . . -71.54 -30.24 65.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.534 0.683 . . . . 0.0 109.516 178.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.744 HD11 HD22 ' A' ' 106' ' ' LEU . 15.9 mt -61.21 -49.33 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.229 179.075 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -66.07 -37.96 87.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.43 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 63.8 m -82.17 -4.94 58.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.959 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? 63.91 64.05 0.79 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.071 0.462 . . . . 0.0 111.07 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -151.59 25.09 0.68 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.52 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -104.89 -9.87 17.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.506 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.417 ' HD3' ' HB1' ' A' ' 63' ' ' ALA . 22.5 ttt180 65.13 86.33 0.14 Allowed Pre-proline 0 C--N 1.332 -0.167 0 CA-C-O 120.799 0.333 . . . . 0.0 110.919 -179.822 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -50.35 99.53 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.568 2.178 . . . . 0.0 112.164 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.487 ' C ' HG23 ' A' ' 6' ' ' ILE . 0.6 OUTLIER -129.41 -45.22 1.22 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.957 -179.829 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.445 ' CE2' ' HG3' ' A' ' 12' ' ' GLN . 16.3 t80 -177.66 -52.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.952 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.539 ' HB1' HD11 ' A' ' 106' ' ' LEU . . . -53.94 -39.51 65.96 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.243 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.619 HG22 ' CD2' ' A' ' 106' ' ' LEU . 40.2 p -67.05 -40.89 87.24 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.857 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.599 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -66.33 -57.87 6.55 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.096 0.474 . . . . 0.0 110.684 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' MET . . . . . 0.583 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -53.1 -29.65 31.84 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.209 179.455 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.904 HD13 ' CD1' ' A' ' 106' ' ' LEU . 0.3 OUTLIER -69.66 -48.69 58.92 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 121.129 0.49 . . . . 0.0 110.03 178.821 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.443 ' HA ' HD12 ' A' ' 128' ' ' LEU . 17.0 mm100 -50.32 -36.27 31.23 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.065 179.285 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -83.21 -32.67 26.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.975 178.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.583 HD13 ' CE ' ' A' ' 123' ' ' MET . 0.2 OUTLIER -62.69 -17.56 60.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.453 179.138 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.443 HD12 ' HA ' ' A' ' 125' ' ' GLN . 12.1 mt -88.13 -19.5 26.9 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.226 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 8.6 mmtt . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.022 -179.926 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.815 0.341 . . . . 0.0 111.192 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.555 ' O ' HD12 ' A' ' 6' ' ' ILE . 8.0 mmt180 -57.55 -64.0 1.04 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.431 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.26 -36.98 61.7 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.226 179.426 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -58.61 -33.74 70.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.301 179.375 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -74.58 -47.89 29.88 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.382 179.599 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.555 HD12 ' O ' ' A' ' 2' ' ' ARG . 2.8 mp -59.66 -63.52 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.389 179.418 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.3 p30 40.58 79.9 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.471 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.1 mtm -54.85 -73.58 0.05 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.286 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.13 29.92 17.41 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.031 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -146.0 167.09 24.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.895 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.1 mm100 -80.64 154.38 27.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.077 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.441 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 9.3 mp0 -113.48 107.61 16.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.789 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.501 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -108.15 127.62 53.98 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.902 0.382 . . . . 0.0 111.039 -179.642 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.507 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 1.4 m-85 -114.09 151.14 32.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.389 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.889 ' HB2' HD22 ' A' ' 80' ' ' LEU . 9.0 m-85 -150.24 157.72 43.39 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.185 0.517 . . . . 0.0 112.062 -179.318 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.643 ' CB ' HG21 ' A' ' 88' ' ' ILE . 34.3 ttp180 -149.21 149.66 31.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.835 179.28 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.525 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -151.47 115.77 3.1 Favored Pre-proline 0 C--N 1.33 -0.272 0 C-N-CA 121.066 -0.254 . . . . 0.0 111.284 -179.858 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.416 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 89.8 Cg_endo -82.85 85.24 1.62 Allowed 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.725 2.284 . . . . 0.0 112.301 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.444 ' CE2' ' HB2' ' A' ' 37' ' ' TRP . 9.0 p90 -103.91 140.47 37.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.998 0.427 . . . . 0.0 110.729 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.629 HG21 ' HB2' ' A' ' 32' ' ' LYS . 17.4 mt -91.47 141.5 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.2 -179.661 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.7 135.91 86.52 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.586 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.477 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 51.4 Cg_exo -54.52 -55.68 3.12 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.388 2.059 . . . . 0.0 112.949 -179.536 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.566 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -51.13 -54.96 20.37 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.71 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.538 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 40.7 m-20 -70.88 -31.04 67.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.158 -179.727 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -52.33 -57.11 10.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.65 -179.474 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.566 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.3 p90 -88.55 -19.14 26.75 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.594 -179.397 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.538 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 1.7 mtpp -56.04 -54.98 38.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.915 0.388 . . . . 0.0 110.801 179.744 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.8 p30 -167.27 144.79 3.92 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.327 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.404 ' HA ' ' HD2' ' A' ' 32' ' ' LYS . 70.6 Cg_endo -73.35 -4.42 15.39 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.709 2.272 . . . . 0.0 112.764 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -98.3 -40.58 8.26 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.856 0.36 . . . . 0.0 110.928 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -109.07 34.3 3.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.803 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.629 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -66.31 -33.22 75.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.08 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.56 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.9 OUTLIER 59.68 108.33 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.78 -179.795 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.418 ' N ' ' HG2' ' A' ' 54' ' ' PRO . 0.2 OUTLIER -88.82 112.93 23.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.565 -179.933 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.438 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -92.67 122.02 6.73 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.621 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.416 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 15.5 m-90 -98.62 121.0 40.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.871 0.367 . . . . 0.0 110.677 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.701 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 21.9 t90 -108.44 117.5 34.32 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.326 -179.429 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.92 ' CE1' HD12 ' A' ' 52' ' ' LEU . 14.2 m-85 -110.98 153.3 25.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.259 179.422 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.625 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -165.79 124.07 1.56 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.131 0.491 . . . . 0.0 111.681 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.507 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 11.7 t-160 -97.65 94.71 7.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.671 179.086 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.755 ' HZ ' HG21 ' A' ' 78' ' ' THR . 13.6 m-85 -78.03 149.19 34.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.472 -179.148 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.471 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 88.0 m-20 -122.64 110.83 16.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.14 178.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.47 -132.58 50.04 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.051 -1.071 . . . . 0.0 111.152 -178.424 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.408 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 5.7 Cg_exo -73.64 -18.19 22.62 Favored 'Trans proline' 0 N--CA 1.464 -0.261 0 C-N-CA 122.557 2.171 . . . . 0.0 112.505 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' TRP . . . . . 0.429 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.5 OUTLIER -117.51 -164.76 1.02 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.87 0.366 . . . . 0.0 111.769 -178.492 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.803 HD11 ' O ' ' A' ' 48' ' ' ARG . 3.3 tt -136.66 152.98 29.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.183 -179.899 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.698 ' HB2' HG21 ' A' ' 118' ' ' THR . . . -125.28 -18.9 5.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.071 -179.607 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.803 ' O ' HD11 ' A' ' 46' ' ' ILE . 8.5 mtt180 -132.79 136.63 46.41 Favored 'General case' 0 N--CA 1.458 -0.07 0 CA-C-O 120.854 0.359 . . . . 0.0 111.406 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.449 ' HB3' ' HB3' ' A' ' 61' ' ' LEU . 0.8 OUTLIER -146.74 118.73 8.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.827 179.824 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.543 ' HE1' ' HB ' ' A' ' 96' ' ' ILE . 16.1 ttp -112.83 118.05 33.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.714 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.426 ' O ' ' HA ' ' A' ' 58' ' ' PRO . 8.8 mt-10 -101.52 118.39 36.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.381 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.92 HD12 ' CE1' ' A' ' 38' ' ' TYR . 13.8 mt -119.27 116.53 26.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.627 179.697 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.443 ' HB2' ' HB2' ' A' ' 56' ' ' LYS . 7.9 m-70 -129.94 130.94 23.2 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.63 0.253 . . . . 0.0 111.004 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.418 ' HG2' ' N ' ' A' ' 34' ' ' LYS . 58.8 Cg_exo -51.65 -24.62 17.98 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.399 2.066 . . . . 0.0 112.391 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.6 p-10 -104.15 -22.94 13.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.205 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.443 ' HB2' ' HB2' ' A' ' 53' ' ' HIS . 0.3 OUTLIER -119.66 127.87 26.19 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.63 -0.259 . . . . 0.0 110.946 179.828 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo -49.71 171.65 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.664 2.243 . . . . 0.0 112.451 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.426 ' HA ' ' O ' ' A' ' 51' ' ' GLU . 27.6 Cg_endo -62.68 77.61 0.11 Allowed 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.605 2.203 . . . . 0.0 112.354 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.403 ' HB ' ' HB2' ' A' ' 51' ' ' GLU . 6.7 mt -56.92 100.37 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 121.088 0.471 . . . . 0.0 110.765 179.733 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.519 HD21 ' HA2' ' A' ' 102' ' ' GLY . 0.4 OUTLIER -76.43 131.84 39.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.062 -179.694 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.688 HD21 ' HB3' ' A' ' 69' ' ' GLU . 0.3 OUTLIER -132.19 146.66 52.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.72 179.93 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.748 HG21 HD21 ' A' ' 106' ' ' LEU . 13.6 p -150.75 137.16 12.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.224 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.04 167.68 2.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.273 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.25 -66.52 0.72 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.521 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.46 ' HG3' ' HB1' ' A' ' 109' ' ' ALA . 0.1 OUTLIER -70.1 -66.49 0.59 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.925 0.393 . . . . 0.0 110.949 -179.929 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.507 ' HB3' HD13 ' A' ' 61' ' ' LEU . 16.4 t0 -101.59 56.4 0.83 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.945 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.18 -17.43 62.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.592 -179.77 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 2.4 mtm -77.09 -30.9 55.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.895 0.379 . . . . 0.0 110.748 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.688 ' HB3' HD21 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -98.6 -21.44 16.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.196 179.984 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.3 -176.48 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.169 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.677 ' SG ' HD13 ' A' ' 46' ' ' ILE . 8.1 m -63.61 -47.25 82.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.795 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 70.29 25.35 4.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.112 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.41 ' HB2' HG23 ' A' ' 78' ' ' THR . 0.0 OUTLIER -148.64 154.41 39.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.705 179.833 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -79.54 -170.97 2.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.397 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.866 HD11 ' CZ ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -59.21 -53.1 62.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.252 -179.713 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.75 -44.75 66.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.175 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -54.78 -33.0 60.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.58 -179.397 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.755 HG21 ' HZ ' ' A' ' 41' ' ' PHE . 0.8 OUTLIER -71.35 -69.3 0.39 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.065 -179.646 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 133.48 -19.65 4.24 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.863 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.889 HD22 ' HB2' ' A' ' 15' ' ' PHE . 1.3 mp -51.85 -34.32 40.14 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.85 0.357 . . . . 0.0 111.025 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.778 ' CG2' HD12 ' A' ' 75' ' ' LEU . 0.2 OUTLIER -77.14 -43.07 35.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.654 179.733 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.409 ' HB3' ' NH1' ' A' ' 82' ' ' ARG . 0.1 OUTLIER -60.06 -29.74 68.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.716 179.786 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -168.16 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.889 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.0 77.37 1.24 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.801 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 72.05 68.06 1.7 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.402 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.572 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -96.55 21.16 9.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.691 0.282 . . . . 0.0 111.267 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -86.1 150.18 24.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.924 0.392 . . . . 0.0 111.1 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.643 HG21 ' CB ' ' A' ' 16' ' ' ARG . 1.3 pt -133.67 -179.66 3.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.004 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.921 HD12 ' HB3' ' A' ' 91' ' ' ARG . 0.8 OUTLIER -96.32 141.5 23.22 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.707 179.753 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -66.12 -13.86 41.77 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.577 2.184 . . . . 0.0 112.688 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.921 ' HB3' HD12 ' A' ' 89' ' ' LEU . 2.7 tpm_? -73.39 -49.89 24.77 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.43 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.428 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 0.2 OUTLIER -65.26 -42.93 92.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.968 0.413 . . . . 0.0 110.675 179.824 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -56.54 -53.39 58.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.555 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.27 -19.74 62.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.464 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.428 ' HB2' ' HA ' ' A' ' 92' ' ' GLN . 0.5 OUTLIER -61.25 -50.42 73.14 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.162 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.569 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 19.0 mm -73.72 -33.84 39.27 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.445 179.033 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.446 ' CH2' ' HG ' ' A' ' 60' ' ' LEU . 10.0 t-105 -53.03 -39.45 63.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.242 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -85.89 -30.54 22.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.609 179.325 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.569 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -58.13 -52.12 66.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.23 -179.882 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 32.4 m -78.29 -71.1 0.45 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.089 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 163.38 40.5 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.638 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.519 ' HA2' HD21 ' A' ' 60' ' ' LEU . . . -60.35 -47.86 89.01 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.37 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.681 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.7 mp -56.55 -34.63 42.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.847 0.356 . . . . 0.0 111.426 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -67.84 -48.69 65.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.836 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -67.73 -41.14 83.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.715 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.789 HD12 HD11 ' A' ' 110' ' ' ILE . 0.2 OUTLIER -67.84 -50.63 55.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.945 179.954 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.41 ' HG3' ' N ' ' A' ' 108' ' ' SER . 0.9 OUTLIER -60.78 -29.54 69.5 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.78 179.801 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.41 ' N ' ' HG3' ' A' ' 107' ' ' GLN . 4.1 m -67.99 -50.81 53.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.604 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.516 ' HB1' ' HB2' ' A' ' 114' ' ' GLN . . . -71.43 -32.33 68.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.413 0.625 . . . . 0.0 109.732 179.021 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.789 HD11 HD12 ' A' ' 106' ' ' LEU . 5.0 mt -56.76 -49.16 79.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.406 179.073 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -69.42 -36.61 76.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.51 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 51.9 m -74.83 -9.29 58.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.282 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 70.86 39.81 1.01 Allowed 'General case' 0 N--CA 1.461 0.079 0 CA-C-O 120.901 0.381 . . . . 0.0 111.033 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' GLN . . . . . 0.516 ' HB2' ' HB1' ' A' ' 109' ' ' ALA . 13.6 mt-30 -111.74 -28.99 7.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.835 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.452 ' HB1' ' CG2' ' A' ' 121' ' ' THR . . . -58.01 -166.81 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.144 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.593 ' O ' HG22 ' A' ' 118' ' ' THR . 5.1 ttt180 -132.56 93.64 24.25 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.03 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.431 ' HB3' HG13 ' A' ' 6' ' ' ILE . 51.9 Cg_exo -52.8 89.06 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.61 2.207 . . . . 0.0 112.116 179.771 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.698 HG21 ' HB2' ' A' ' 47' ' ' ALA . 4.6 t -132.88 -49.67 0.88 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.237 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.441 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 12.1 t80 -163.21 -62.28 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.889 0.376 . . . . 0.0 111.163 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.572 ' HB1' ' NE ' ' A' ' 48' ' ' ARG . . . -53.85 -38.47 64.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.445 -179.59 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.51 HG22 ' CG1' ' A' ' 110' ' ' ILE . 0.9 OUTLIER -67.38 -44.64 78.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.693 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.49 ' HB2' HD13 ' A' ' 6' ' ' ILE . . . -62.56 -58.11 8.72 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.156 0.503 . . . . 0.0 110.696 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' MET . . . . . 0.759 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -53.56 -29.98 39.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.485 179.512 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.681 HD11 ' HA ' ' A' ' 103' ' ' ILE . 0.2 OUTLIER -66.54 -50.59 62.64 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.037 0.446 . . . . 0.0 109.922 178.863 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -49.77 -37.52 30.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.74 179.19 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -82.73 -31.46 28.45 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.014 178.862 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.759 HD13 ' CE ' ' A' ' 123' ' ' MET . 0.4 OUTLIER -61.4 -18.81 60.54 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.514 179.21 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.689 ' O ' HD12 ' A' ' 128' ' ' LEU . 0.9 OUTLIER -134.13 79.46 1.81 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.066 -179.962 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.918 179.966 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.3 0 CA-C-O 120.866 0.365 . . . . 0.0 111.056 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.669 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.4 OUTLIER -58.2 -62.28 1.95 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.64 179.847 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -53.77 -32.19 51.49 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.624 179.548 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.2 mm100 -63.72 -37.16 86.31 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.404 179.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -73.91 -55.89 5.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.116 179.44 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.669 HD12 ' O ' ' A' ' 2' ' ' ARG . 4.9 mp -61.15 -59.72 3.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.356 179.238 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.1 t70 41.14 72.63 0.15 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.963 -1.017 . . . . 0.0 111.409 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 8.5 mtm -57.24 -82.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.031 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.3 mttm 49.49 34.08 6.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.826 0.346 . . . . 0.0 111.124 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -139.72 164.12 30.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.069 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -78.97 117.06 19.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.868 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 94.8 mm-40 -84.94 102.66 13.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.899 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.536 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 1.5 mmp_? -119.82 144.0 47.57 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.849 0.357 . . . . 0.0 110.645 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.527 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 0.9 OUTLIER -123.98 134.85 53.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.346 -179.653 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.889 ' HB2' HD22 ' A' ' 80' ' ' LEU . 7.7 m-85 -135.36 152.59 51.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.337 0.589 . . . . 0.0 111.971 -179.012 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.539 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.4 142.62 25.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.691 179.15 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -145.88 127.27 7.53 Favored Pre-proline 0 C--N 1.328 -0.36 0 C-N-CA 120.709 -0.396 . . . . 0.0 111.983 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.415 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 60.7 Cg_endo -89.64 91.19 0.35 Allowed 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 123.176 2.584 . . . . 0.0 111.97 179.683 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.407 ' O ' ' CD1' ' A' ' 19' ' ' PHE . 27.1 p90 -111.27 133.96 53.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.983 0.421 . . . . 0.0 111.238 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.683 HG23 ' O ' ' A' ' 33' ' ' LYS . 17.2 mt -89.94 142.78 12.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.763 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 mtt180 -60.08 130.11 88.83 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.215 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.455 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 9.3 Cg_endo -52.75 -50.93 12.35 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.46 2.107 . . . . 0.0 112.497 -179.567 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.54 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -53.98 -58.33 7.7 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.334 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.59 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 10.3 m-20 -66.0 -33.49 75.92 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.97 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -50.66 -54.63 21.48 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.469 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.54 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.4 p90 -95.8 -12.38 25.41 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.841 -179.529 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.59 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 1.6 mtpp -62.17 -48.61 79.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.93 0.395 . . . . 0.0 110.566 179.704 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -160.95 140.91 8.19 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.155 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -73.19 -5.74 17.7 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.621 2.214 . . . . 0.0 112.592 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -108.17 -33.92 7.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.897 0.38 . . . . 0.0 110.605 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -97.82 30.17 3.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.763 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 15.6 mttt -65.43 -59.98 3.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.976 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.683 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.0 OUTLIER 62.83 121.44 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.519 -179.519 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.98 131.46 45.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.045 -179.315 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -103.88 121.64 7.11 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.187 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.432 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 8.0 m-90 -97.81 119.62 36.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.903 0.382 . . . . 0.0 110.758 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.597 ' HZ3' HD11 ' A' ' 80' ' ' LEU . 21.6 t90 -108.68 117.5 34.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.07 -179.633 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.873 ' CE1' HD12 ' A' ' 52' ' ' LEU . 4.5 m-85 -110.76 154.34 24.05 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.266 179.36 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.826 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.38 123.83 0.69 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.123 0.487 . . . . 0.0 111.554 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.507 ' CG ' ' CE2' ' A' ' 14' ' ' PHE . 9.0 t-160 -95.57 96.05 8.79 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 178.72 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.803 ' HZ ' HG21 ' A' ' 78' ' ' THR . 7.4 m-85 -75.12 159.49 31.59 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.255 0.55 . . . . 0.0 111.433 -178.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.54 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.6 OUTLIER -133.09 120.35 21.16 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.113 179.003 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 58.39 -137.43 50.09 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 119.881 -1.152 . . . . 0.0 110.96 -178.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.401 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.2 Cg_exo -73.34 -16.23 24.83 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.456 2.104 . . . . 0.0 112.21 179.331 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' TRP . . . . . 0.418 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.8 OUTLIER -119.24 -158.85 0.75 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.344 -178.56 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.826 ' CD1' ' HB1' ' A' ' 39' ' ' ALA . 5.6 tt -130.82 154.84 41.3 Favored 'Isoleucine or valine' 0 C--O 1.231 0.108 0 CA-C-O 121.059 0.457 . . . . 0.0 112.089 -179.439 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -112.29 -35.44 5.6 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.457 -179.224 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.568 ' O ' HD11 ' A' ' 46' ' ' ILE . 0.0 OUTLIER -150.85 158.25 43.91 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 120.255 -0.578 . . . . 0.0 111.781 -179.392 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.504 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 21.8 pt20 -161.17 159.25 28.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.407 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.479 ' HE3' ' N ' ' A' ' 97' ' ' TRP . 0.0 OUTLIER -134.24 122.7 23.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.436 179.46 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.463 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 2.1 mt-10 -90.09 115.71 27.56 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.838 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.873 HD12 ' CE1' ' A' ' 38' ' ' TYR . 33.1 mt -119.09 101.86 8.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.937 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.4 m80 -135.11 136.26 24.44 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.565 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.431 ' HG2' ' HB3' ' A' ' 33' ' ' LYS . 10.0 Cg_endo -51.08 -28.65 25.61 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.713 2.276 . . . . 0.0 112.215 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 15.2 p30 -96.41 -26.37 15.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.816 179.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -113.1 112.6 49.73 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.77 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -50.01 175.05 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.468 2.112 . . . . 0.0 112.433 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -60.95 79.38 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.616 2.21 . . . . 0.0 112.357 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.463 ' HB ' ' HB2' ' A' ' 51' ' ' GLU . 7.6 mt -77.49 93.32 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.022 0.439 . . . . 0.0 110.502 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.66 HD13 ' HA2' ' A' ' 102' ' ' GLY . 2.8 mt -75.49 107.44 7.63 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.977 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.881 HD13 ' HA ' ' A' ' 70' ' ' MET . 3.8 mt -98.32 153.41 18.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.912 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.689 HG21 HD21 ' A' ' 106' ' ' LEU . 13.7 p -154.78 142.07 12.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.952 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.67 164.66 1.95 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.397 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 66.68 -76.5 0.15 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.417 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.88 -61.79 2.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.977 0.418 . . . . 0.0 110.808 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.483 ' CB ' HD23 ' A' ' 61' ' ' LEU . 7.5 m-20 -108.14 42.83 1.3 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.672 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.61 -17.4 64.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.434 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -76.81 -28.05 55.42 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.803 0.335 . . . . 0.0 110.669 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.857 ' CG ' HD21 ' A' ' 61' ' ' LEU . 4.2 pm0 -109.19 -23.84 11.42 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.249 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.881 ' HA ' HD13 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -50.4 176.55 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.868 0.366 . . . . 0.0 110.981 179.723 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.507 ' HB3' HG21 ' A' ' 46' ' ' ILE . 7.0 t -52.33 -66.7 0.34 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.802 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 72.37 7.12 5.63 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.516 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.47 157.9 18.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.962 0.41 . . . . 0.0 111.045 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -83.04 168.3 17.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.222 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.464 HD11 ' CE2' ' A' ' 15' ' ' PHE . 4.2 mm? -53.91 -53.58 50.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.747 0.308 . . . . 0.0 111.601 -179.386 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.56 -31.63 68.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.685 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -70.34 -40.8 73.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.462 -179.348 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.803 HG21 ' HZ ' ' A' ' 41' ' ' PHE . 0.2 OUTLIER -54.8 -76.58 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.306 -179.584 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 143.27 -24.21 2.21 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.508 -0.853 . . . . 0.0 113.007 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.889 HD22 ' HB2' ' A' ' 15' ' ' PHE . 1.0 OUTLIER -53.94 -48.58 70.09 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.06 0.457 . . . . 0.0 110.538 179.875 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.53 -48.32 82.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.614 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.76 -30.11 68.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.635 179.605 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.34 177.35 0.5 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.811 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -87.96 78.28 8.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.826 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 69.27 68.51 1.62 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.372 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -90.84 16.31 9.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.465 0.174 . . . . 0.0 111.463 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -84.03 155.15 22.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.953 0.406 . . . . 0.0 111.186 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.539 HG21 ' HB3' ' A' ' 16' ' ' ARG . 0.8 OUTLIER -136.95 179.04 4.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.964 179.748 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.578 ' H ' HD12 ' A' ' 89' ' ' LEU . 1.8 mp -94.07 137.93 22.79 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.607 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.72 -21.18 62.06 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.437 2.092 . . . . 0.0 112.334 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.12 -39.43 72.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.997 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -70.12 -50.44 40.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.009 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.45 ' CZ ' ' HG2' ' A' ' 50' ' ' MET . 16.7 t80 -54.91 -49.42 71.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.767 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.14 -21.93 61.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.748 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.9 -50.44 72.18 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.2 0.524 . . . . 0.0 109.614 179.131 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.438 ' HB ' ' HE3' ' A' ' 50' ' ' MET . 20.8 mm -77.47 -34.11 20.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.671 179.336 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.508 ' CZ3' HD23 ' A' ' 60' ' ' LEU . 53.0 t-105 -52.96 -40.55 63.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.919 179.353 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.15 -30.16 22.7 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.453 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -56.78 -54.15 49.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.221 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 95.3 m -75.8 -82.06 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.003 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -178.62 35.99 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.515 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.66 ' HA2' HD13 ' A' ' 60' ' ' LEU . . . -67.69 -37.66 89.22 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.607 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.655 ' CD1' HD22 ' A' ' 127' ' ' LEU . 30.9 mm -70.21 -39.41 76.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.855 0.359 . . . . 0.0 111.162 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.7 -42.92 97.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.974 0.416 . . . . 0.0 110.425 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -67.53 -42.99 81.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.717 179.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.856 HD12 HD11 ' A' ' 110' ' ' ILE . 0.2 OUTLIER -66.49 -50.25 63.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.056 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.422 ' HA ' ' HB ' ' A' ' 110' ' ' ILE . 0.9 OUTLIER -60.9 -29.56 69.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.024 -179.962 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 108' ' ' SER . . . . . 0.401 ' N ' ' HG3' ' A' ' 107' ' ' GLN . 8.5 t -68.87 -50.49 49.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.76 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.09 -31.1 65.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.351 0.596 . . . . 0.0 109.505 178.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.856 HD11 HD12 ' A' ' 106' ' ' LEU . 10.7 mt -56.96 -48.8 80.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.127 179.136 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -69.53 -39.35 77.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.577 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.39 -12.03 61.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.191 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 73.2 35.83 0.89 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.842 0.353 . . . . 0.0 110.908 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -106.8 -28.91 9.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.661 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.99 -170.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.025 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -140.16 96.21 8.15 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.951 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -45.88 107.09 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.509 2.14 . . . . 0.0 112.276 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.585 ' C ' HG23 ' A' ' 6' ' ' ILE . 1.7 p -144.69 -45.82 0.24 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.171 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -174.37 -49.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.916 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.436 ' O ' ' HB2' ' A' ' 124' ' ' LEU . . . -58.14 -39.06 77.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.232 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.473 HG22 ' CD1' ' A' ' 106' ' ' LEU . 40.3 p -68.64 -44.76 73.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.746 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.21 -58.26 9.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.089 0.471 . . . . 0.0 110.427 179.475 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' MET . . . . . 0.54 ' HE2' ' N ' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -56.19 -29.59 61.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.18 179.22 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.54 ' N ' ' HE2' ' A' ' 123' ' ' MET . 0.0 OUTLIER -67.65 -51.36 50.84 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.003 0.43 . . . . 0.0 109.943 178.956 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 46.6 mm-40 -49.75 -38.39 33.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.067 179.402 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 -79.63 -34.23 40.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.227 179.128 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.655 HD22 ' CD1' ' A' ' 103' ' ' ILE . 0.3 OUTLIER -61.49 -18.68 60.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.387 179.065 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.626 ' O ' HD12 ' A' ' 128' ' ' LEU . 1.0 OUTLIER -148.23 84.07 1.5 Allowed 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.873 -179.893 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.304 -0.855 . . . . 0.0 110.938 179.918 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.787 ' HB1' ' HB2' ' A' ' 4' ' ' GLN . . . . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.912 0.386 . . . . 0.0 110.974 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.9 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -57.44 -61.01 2.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.984 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -64.36 -34.32 77.89 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.369 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.787 ' HB2' ' HB1' ' A' ' 1' ' ' ALA . 9.8 mm100 -57.66 -33.09 67.96 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.593 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.93 -53.03 7.92 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.119 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.9 HD12 ' O ' ' A' ' 2' ' ' ARG . 2.7 mp -61.03 -62.55 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.45 0.643 . . . . 0.0 110.225 179.124 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.4 t70 42.33 75.15 0.09 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.81 -1.086 . . . . 0.0 111.535 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.2 ptp -57.4 -70.09 0.14 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.161 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.4 mttt 45.31 40.91 5.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.967 0.413 . . . . 0.0 111.419 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.86 161.35 38.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.004 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 87.8 mm-40 -70.23 146.93 50.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.593 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.9 mp0 -112.82 113.73 25.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.918 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.473 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.7 OUTLIER -126.0 124.09 39.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.051 179.842 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.501 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -113.67 134.66 54.6 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.699 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.912 ' HB2' HD22 ' A' ' 80' ' ' LEU . 1.9 m-85 -133.5 160.65 36.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.28 0.562 . . . . 0.0 112.179 -178.685 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.647 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.4 OUTLIER -149.11 144.09 26.42 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.827 179.625 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.462 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -153.22 117.5 2.81 Favored Pre-proline 0 C--N 1.33 -0.269 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.96 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.489 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 1.2 Cg_endo -83.67 89.27 1.05 Allowed 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 123.057 2.504 . . . . 0.0 111.781 179.456 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.421 ' O ' ' CD1' ' A' ' 19' ' ' PHE . 20.8 p90 -103.1 136.58 42.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.944 0.402 . . . . 0.0 110.997 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.558 HG12 ' HG3' ' A' ' 34' ' ' LYS . 10.6 mt -84.81 139.67 17.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.072 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.7 mtp180 -60.66 139.06 93.08 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.261 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.461 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 19.5 Cg_endo -58.29 -50.55 9.51 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.409 2.073 . . . . 0.0 112.301 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.531 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -53.84 -58.34 7.6 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.077 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.541 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 45.4 m-20 -66.38 -32.69 74.23 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.983 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.429 ' HB3' ' O ' ' A' ' 22' ' ' PRO . 0.0 OUTLIER -50.37 -52.45 37.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.347 -179.653 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.531 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.9 p90 -98.17 -15.75 19.77 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.972 -179.317 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.541 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 0.7 OUTLIER -60.92 -46.51 90.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.937 0.398 . . . . 0.0 110.729 179.861 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -161.86 138.44 6.15 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.021 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.29 -7.08 20.57 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.515 2.143 . . . . 0.0 112.729 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -111.26 -29.75 7.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.854 0.359 . . . . 0.0 110.897 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.3 m120 -97.95 29.05 3.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.121 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.437 ' HB3' HG21 ' A' ' 20' ' ' ILE . 17.5 mttt -64.7 -62.32 1.65 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.115 0.484 . . . . 0.0 110.525 179.578 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.9 mmmt 67.77 100.98 0.05 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.505 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.558 ' HG3' HG12 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -81.87 139.17 34.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.457 -179.467 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.441 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -110.49 130.18 9.71 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.05 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.489 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 22.9 m-90 -97.49 112.85 24.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.054 0.454 . . . . 0.0 110.875 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.732 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 26.9 t90 -101.92 117.47 34.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.01 -179.509 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.89 ' CE1' HD12 ' A' ' 52' ' ' LEU . 1.2 m-85 -114.45 156.04 25.26 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.414 179.319 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.94 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -163.53 123.78 2.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.331 0.586 . . . . 0.0 111.852 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.507 ' HB3' ' CB ' ' A' ' 48' ' ' ARG . 2.4 t-160 -90.71 84.51 5.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.208 -0.906 . . . . 0.0 108.841 178.603 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.703 ' CD2' HD12 ' A' ' 75' ' ' LEU . 13.7 m-85 -71.83 149.83 44.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.836 -178.518 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.432 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.5 OUTLIER -133.03 119.13 19.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.432 -0.804 . . . . 0.0 108.898 178.968 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 62.71 -140.52 46.0 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 119.966 -1.111 . . . . 0.0 110.929 -178.354 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.406 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 2.6 Cg_exo -75.89 -1.17 11.07 Favored 'Trans proline' 0 CA--C 1.531 0.33 0 C-N-CA 122.691 2.261 . . . . 0.0 112.421 179.558 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' TRP . . . . . 0.406 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 1.5 m95 -135.5 -158.44 0.87 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.582 -178.374 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.94 ' CD1' ' HB1' ' A' ' 39' ' ' ALA . 4.2 tt -139.31 155.21 25.87 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.099 0 CA-C-O 121.119 0.485 . . . . 0.0 111.861 -179.231 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.447 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -123.85 -24.29 4.48 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.594 -0.73 . . . . 0.0 112.12 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.857 ' O ' HD11 ' A' ' 46' ' ' ILE . 3.2 mtt180 -126.47 133.65 51.14 Favored 'General case' 0 C--O 1.227 -0.099 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.536 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.413 ' NE2' ' HA ' ' A' ' 70' ' ' MET . 0.5 OUTLIER -144.16 137.48 27.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.913 0.387 . . . . 0.0 111.423 -179.943 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.628 ' HE1' ' HB ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -133.62 115.51 14.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.524 179.729 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.414 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.1 OUTLIER -95.46 115.67 27.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.104 -179.73 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.89 HD12 ' CE1' ' A' ' 38' ' ' TYR . 15.1 mt -115.22 101.87 9.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.649 179.684 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.441 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 2.0 m-70 -123.8 133.6 24.74 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.041 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -52.66 -27.33 32.92 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.268 1.979 . . . . 0.0 112.118 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -94.75 -26.92 16.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.936 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.5 mptt -121.2 118.93 29.86 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.999 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.431 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 88.1 Cg_exo -46.09 170.13 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.536 2.157 . . . . 0.0 112.238 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.595 ' O ' HD13 ' A' ' 60' ' ' LEU . 18.0 Cg_endo -58.2 82.22 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.446 2.098 . . . . 0.0 112.3 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.414 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 76.2 mt -61.03 105.36 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.735 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.771 HD11 ' SG ' ' A' ' 100' ' ' CYS . 3.0 mp -81.43 121.38 26.18 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.987 -179.861 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.605 HD22 ' HB3' ' A' ' 66' ' ' ASP . 73.9 mt -129.4 154.17 47.19 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.076 -179.793 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.543 ' HB ' HD21 ' A' ' 106' ' ' LEU . 10.6 p -153.51 143.15 14.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.028 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.492 ' N ' ' HE1' ' A' ' 70' ' ' MET . . . -54.44 147.62 13.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.151 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.72 -50.51 2.3 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.568 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.74 -75.68 0.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.833 0.349 . . . . 0.0 110.888 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.605 ' HB3' HD22 ' A' ' 61' ' ' LEU . 0.4 OUTLIER -85.93 56.14 3.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.916 -179.87 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -68.18 -28.7 67.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.204 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.96 -20.71 34.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.235 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -94.78 -50.07 5.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.287 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.492 ' HE1' ' N ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -58.35 -163.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.153 -179.915 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.696 ' SG ' HD13 ' A' ' 46' ' ' ILE . 1.8 m -73.65 114.36 11.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.595 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -103.14 37.76 1.91 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.886 0.374 . . . . 0.0 110.764 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.415 ' HB2' ' HG3' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -147.09 -179.18 6.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.819 179.954 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -94.67 164.21 13.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.683 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.703 HD12 ' CD2' ' A' ' 41' ' ' PHE . 0.6 OUTLIER -54.92 -32.32 61.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.659 -179.573 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.57 -56.06 7.41 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -179.273 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.415 ' HG3' ' HB2' ' A' ' 73' ' ' LYS . 5.5 pt-20 -77.91 -3.91 44.12 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.595 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.689 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -65.34 -53.56 41.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.755 0.312 . . . . 0.0 110.758 179.911 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 117.79 -25.13 8.62 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.7 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.912 HD22 ' HB2' ' A' ' 15' ' ' PHE . 1.2 mt -56.92 -32.24 65.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.747 0.308 . . . . 0.0 111.005 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 5.1 p -80.04 -34.03 38.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.927 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -67.01 -30.5 70.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.876 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.58 -173.96 0.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.808 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.03 74.46 4.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.976 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 69.25 65.57 2.55 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.602 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.495 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -72.58 -10.26 59.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.637 0.256 . . . . 0.0 111.387 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -52.28 148.07 7.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.898 0.38 . . . . 0.0 111.388 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.647 HG21 ' HB3' ' A' ' 16' ' ' ARG . 1.0 OUTLIER -139.8 179.29 2.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.105 179.897 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.476 HD12 ' CB ' ' A' ' 91' ' ' ARG . 0.4 OUTLIER -98.41 150.19 36.48 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.578 179.664 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.51 -29.94 71.14 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.489 2.126 . . . . 0.0 112.349 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.476 ' CB ' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -57.0 -49.69 74.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.472 -179.723 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.516 ' HA ' ' HG2' ' A' ' 95' ' ' GLU . 4.8 mm-40 -64.37 -46.23 84.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.937 0.399 . . . . 0.0 111.637 -179.366 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.467 ' CZ ' ' HG2' ' A' ' 50' ' ' MET . 15.2 t80 -64.72 -43.93 91.84 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.365 -179.547 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -79.6 -30.02 41.34 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -179.053 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.516 ' HG2' ' HA ' ' A' ' 92' ' ' GLN . 11.8 pt-20 -63.91 -46.43 84.83 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 120.129 -0.628 . . . . 0.0 109.799 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.628 ' HB ' ' HE1' ' A' ' 50' ' ' MET . 38.0 mm -71.21 -37.84 67.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 CA-C-O 121.142 0.496 . . . . 0.0 110.018 178.61 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.461 ' CZ3' ' HG ' ' A' ' 60' ' ' LEU . 47.5 t-105 -52.48 -39.64 61.41 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.228 179.399 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -85.51 -24.57 27.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.729 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.61 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -56.77 -45.7 81.92 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.291 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 100' ' ' CYS . . . . . 0.771 ' SG ' HD11 ' A' ' 60' ' ' LEU . 2.2 p -88.66 -54.63 4.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.606 -179.506 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.408 ' O ' ' HG2' ' A' ' 104' ' ' GLN . . . 148.96 45.88 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.584 -0.817 . . . . 0.0 112.556 -179.835 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.489 ' HA2' HD23 ' A' ' 60' ' ' LEU . . . -71.09 -38.98 63.5 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.932 -0.652 . . . . 0.0 112.387 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.596 HD12 HD22 ' A' ' 127' ' ' LEU . 20.6 mm -62.44 -55.08 26.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.725 0.297 . . . . 0.0 110.951 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 101' ' ' GLY . 0.0 OUTLIER -56.19 -45.06 79.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.561 179.826 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -59.9 -49.36 77.99 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.342 179.37 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.589 HD12 HD11 ' A' ' 110' ' ' ILE . 0.3 OUTLIER -60.01 -46.19 90.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.798 179.816 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.464 ' HG2' HD23 ' A' ' 124' ' ' LEU . 1.1 mm100 -59.41 -29.63 67.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.032 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.84 -50.67 40.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.933 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.13 -31.29 65.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.456 0.646 . . . . 0.0 109.607 178.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.589 HD11 HD12 ' A' ' 106' ' ' LEU . 12.3 mt -58.69 -48.96 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.363 179.139 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -66.38 -42.44 87.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.321 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.74 -15.72 63.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.011 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 75.54 32.53 0.7 Allowed 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 120.921 0.391 . . . . 0.0 110.977 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -100.32 -26.73 13.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.792 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.585 ' HB1' HG21 ' A' ' 121' ' ' THR . . . -59.11 -162.88 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.041 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.471 ' O ' HG22 ' A' ' 118' ' ' THR . 0.0 OUTLIER -138.31 93.38 11.46 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.219 -179.88 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.452 ' HB3' HG13 ' A' ' 6' ' ' ILE . 72.4 Cg_exo -51.06 89.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.602 2.201 . . . . 0.0 112.035 179.594 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.517 ' CA ' HG23 ' A' ' 6' ' ' ILE . 9.0 t -138.23 -47.66 0.53 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.414 -179.605 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.453 ' CE1' ' CE1' ' A' ' 40' ' ' HIS . 14.4 t80 -167.23 -47.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.629 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.451 ' HB1' ' HG3' ' A' ' 48' ' ' ARG . . . -59.97 -52.4 65.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.664 -179.34 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.585 HG21 ' HB1' ' A' ' 115' ' ' ALA . 69.1 p -65.32 -49.12 70.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.718 -179.841 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.518 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -55.86 -48.39 75.62 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.414 0.626 . . . . 0.0 109.799 179.006 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' MET . . . . . 0.832 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -58.01 -31.45 66.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.245 -0.888 . . . . 0.0 109.875 178.762 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.493 HD22 HD12 ' A' ' 110' ' ' ILE . 0.1 OUTLIER -66.39 -49.41 66.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.891 178.837 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 63.7 mm-40 -49.99 -40.65 44.97 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.966 179.204 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -77.95 -32.82 51.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.129 178.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.832 HD13 ' CE ' ' A' ' 123' ' ' MET . 0.2 OUTLIER -63.03 -17.53 62.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.53 179.027 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.476 HD21 HD23 ' A' ' 124' ' ' LEU . 0.7 OUTLIER -141.49 70.96 1.35 Allowed 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.038 -179.839 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 32.7 mmtt . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.845 179.975 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.749 0.309 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.753 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.2 OUTLIER -60.18 -57.89 10.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.994 0.426 . . . . 0.0 110.635 179.86 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.427 ' O ' ' N ' ' A' ' 7' ' ' ASP . 0.2 OUTLIER -57.62 -31.15 65.94 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.253 0.549 . . . . 0.0 109.84 179.353 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -64.71 -41.8 95.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.078 179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.472 ' HG3' ' N ' ' A' ' 6' ' ' ILE . 9.9 pt-20 -73.06 -46.31 52.37 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.758 0.313 . . . . 0.0 110.846 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.753 HD12 ' O ' ' A' ' 2' ' ' ARG . 3.5 mp -69.42 -58.98 4.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.766 0.793 . . . . 0.0 109.534 178.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.427 ' N ' ' O ' ' A' ' 3' ' ' GLN . 16.6 t70 49.67 92.15 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.234 -179.643 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.448 ' HG2' ' CD2' ' A' ' 119' ' ' TYR . 0.0 OUTLIER -62.22 -69.61 0.24 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.892 179.867 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.6 mmtt 52.77 28.24 6.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.109 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -154.75 -179.96 8.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.804 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -97.67 167.98 10.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.865 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.47 ' HG2' ' CZ ' ' A' ' 119' ' ' TYR . 4.1 mp0 -119.38 108.3 14.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.902 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.54 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -117.58 120.56 38.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.019 -179.739 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.489 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 0.1 OUTLIER -113.8 148.94 35.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.515 179.897 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.84 ' HB2' HD22 ' A' ' 80' ' ' LEU . 0.2 OUTLIER -152.39 162.8 40.66 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.296 0.569 . . . . 0.0 111.857 179.944 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.695 ' HB3' HG21 ' A' ' 88' ' ' ILE . 7.0 ttp180 -149.26 148.04 29.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.896 179.36 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.492 HG21 ' CD ' ' A' ' 83' ' ' LYS . 0.2 OUTLIER -149.61 124.48 4.8 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 120.72 0.295 . . . . 0.0 111.688 -179.751 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.468 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 67.1 Cg_endo -91.66 97.91 0.21 Allowed 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 123.007 2.471 . . . . 0.0 112.284 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -113.21 143.27 44.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.814 0.34 . . . . 0.0 110.834 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.43 HG12 ' HG2' ' A' ' 34' ' ' LYS . 5.7 mt -85.66 153.02 3.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.372 -179.641 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -80.25 140.57 52.92 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.671 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.485 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 51.8 Cg_exo -55.34 -47.92 23.43 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.558 2.172 . . . . 0.0 112.844 -179.576 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.54 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -54.94 -58.98 5.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.35 -179.383 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.484 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 1.8 m-20 -67.99 -31.18 70.7 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.552 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.42 -50.39 59.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.573 -179.718 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.54 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.3 p90 -102.21 -5.29 24.53 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 -179.268 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.484 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 6.0 mtpp -74.41 -39.11 62.85 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.835 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -174.44 140.79 0.74 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.417 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.469 ' HA ' ' HG2' ' A' ' 32' ' ' LYS . 61.4 Cg_endo -72.3 -22.28 22.14 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.671 2.248 . . . . 0.0 112.288 179.627 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -84.63 -36.95 21.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.169 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -94.47 41.6 1.09 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.821 179.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.469 ' HG2' ' HA ' ' A' ' 29' ' ' PRO . 18.2 mmtm -78.08 61.17 2.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.698 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.7 mmtt -46.2 95.5 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.338 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.43 ' HG2' HG12 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -83.89 131.99 34.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.783 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.407 ' HA2' ' HD3' ' A' ' 54' ' ' PRO . . . -115.99 142.51 17.59 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.849 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.468 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 22.0 m-90 -105.82 138.35 42.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.757 0.313 . . . . 0.0 110.732 179.853 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.621 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 41.7 t90 -123.98 116.83 23.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.791 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.858 ' CE1' HD12 ' A' ' 52' ' ' LEU . 3.1 m-85 -109.73 154.53 22.77 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.413 179.693 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.582 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -170.21 125.46 0.77 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.154 0.502 . . . . 0.0 112.041 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.489 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 16.8 t-160 -96.89 96.61 8.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.757 179.016 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.771 ' CZ ' HG21 ' A' ' 78' ' ' THR . 19.5 m-85 -83.91 122.54 28.87 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.579 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.513 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.6 OUTLIER -91.75 111.06 22.43 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 178.289 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.19 -135.6 50.09 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.018 -1.087 . . . . 0.0 110.928 -178.254 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.404 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 8.1 Cg_exo -72.5 -16.68 27.23 Favored 'Trans proline' 0 N--CA 1.463 -0.278 0 C-N-CA 122.444 2.096 . . . . 0.0 112.317 179.424 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' TRP . . . . . 0.404 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 0.8 OUTLIER -115.08 -170.3 1.73 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.597 -178.696 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.589 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 3.5 tt -133.07 153.65 38.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 121.172 0.51 . . . . 0.0 111.998 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.579 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -129.73 -22.21 2.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.492 -0.777 . . . . 0.0 111.959 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.699 ' NE ' ' HB1' ' A' ' 120' ' ' ALA . 3.5 mtt180 -130.22 142.3 50.57 Favored 'General case' 0 N--CA 1.46 0.04 0 CA-C-O 120.77 0.319 . . . . 0.0 111.167 -179.686 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.494 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 0.1 OUTLIER -155.88 129.86 8.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.991 0.424 . . . . 0.0 111.175 179.942 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.642 ' SD ' HD11 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -125.47 120.53 31.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.695 179.891 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.491 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -98.53 132.85 43.63 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.071 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.858 HD12 ' CE1' ' A' ' 38' ' ' TYR . 14.1 mt -135.06 101.98 5.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.846 179.724 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 4.3 m-70 -126.26 138.26 31.92 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.931 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.407 ' HD3' ' HA2' ' A' ' 35' ' ' GLY . 53.3 Cg_exo -52.26 -23.64 18.62 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.439 2.092 . . . . 0.0 112.341 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -98.58 -27.45 14.01 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.233 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 1.9 mttm -118.49 125.41 27.84 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.053 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.53 177.05 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.522 2.148 . . . . 0.0 112.27 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -59.68 84.97 0.07 OUTLIER 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.642 2.228 . . . . 0.0 112.498 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.693 HG22 HD23 ' A' ' 61' ' ' LEU . 67.1 mt -66.21 98.12 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.003 0.43 . . . . 0.0 110.634 179.64 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.557 HD21 ' C ' ' A' ' 101' ' ' GLY . 0.2 OUTLIER -72.92 107.82 5.51 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.933 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.907 HD11 ' CB ' ' A' ' 69' ' ' GLU . 1.1 mm? -110.15 147.46 33.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.959 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.9 p -156.53 140.51 7.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.936 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.579 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -56.08 170.7 0.3 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.025 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.28 -72.28 0.32 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.325 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.405 ' HG2' ' HB3' ' A' ' 114' ' ' GLN . 0.5 OUTLIER -64.28 -54.0 40.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.824 0.345 . . . . 0.0 110.694 179.839 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.428 ' CB ' HD13 ' A' ' 61' ' ' LEU . 59.7 m-20 -114.19 57.46 0.7 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.867 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -20.19 63.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.212 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -85.58 -43.3 13.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.049 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.907 ' CB ' HD11 ' A' ' 61' ' ' LEU . 3.2 mm-40 -68.41 -39.58 81.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.02 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -48.26 167.66 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.905 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.529 ' SG ' HG22 ' A' ' 78' ' ' THR . 0.9 OUTLIER -56.09 -30.66 62.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.864 0.364 . . . . 0.0 111.083 -179.798 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 75.97 -61.07 0.47 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.059 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.2 mptt -53.45 161.49 0.98 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.189 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.55 ' O ' HG23 ' A' ' 78' ' ' THR . 11.1 m120 -77.59 -172.89 2.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.555 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.542 HD11 ' CZ ' ' A' ' 15' ' ' PHE . 28.0 tp -64.47 -51.97 60.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.558 -179.542 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.16 -31.37 68.82 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.837 0.351 . . . . 0.0 111.383 -179.663 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -66.95 -37.9 85.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.611 -179.406 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.771 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 21.0 p -59.41 -74.13 0.07 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.785 0.326 . . . . 0.0 111.122 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 143.03 -17.76 2.34 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.807 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.84 HD22 ' HB2' ' A' ' 15' ' ' PHE . 0.6 OUTLIER -50.49 -41.1 52.84 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.979 0.418 . . . . 0.0 110.756 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -73.94 -26.84 60.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.725 179.727 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.98 -26.91 57.22 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.975 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.492 ' CD ' HG21 ' A' ' 17' ' ' ILE . 0.3 OUTLIER -70.86 -171.08 0.49 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.115 -179.853 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.6 90.93 4.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.951 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 62.5 68.97 1.44 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.559 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -88.14 -22.0 24.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.779 0.323 . . . . 0.0 111.077 179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -53.92 143.26 21.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.307 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.695 HG21 ' HB3' ' A' ' 16' ' ' ARG . 1.6 pt -130.16 169.66 20.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.127 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.6 HD12 ' HB2' ' A' ' 91' ' ' ARG . 0.8 OUTLIER -84.59 147.56 49.65 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.67 179.845 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -66.02 -26.06 51.17 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.558 2.172 . . . . 0.0 112.353 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.6 ' HB2' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -61.16 -54.37 45.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.104 -179.897 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -50.91 71.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.12 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -54.22 -53.07 58.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.713 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.57 -20.8 62.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.502 179.546 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.15 -50.34 74.05 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.013 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.437 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 20.0 mm -75.4 -33.67 28.23 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.303 178.898 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.475 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 14.1 t-105 -52.75 -41.07 63.68 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.972 179.281 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.06 -29.0 23.74 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.381 179.188 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.437 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -61.35 -45.92 92.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.207 -179.813 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 44.3 t -88.02 -83.45 0.21 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.976 -179.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.557 ' C ' HD21 ' A' ' 60' ' ' LEU . . . -176.09 34.38 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.63 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.518 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -58.26 -54.89 33.99 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.603 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.869 ' HA ' HD11 ' A' ' 124' ' ' LEU . 1.8 mt -58.33 -34.69 50.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.796 0.331 . . . . 0.0 111.108 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.491 ' NE2' ' HA2' ' A' ' 101' ' ' GLY . 1.0 OUTLIER -63.75 -49.16 74.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.604 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -64.18 -42.52 96.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.432 179.611 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.939 ' CD1' HD13 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -64.0 -46.31 85.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.693 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.44 ' HG2' HD21 ' A' ' 124' ' ' LEU . 8.1 mm100 -61.49 -29.72 70.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.77 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 37.7 m -68.33 -50.31 54.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.749 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.27 -33.37 69.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.362 0.601 . . . . 0.0 109.518 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.641 HD11 HD22 ' A' ' 106' ' ' LEU . 8.6 mt -56.91 -48.92 80.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.368 179.146 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -67.86 -38.33 82.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.413 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 1.1 m -78.07 -4.88 49.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.235 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.8 mmt85 65.27 35.88 7.38 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.964 0.411 . . . . 0.0 110.922 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' GLN . . . . . 0.405 ' HB3' ' HG2' ' A' ' 65' ' ' LYS . 0.0 OUTLIER -111.15 -25.2 9.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.873 179.86 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.482 ' HB1' ' CG2' ' A' ' 121' ' ' THR . . . -56.45 -29.93 62.26 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.161 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 72.05 97.65 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.345 179.781 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.432 ' HB3' HG13 ' A' ' 6' ' ' ILE . 65.8 Cg_exo -52.3 87.85 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.746 2.297 . . . . 0.0 111.932 179.577 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.538 ' C ' HG23 ' A' ' 6' ' ' ILE . 9.0 t -112.22 -43.48 3.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.106 -179.643 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.47 ' CZ ' ' HG2' ' A' ' 12' ' ' GLN . 23.0 t80 -178.89 -63.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.035 179.855 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.699 ' HB1' ' NE ' ' A' ' 48' ' ' ARG . . . -53.67 -36.12 61.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.995 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.502 HG22 ' CG1' ' A' ' 110' ' ' ILE . 0.8 OUTLIER -60.83 -47.09 87.96 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.06 179.467 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.598 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -65.79 -46.4 78.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.389 0.614 . . . . 0.0 109.695 178.827 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' MET . . . . . 0.606 ' HE3' HD12 ' A' ' 127' ' ' LEU . 1.9 tmm? -58.11 -35.81 72.0 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.251 179.087 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.939 HD13 ' CD1' ' A' ' 106' ' ' LEU . 0.6 OUTLIER -67.69 -45.97 73.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.74 178.996 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.747 ' HA ' HD12 ' A' ' 128' ' ' LEU . 21.7 mm100 -50.52 -38.4 44.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.968 179.092 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -76.77 -34.95 58.0 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.065 179.102 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.606 HD12 ' HE3' ' A' ' 123' ' ' MET . 1.2 mt -59.3 -21.13 59.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.084 178.659 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.747 HD12 ' HA ' ' A' ' 125' ' ' GLN . 1.8 mt -91.6 -65.81 0.98 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.93 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 1.8 mmtt . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.283 -0.865 . . . . 0.0 111.213 179.9 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.838 0.352 . . . . 0.0 110.956 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.993 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.2 OUTLIER -63.22 -54.25 40.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.145 0.498 . . . . 0.0 110.897 -179.93 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.61 -36.07 61.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.232 0.539 . . . . 0.0 110.035 179.755 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -62.77 -44.87 95.05 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.891 179.716 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.453 ' CG ' ' O ' ' A' ' 2' ' ' ARG . 16.5 pt-20 -72.21 -45.48 60.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.934 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.993 HD12 ' O ' ' A' ' 2' ' ' ARG . 2.8 mp -65.49 -61.06 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.681 0.753 . . . . 0.0 109.96 179.008 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 44.1 t0 45.0 86.36 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.553 -1.203 . . . . 0.0 111.176 -179.347 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.0 ptp -88.46 52.14 2.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.048 -179.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.72 -28.02 14.08 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.005 179.787 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 51.5 mtt-85 -66.25 -177.49 0.53 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.877 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.71 138.16 31.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.874 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.456 ' HG2' ' CZ ' ' A' ' 119' ' ' TYR . 5.7 mp0 -108.08 102.82 11.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.889 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.483 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 2.5 mtp180 -111.92 133.84 53.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.019 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.505 ' CE2' ' CG ' ' A' ' 40' ' ' HIS . 1.2 m-85 -117.7 134.96 54.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.145 179.799 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.809 ' HB2' HD22 ' A' ' 80' ' ' LEU . 1.4 m-85 -136.31 157.23 47.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.251 0.548 . . . . 0.0 112.003 -179.037 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.707 ' HB3' HG21 ' A' ' 88' ' ' ILE . 16.4 ttp180 -149.38 145.89 27.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.785 179.428 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.685 HG21 ' CE ' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -140.84 125.01 10.48 Favored Pre-proline 0 C--N 1.328 -0.327 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.447 -179.72 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -88.19 96.75 0.4 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.009 2.473 . . . . 0.0 112.186 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.407 ' O ' ' CD1' ' A' ' 19' ' ' PHE . 10.9 p90 -120.39 142.61 49.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.912 0.387 . . . . 0.0 111.107 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.524 HG23 ' O ' ' A' ' 33' ' ' LYS . 17.0 mt -87.9 145.41 7.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.935 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.14 129.26 93.92 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.485 179.647 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.474 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 75.8 Cg_exo -50.04 -48.96 17.59 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.431 2.087 . . . . 0.0 112.659 -179.698 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.543 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -54.37 -58.24 8.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.439 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.554 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 36.9 m-20 -67.38 -31.77 72.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.913 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -51.61 -55.44 19.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.493 -179.574 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.543 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.0 p90 -93.89 -14.28 26.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.728 -179.43 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.554 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 3.0 mtpp -60.97 -47.25 87.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.952 0.406 . . . . 0.0 110.6 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -164.87 142.35 5.13 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.094 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -70.66 -22.42 27.96 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.735 2.29 . . . . 0.0 112.666 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -95.09 -32.83 12.92 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.789 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 30.5 m120 -101.37 48.14 0.9 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.728 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.01 59.53 0.67 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.795 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.524 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -44.25 146.14 0.7 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.259 179.938 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.26 117.49 34.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.013 -179.486 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -92.17 126.33 8.46 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.228 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 8.6 m-90 -102.16 135.21 44.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.902 0.382 . . . . 0.0 111.01 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.73 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 33.7 t90 -117.01 117.21 29.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.048 -179.601 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.868 ' CE1' HD12 ' A' ' 52' ' ' LEU . 12.0 m-85 -111.87 150.91 29.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.122 179.434 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.85 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -169.55 125.05 0.84 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.146 0.498 . . . . 0.0 112.042 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.505 ' CG ' ' CE2' ' A' ' 14' ' ' PHE . 14.4 t-160 -91.92 99.56 12.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.649 178.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.74 ' CZ ' HG21 ' A' ' 78' ' ' THR . 36.9 m-85 -85.23 118.87 25.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.776 -179.085 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.493 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.7 OUTLIER -91.59 115.17 27.82 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.28 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 57.78 -135.82 51.38 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 119.967 -1.111 . . . . 0.0 111.107 -178.341 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -72.38 -18.77 26.05 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.436 2.091 . . . . 0.0 112.353 179.417 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' TRP . . . . . 0.418 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.6 OUTLIER -114.24 -171.56 1.94 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.969 0.414 . . . . 0.0 111.692 -178.752 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.85 ' CD1' ' HB1' ' A' ' 39' ' ' ALA . 1.7 tt -131.03 148.5 33.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.509 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.613 ' CB ' HG21 ' A' ' 118' ' ' THR . . . -122.92 -20.58 5.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.839 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.749 ' O ' HD11 ' A' ' 46' ' ' ILE . 2.3 mtt180 -129.94 138.38 50.85 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.84 0.352 . . . . 0.0 111.333 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.475 ' HB3' ' HB3' ' A' ' 61' ' ' LEU . 7.2 tt0 -147.96 121.06 8.86 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.908 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 7.3 ttm -121.01 112.76 19.14 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.708 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -94.23 129.76 40.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.14 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.868 HD12 ' CE1' ' A' ' 38' ' ' TYR . 8.5 mt -129.05 112.1 13.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.854 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.8 m-70 -128.52 129.97 23.54 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.774 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.408 ' HB2' ' HG2' ' A' ' 33' ' ' LYS . 86.4 Cg_exo -46.68 -27.11 5.05 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.515 2.143 . . . . 0.0 112.543 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -95.08 -33.97 12.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.946 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.1 mtpt -111.95 120.44 42.03 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.954 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -47.56 174.05 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.598 2.199 . . . . 0.0 112.579 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.463 ' HA ' HD23 ' A' ' 52' ' ' LEU . 48.9 Cg_exo -55.95 85.38 0.04 OUTLIER 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.7 2.266 . . . . 0.0 112.341 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 84.5 mt -64.47 92.14 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.097 0.475 . . . . 0.0 110.737 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.591 HD21 ' N ' ' A' ' 102' ' ' GLY . 0.3 OUTLIER -64.68 132.78 50.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.719 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.96 HD11 ' HB3' ' A' ' 69' ' ' GLU . 0.2 OUTLIER -140.88 150.03 42.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.163 -179.52 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.526 HG12 ' HE2' ' A' ' 105' ' ' TYR . 13.3 p -153.36 148.96 13.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.121 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.558 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -60.26 166.92 2.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.974 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.18 -73.39 0.29 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.393 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -58.95 -57.6 12.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.845 0.355 . . . . 0.0 110.8 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.411 ' HB3' HD21 ' A' ' 61' ' ' LEU . 81.5 m-20 -108.96 48.51 0.86 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.639 179.8 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.22 -17.88 65.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.422 -179.938 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 17.9 mmt -82.14 -32.63 29.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.848 0.356 . . . . 0.0 110.563 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.96 ' HB3' HD11 ' A' ' 61' ' ' LEU . 1.2 mp0 -89.24 -40.81 12.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.799 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.434 ' CA ' HD22 ' A' ' 61' ' ' LEU . 32.1 ttm -53.34 162.51 0.74 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.142 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.502 ' SG ' HG22 ' A' ' 78' ' ' THR . 1.7 t -50.08 118.1 2.73 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.941 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -82.98 0.84 42.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.772 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.28 164.56 16.8 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.79 0.329 . . . . 0.0 110.997 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.555 ' O ' HG23 ' A' ' 78' ' ' THR . 7.2 m120 -83.31 -179.84 7.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.974 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.809 HD21 ' CE1' ' A' ' 15' ' ' PHE . 4.3 mt -65.78 -34.24 77.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.444 -179.673 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.5 -42.11 71.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.087 -178.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -93.87 -3.75 51.25 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.303 0.482 . . . . 0.0 112.303 -178.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.74 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.2 OUTLIER -67.08 -64.11 0.92 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.795 0.331 . . . . 0.0 110.813 179.945 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.405 ' CA ' ' NH1' ' A' ' 82' ' ' ARG . . . 129.82 -15.83 5.63 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.763 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.809 HD22 ' HB2' ' A' ' 15' ' ' PHE . 1.1 mp -68.25 -45.07 74.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.892 0.377 . . . . 0.0 110.892 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.755 HG23 HD22 ' A' ' 75' ' ' LEU . 52.9 p -65.44 -52.16 55.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.174 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.405 ' NH1' ' CA ' ' A' ' 79' ' ' GLY . 0.0 OUTLIER -62.01 -27.59 68.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.961 -179.833 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.685 ' CE ' HG21 ' A' ' 17' ' ' ILE . 0.4 OUTLIER -59.48 -167.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.861 179.83 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.18 73.67 7.17 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.005 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 59.71 65.35 3.47 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.651 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.99 -14.03 62.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.8 0.333 . . . . 0.0 111.492 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.69 143.18 21.13 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.273 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.707 HG21 ' HB3' ' A' ' 16' ' ' ARG . 2.1 pt -127.16 -179.88 3.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.193 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 8.9 mt -81.85 137.96 46.87 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.838 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.5 -51.25 5.43 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.428 2.085 . . . . 0.0 111.986 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.87 -38.26 69.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.19 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -62.33 -52.38 63.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.935 0.398 . . . . 0.0 110.981 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.53 ' HB2' HD11 ' A' ' 88' ' ' ILE . 43.2 t80 -54.27 -53.0 59.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.57 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.404 ' OE2' ' NH1' ' A' ' 48' ' ' ARG . 0.1 OUTLIER -68.8 -21.23 64.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.515 179.436 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.52 -50.64 72.75 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 179.041 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.438 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 17.4 mm -71.96 -32.9 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.351 179.157 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.469 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 19.4 t-105 -55.72 -37.22 68.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.995 179.047 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.68 -27.92 25.03 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.642 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.438 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.2 OUTLIER -56.58 -54.3 47.51 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.348 -179.541 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 40.9 t -83.54 -80.18 0.19 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.025 -179.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.566 ' C ' HD21 ' A' ' 60' ' ' LEU . . . 178.85 36.48 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.579 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.591 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -54.29 -55.23 27.6 Favored Glycine 0 N--CA 1.453 -0.188 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.418 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.821 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.6 mp -56.69 -40.49 70.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.768 0.318 . . . . 0.0 111.292 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -59.7 -49.03 79.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.571 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.526 ' HE2' HG12 ' A' ' 62' ' ' VAL . 82.9 t80 -61.26 -42.16 98.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.401 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 1.065 HD13 HD13 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -64.92 -41.56 95.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.63 179.705 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -63.11 -32.72 74.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.727 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -67.97 -50.18 57.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.514 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.4 -35.84 78.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.437 0.636 . . . . 0.0 109.456 178.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.637 HD12 HD22 ' A' ' 124' ' ' LEU . 3.8 mt -59.62 -48.87 85.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.357 179.012 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.405 ' HG3' ' N ' ' A' ' 112' ' ' SER . 7.5 pt-20 -67.03 -30.93 71.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.725 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' SER . . . . . 0.405 ' N ' ' HG3' ' A' ' 111' ' ' GLU . 23.4 m -86.23 -7.03 58.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.206 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 22.6 mmt85 70.27 29.01 3.75 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.898 0.38 . . . . 0.0 110.88 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 84.1 mm-40 -99.44 -25.18 14.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.587 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.04 -164.93 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.933 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ARG . . . . . 0.492 ' O ' HG22 ' A' ' 118' ' ' THR . 5.7 ttt180 -140.48 89.94 10.31 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.102 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.405 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 77.9 Cg_exo -51.31 87.91 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.705 2.27 . . . . 0.0 112.349 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.613 HG21 ' CB ' ' A' ' 47' ' ' ALA . 5.7 t -127.35 -45.03 1.53 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.868 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.456 ' CZ ' ' HG2' ' A' ' 12' ' ' GLN . 27.9 t80 -168.56 -61.66 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.886 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.458 ' O ' ' HG3' ' A' ' 123' ' ' MET . . . -54.09 -37.33 64.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.317 -179.73 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.605 HG22 ' CG1' ' A' ' 110' ' ' ILE . 0.2 OUTLIER -68.33 -41.06 81.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.557 179.961 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.662 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -65.53 -56.25 13.39 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.523 179.538 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' MET . . . . . 0.568 ' HE1' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -55.38 -29.12 57.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.315 179.293 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 1.065 HD13 HD13 ' A' ' 106' ' ' LEU . 0.3 OUTLIER -64.51 -52.4 58.0 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.079 0.466 . . . . 0.0 110.043 179.055 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 125' ' ' GLN . . . . . 0.753 ' HA ' HD12 ' A' ' 128' ' ' LEU . 11.2 mm100 -53.09 -42.69 66.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.717 179.741 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -78.63 -30.63 46.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.666 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.568 HD13 ' HE1' ' A' ' 123' ' ' MET . 1.3 tt -76.02 -7.81 55.53 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.523 179.269 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.753 HD12 ' HA ' ' A' ' 125' ' ' GLN . 7.0 mt -89.04 -10.61 46.88 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.24 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 14.6 mmtt . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.319 -0.848 . . . . 0.0 111.052 179.948 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.713 ' HB1' ' HB3' ' A' ' 4' ' ' GLN . . . . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.824 0.345 . . . . 0.0 110.993 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.91 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.2 OUTLIER -58.48 -59.91 4.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.887 179.9 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -53.39 -41.06 65.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.66 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.713 ' HB3' ' HB1' ' A' ' 1' ' ' ALA . 5.4 tp60 -61.04 -32.25 71.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.508 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.422 ' HG2' ' HB2' ' A' ' 117' ' ' PRO . 0.3 OUTLIER -77.77 -53.83 7.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.014 179.546 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.91 HD12 ' O ' ' A' ' 2' ' ' ARG . 2.7 mp -53.61 -64.6 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.327 0.584 . . . . 0.0 109.929 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.1 t0 42.25 88.46 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.405 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' MET . . . . . 0.455 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 0.0 OUTLIER -55.04 -90.29 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.968 -179.902 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.6 mtmt 44.26 33.34 0.82 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.688 0.28 . . . . 0.0 111.554 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -135.84 151.12 49.72 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.034 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.8 mm-40 -61.48 152.72 29.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.786 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.402 ' OE1' ' CE1' ' A' ' 40' ' ' HIS . 93.1 mm-40 -123.89 102.71 7.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.907 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.475 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -112.58 123.64 50.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.023 179.977 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.46 ' N ' ' CD1' ' A' ' 14' ' ' PHE . 2.5 m-85 -108.91 134.89 50.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.012 179.709 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.919 ' HB2' HD22 ' A' ' 80' ' ' LEU . 15.1 m-85 -132.79 148.84 52.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.234 0.54 . . . . 0.0 112.12 -178.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.92 ' HD3' HD12 ' A' ' 88' ' ' ILE . 0.3 OUTLIER -147.2 138.93 24.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.605 179.597 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.668 HG21 ' HG2' ' A' ' 83' ' ' LYS . 0.2 OUTLIER -149.33 123.27 4.63 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-O 120.725 0.298 . . . . 0.0 111.613 -179.582 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.449 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 91.0 Cg_endo -89.16 119.59 0.97 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.016 2.478 . . . . 0.0 111.964 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.432 ' O ' ' N ' ' A' ' 35' ' ' GLY . 11.4 p90 -139.31 154.84 47.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.883 0.373 . . . . 0.0 111.068 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 58.5 mt -105.06 142.19 18.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.769 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -58.76 136.99 86.87 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.47 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.457 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 15.9 Cg_endo -57.46 -46.56 26.79 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.516 2.144 . . . . 0.0 112.585 -179.624 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.523 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -55.44 -58.87 5.97 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.316 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.521 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 2.7 m-20 -66.52 -32.71 74.24 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.684 179.768 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.403 ' HA ' ' HE3' ' A' ' 32' ' ' LYS . 0.4 OUTLIER -50.62 -51.23 50.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.48 -179.696 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.523 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.8 p90 -103.32 -1.64 28.4 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.119 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.521 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 16.0 mtpp -77.89 -40.07 41.13 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.919 -0.313 . . . . 0.0 110.949 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -172.78 143.57 1.18 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.44 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.482 ' HA ' ' HG2' ' A' ' 32' ' ' LYS . 67.8 Cg_endo -73.03 -22.7 19.2 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.807 2.338 . . . . 0.0 112.295 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -83.97 -36.2 23.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.111 179.686 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -94.38 41.79 1.09 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.995 179.057 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.482 ' HG2' ' HA ' ' A' ' 29' ' ' PRO . 13.9 mmtm -80.74 59.93 3.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.779 -179.589 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.1 94.6 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.964 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.17 -170.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.979 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 19' ' ' PHE . . . -170.11 108.52 0.29 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.23 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.482 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 18.0 m-90 -97.58 131.57 44.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.846 0.355 . . . . 0.0 110.682 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.727 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 18.3 t90 -121.02 117.5 27.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.22 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.526 ' HE2' HD22 ' A' ' 52' ' ' LEU . 1.8 m-85 -120.2 148.02 44.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.201 179.34 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.706 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.47 124.64 0.71 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.215 0.531 . . . . 0.0 111.69 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.479 ' HB3' ' CG ' ' A' ' 48' ' ' ARG . 10.9 t-160 -93.22 105.77 17.81 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 178.536 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.719 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 3.0 m-85 -85.45 134.09 34.07 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.62 -178.558 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.498 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 4.5 t70 -97.25 120.93 38.51 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 178.501 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 57.31 -138.65 47.62 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 119.767 -1.206 . . . . 0.0 110.889 -178.385 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.413 ' O ' ' ND2' ' A' ' 74' ' ' ASN . 7.4 Cg_exo -72.26 -18.67 26.55 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.351 2.034 . . . . 0.0 112.089 179.212 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' TRP . . . . . 0.405 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -113.95 -169.34 1.5 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.292 -178.921 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.719 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 8.4 tt -118.34 156.58 20.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 N-CA-C 112.643 0.608 . . . . 0.0 112.643 -179.155 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.436 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -119.78 -36.46 3.3 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.763 -179.533 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.62 ' O ' HD11 ' A' ' 46' ' ' ILE . 6.4 ptp180 -140.07 153.44 46.76 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 120.501 -0.48 . . . . 0.0 111.406 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.472 ' HG3' ' HB2' ' A' ' 39' ' ' ALA . 30.8 tt0 -146.41 153.62 40.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.289 -179.836 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.489 ' HE2' ' HB3' ' A' ' 50' ' ' MET . 20.0 ttp -142.16 111.96 6.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.566 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -95.34 126.45 40.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.957 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.526 HD22 ' HE2' ' A' ' 38' ' ' TYR . 1.4 mp -123.41 113.77 19.25 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.775 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.446 ' HB2' ' HB2' ' A' ' 56' ' ' LYS . 0.7 OUTLIER -134.49 135.53 23.93 Favored Pre-proline 0 C--N 1.332 -0.194 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.974 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.56 -28.11 35.34 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.51 2.14 . . . . 0.0 112.319 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -102.31 -19.72 14.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.149 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.446 ' HB2' ' HB2' ' A' ' 53' ' ' HIS . 5.3 mmmt -117.82 122.32 30.76 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.727 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -52.89 164.92 1.38 Allowed 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.531 2.154 . . . . 0.0 112.237 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -57.11 88.57 0.04 OUTLIER 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.641 2.227 . . . . 0.0 112.381 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.2 mt -69.59 94.54 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.147 0.498 . . . . 0.0 110.496 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.594 HD23 ' CZ3' ' A' ' 97' ' ' TRP . 0.8 OUTLIER -84.42 107.36 16.64 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.978 -179.626 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 29.0 mt -107.68 161.0 15.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.94 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.522 HG21 HD21 ' A' ' 106' ' ' LEU . 12.9 p -153.31 139.84 12.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.085 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.53 137.4 48.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.165 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 100.98 -40.46 2.41 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.438 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.441 ' HG3' ' HB1' ' A' ' 109' ' ' ALA . 0.1 OUTLIER -102.87 -32.2 9.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.781 0.324 . . . . 0.0 110.853 -179.909 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -132.0 44.28 2.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.886 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -59.47 -30.56 68.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.911 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 2.4 mtp -84.91 -29.8 24.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.092 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -78.3 -55.74 5.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.962 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.6 ptm -59.81 -178.12 0.07 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.032 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.507 ' SG ' HG22 ' A' ' 78' ' ' THR . 2.2 t -62.29 118.25 7.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.759 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -98.91 6.41 46.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.459 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -102.74 -175.04 2.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.916 0.389 . . . . 0.0 111.114 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASN . . . . . 0.413 ' ND2' ' O ' ' A' ' 44' ' ' PRO . 21.0 t-20 -109.42 160.41 16.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.25 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.823 HD23 HG21 ' A' ' 81' ' ' THR . 0.2 OUTLIER -43.87 -37.4 2.81 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.506 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -70.77 -56.1 7.12 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.838 0.351 . . . . 0.0 111.73 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -71.37 -16.3 62.41 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.6 HG21 ' CE2' ' A' ' 41' ' ' PHE . 0.4 OUTLIER -64.82 -62.15 1.74 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.79 0.329 . . . . 0.0 111.092 -179.524 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 122.0 -26.5 6.44 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.256 -179.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.919 HD22 ' HB2' ' A' ' 15' ' ' PHE . 0.7 OUTLIER -48.92 -42.67 37.96 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.993 0.425 . . . . 0.0 110.649 179.683 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.823 HG21 HD23 ' A' ' 75' ' ' LEU . 39.0 p -70.41 -28.32 64.97 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.372 179.228 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 8.0 mmm-85 -96.25 6.43 48.81 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.019 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.743 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 0.4 OUTLIER -93.81 31.25 1.63 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.695 0.284 . . . . 0.0 111.277 -179.754 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 55.02 72.84 0.45 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.974 0.416 . . . . 0.0 111.263 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.72 65.42 3.56 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.888 -0.673 . . . . 0.0 113.115 179.468 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.743 ' HB2' ' HB3' ' A' ' 83' ' ' LYS . . . -93.85 32.15 1.5 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.84 0.352 . . . . 0.0 111.009 179.442 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -86.87 147.36 25.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.975 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.92 HD12 ' HD3' ' A' ' 16' ' ' ARG . 1.5 tt -130.01 159.44 42.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.802 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.733 HD12 ' HB2' ' A' ' 91' ' ' ARG . 0.4 OUTLIER -82.0 146.4 55.39 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.018 -179.908 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -62.51 -26.5 76.25 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.526 2.151 . . . . 0.0 112.508 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.733 ' HB2' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -60.7 -50.5 73.22 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.918 -179.968 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.416 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 12.8 mm-40 -66.4 -41.52 89.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.943 0.401 . . . . 0.0 110.943 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -57.93 -53.75 54.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.739 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.37 -20.86 62.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.48 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLU . . . . . 0.416 ' HB2' ' HA ' ' A' ' 92' ' ' GLN . 1.7 tm-20 -60.14 -50.29 74.27 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 178.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 18.5 mm -73.02 -33.28 42.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.307 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.594 ' CZ3' HD23 ' A' ' 60' ' ' LEU . 4.2 t-105 -54.79 -36.56 65.05 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.881 178.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.679 ' OE1' HD11 ' A' ' 103' ' ' ILE . 1.9 mp0 -85.41 -31.16 23.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.584 179.342 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -56.78 -54.61 44.38 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.584 -179.245 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' CYS . . . . . 0.464 ' SG ' HD11 ' A' ' 60' ' ' LEU . 42.3 t -82.37 -79.14 0.19 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.032 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 170.34 38.25 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.557 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.516 ' CA ' HD22 ' A' ' 60' ' ' LEU . . . -58.97 -50.77 64.21 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.575 -0.822 . . . . 0.0 112.182 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.818 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.3 mp -56.37 -53.07 44.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.842 0.354 . . . . 0.0 111.092 179.716 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -56.37 -39.84 73.57 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.994 0.426 . . . . 0.0 110.336 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -65.19 -45.36 85.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.062 179.172 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.906 HD22 HD11 ' A' ' 110' ' ' ILE . 0.4 OUTLIER -62.05 -43.31 99.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.261 179.488 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.513 ' HG2' HD23 ' A' ' 124' ' ' LEU . 0.2 OUTLIER -63.31 -29.83 71.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.722 179.679 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 40.4 t -67.64 -50.53 57.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.705 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.441 ' HB1' ' HG3' ' A' ' 65' ' ' LYS . . . -72.81 -35.03 67.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.487 0.66 . . . . 0.0 109.503 178.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.906 HD11 HD22 ' A' ' 106' ' ' LEU . 13.4 mt -57.57 -49.49 80.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.456 179.285 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -72.34 -37.93 68.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.6 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 3.1 m -68.88 -13.39 62.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.073 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 77.26 30.81 0.51 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.902 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -100.75 -29.43 12.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.561 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ALA . . . . . 0.61 ' HB1' ' CG2' ' A' ' 121' ' ' THR . . . -80.88 143.05 33.0 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.927 179.863 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -99.51 118.63 61.85 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.795 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.422 ' HB2' ' HG2' ' A' ' 5' ' ' GLU . 53.1 Cg_exo -55.62 88.68 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.529 2.153 . . . . 0.0 112.504 -179.828 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.764 ' O ' HG23 ' A' ' 6' ' ' ILE . 97.6 m -110.56 -70.3 0.82 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.557 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.455 ' CE2' ' HG2' ' A' ' 8' ' ' MET . 48.1 t80 -147.7 -53.54 0.21 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.745 179.643 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.453 ' HB2' ' HE ' ' A' ' 48' ' ' ARG . . . -62.78 -44.66 95.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.875 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.61 ' CG2' ' HB1' ' A' ' 115' ' ' ALA . 0.7 OUTLIER -60.72 -49.1 78.85 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.466 179.702 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.838 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -61.8 -48.03 82.48 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.367 0.603 . . . . 0.0 110.153 179.142 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' MET . . . . . 0.596 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -55.57 -38.52 69.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.527 179.309 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.906 HD13 ' CD1' ' A' ' 106' ' ' LEU . 0.2 OUTLIER -65.67 -44.29 86.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.988 179.163 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -50.9 -39.59 54.62 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.924 179.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -81.44 -32.55 32.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.113 179.012 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.596 HD13 ' CE ' ' A' ' 123' ' ' MET . 1.7 tp -60.01 -19.74 54.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.489 179.131 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.4 mt -72.36 -28.7 63.2 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.032 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.941 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.754 0.312 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.921 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -56.82 -59.72 4.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.794 179.94 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -55.22 -36.83 66.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.655 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.6 tp60 -59.09 -38.26 79.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.962 0.411 . . . . 0.0 110.611 179.774 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -71.27 -57.13 4.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.111 179.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.963 HG12 ' HB2' ' A' ' 122' ' ' ALA . 2.9 mp -55.32 -62.28 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.163 179.049 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.9 t0 42.6 81.75 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.878 -1.055 . . . . 0.0 111.503 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.5 ptp -65.6 -19.27 65.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.309 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.8 mmtp -52.2 -28.71 19.34 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.186 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -63.68 154.57 32.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.878 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -70.24 130.34 41.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.072 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.462 ' HG3' ' CZ ' ' A' ' 119' ' ' TYR . 69.8 mm-40 -111.79 108.52 17.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.883 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.503 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 13.1 mtp180 -109.8 130.52 55.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.905 0.384 . . . . 0.0 110.915 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PHE . . . . . 0.515 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 0.8 OUTLIER -115.67 134.85 54.63 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.996 179.879 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.616 ' HE2' HD21 ' A' ' 75' ' ' LEU . 5.9 m-85 -139.58 155.62 47.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.404 0.621 . . . . 0.0 112.313 -178.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.581 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.4 OUTLIER -149.26 144.86 26.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.519 179.122 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.72 HD11 HD13 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -136.13 125.58 15.94 Favored Pre-proline 0 C--N 1.327 -0.408 0 C-N-CA 120.893 -0.323 . . . . 0.0 111.834 -179.345 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.423 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 73.8 Cg_endo -89.2 96.92 0.34 Allowed 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.928 2.419 . . . . 0.0 111.664 179.337 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -119.17 153.81 34.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.973 0.416 . . . . 0.0 111.269 -179.457 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.618 HG21 ' HB2' ' A' ' 32' ' ' LYS . 11.2 mt -101.95 140.02 21.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.065 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.9 mtp180 -59.9 133.92 89.75 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.417 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.476 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 50.2 Cg_exo -53.59 -52.05 9.46 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.533 2.155 . . . . 0.0 113.0 -179.515 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.561 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -53.64 -58.78 5.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.522 -179.494 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.543 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 3.4 m-20 -67.71 -28.71 67.9 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.88 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.407 ' HB3' ' O ' ' A' ' 22' ' ' PRO . 0.1 OUTLIER -53.09 -57.34 10.73 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.599 -179.405 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.561 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.9 p90 -87.28 -17.19 33.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.562 -179.432 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.543 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -58.53 -53.23 60.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.899 0.381 . . . . 0.0 110.813 179.684 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -159.75 143.75 10.78 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.17 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -73.2 -7.96 21.31 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.604 2.203 . . . . 0.0 112.724 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -110.48 -36.59 5.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.901 0.382 . . . . 0.0 110.873 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -99.59 32.07 2.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.854 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.618 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -74.33 -30.04 61.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.935 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 42.6 mmtt 58.21 100.9 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.979 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.433 ' HG2' HG12 ' A' ' 20' ' ' ILE . 0.2 OUTLIER -85.0 119.79 25.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.917 179.966 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.422 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -105.85 143.79 15.75 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.907 -179.81 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.423 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 7.3 m-90 -108.99 137.44 46.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.811 0.338 . . . . 0.0 110.907 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.557 ' HZ3' HD21 ' A' ' 80' ' ' LEU . 31.9 t90 -118.79 117.22 28.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.5 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.858 ' CE1' HD12 ' A' ' 52' ' ' LEU . 22.1 m-85 -111.61 149.29 31.69 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.778 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.443 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.37 124.85 0.73 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.088 0.471 . . . . 0.0 111.294 179.815 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.515 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 9.7 t-160 -95.27 103.78 15.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.673 179.35 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.686 ' CE2' HG21 ' A' ' 78' ' ' THR . 4.4 m-85 -89.58 128.84 36.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.164 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.427 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 7.7 p-10 -96.65 114.43 26.07 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 178.623 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 58.23 -137.34 50.09 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.015 -1.088 . . . . 0.0 111.107 -178.505 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo -71.71 -16.46 29.95 Favored 'Trans proline' 0 CA--C 1.529 0.261 0 C-N-CA 122.503 2.135 . . . . 0.0 112.434 179.541 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' TRP . . . . . 0.408 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -114.73 -171.76 1.99 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.891 0.377 . . . . 0.0 111.804 -178.574 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.602 ' HB ' ' CD2' ' A' ' 41' ' ' PHE . 6.7 tt -131.24 153.86 39.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.875 -179.465 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.727 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -132.28 -20.59 2.39 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.811 -0.631 . . . . 0.0 112.317 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.745 ' NE ' ' HB2' ' A' ' 120' ' ' ALA . 4.6 mtm180 -129.03 136.26 50.06 Favored 'General case' 0 C--N 1.334 -0.079 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.052 -179.617 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.433 ' HB3' ' HB2' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -140.97 122.92 15.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.087 -179.958 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.557 ' SD ' HD11 ' A' ' 52' ' ' LEU . 5.2 ttm -125.07 112.59 16.69 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.7 179.732 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.506 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -95.27 133.29 39.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.099 -179.774 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.858 HD12 ' CE1' ' A' ' 38' ' ' TYR . 30.3 mt -135.13 108.77 7.96 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.735 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.422 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 1.7 m-70 -128.39 135.78 28.08 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 120.699 0.285 . . . . 0.0 111.057 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -54.21 -23.46 29.83 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.534 2.156 . . . . 0.0 112.161 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -104.5 -21.42 13.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.04 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.417 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 1.2 mmmm -119.12 125.17 27.78 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.754 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 56' ' ' LYS . 9.4 Cg_endo -52.75 167.58 0.6 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.49 2.126 . . . . 0.0 112.357 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.469 ' HA ' ' O ' ' A' ' 51' ' ' GLU . 20.0 Cg_endo -60.61 88.4 0.08 OUTLIER 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.718 2.279 . . . . 0.0 112.358 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.506 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 58.3 mt -64.97 105.83 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.814 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.678 HD21 ' N ' ' A' ' 102' ' ' GLY . 0.2 OUTLIER -82.11 122.74 28.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.02 -179.905 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.484 HD13 ' HB3' ' A' ' 69' ' ' GLU . 91.1 mt -134.83 151.25 50.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.93 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.8 p -154.2 148.16 13.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.071 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.727 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -60.39 140.17 57.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.957 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.97 -46.78 1.56 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.381 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.568 ' HG3' ' HB2' ' A' ' 109' ' ' ALA . 0.1 OUTLIER -92.32 -55.91 3.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.876 0.369 . . . . 0.0 110.69 179.835 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.45 ' HB3' HD22 ' A' ' 61' ' ' LEU . 1.6 m-20 -109.74 37.63 2.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.775 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -54.14 -28.71 41.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.048 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -83.42 -28.91 28.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.84 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.484 ' HB3' HD13 ' A' ' 61' ' ' LEU . 1.6 mm-40 -77.45 -51.12 11.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.922 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.52 ' HE1' ' N ' ' A' ' 63' ' ' ALA . 4.1 ptp -50.18 175.87 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.832 0.349 . . . . 0.0 111.179 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.7 ' SG ' HG22 ' A' ' 78' ' ' THR . 0.9 OUTLIER -55.64 -49.21 73.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.049 -179.86 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.423 ' CB ' ' O ' ' A' ' 71' ' ' CYS . 20.1 tt0 83.47 -40.58 0.09 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.345 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.614 ' HB2' HG23 ' A' ' 78' ' ' THR . 4.2 mmtt -56.28 -168.74 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.007 0.432 . . . . 0.0 111.13 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -109.78 -174.99 2.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.969 179.42 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.616 HD21 ' HE2' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -60.1 -53.96 51.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.708 0.289 . . . . 0.0 111.643 -179.406 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -71.03 -53.39 14.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.812 0.339 . . . . 0.0 111.846 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -49.08 -36.8 19.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.186 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' THR . . . . . 0.7 HG22 ' SG ' ' A' ' 71' ' ' CYS . 0.9 OUTLIER -62.26 -65.86 0.63 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.755 0.312 . . . . 0.0 111.22 -179.569 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 130.43 -5.47 5.92 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.901 -179.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.72 HD13 HD11 ' A' ' 17' ' ' ILE . 3.8 mm? -53.26 -40.32 64.55 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.142 0.496 . . . . 0.0 110.23 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' THR . . . . . 0.452 HG23 HD12 ' A' ' 75' ' ' LEU . 11.4 p -81.05 -33.09 33.74 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.599 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -56.06 -32.26 63.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.558 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.423 ' CD ' ' CG2' ' A' ' 17' ' ' ILE . 1.9 tttp -72.27 179.81 3.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.732 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -96.73 75.25 2.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.893 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 80.42 67.47 1.55 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.631 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.596 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -97.93 20.15 12.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.771 0.32 . . . . 0.0 111.217 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -89.18 151.14 22.34 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.157 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.581 HG21 ' HB3' ' A' ' 16' ' ' ARG . 1.5 pt -133.83 159.44 42.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.11 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.626 HD23 ' H ' ' A' ' 89' ' ' LEU . 0.7 OUTLIER -72.69 151.71 91.32 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.861 179.912 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -72.5 -24.72 18.7 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.765 2.31 . . . . 0.0 112.815 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.549 ' HB3' HD12 ' A' ' 89' ' ' LEU . 0.1 OUTLIER -64.72 -46.78 80.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.75 -179.809 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -67.68 -38.45 83.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.768 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -57.98 -53.23 60.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.817 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -72.28 -21.86 61.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.644 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.26 -50.49 73.82 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.061 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.41 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 17.2 mm -73.0 -33.73 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.168 178.813 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' TRP . . . . . 0.464 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 10.3 t-105 -53.78 -39.28 65.29 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.097 179.071 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -85.92 -27.2 25.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.8 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.41 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 5.8 mtm180 -56.59 -43.97 80.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.098 -179.797 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 42.5 t -93.89 -79.61 0.41 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.871 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.528 ' C ' HD21 ' A' ' 60' ' ' LEU . . . 176.12 36.77 0.05 OUTLIER Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.569 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.678 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -59.33 -50.73 64.6 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.391 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.809 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.3 mp -57.66 -50.01 78.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 120.761 0.315 . . . . 0.0 111.13 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -56.29 -44.41 79.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.933 0.397 . . . . 0.0 110.51 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -62.13 -46.29 89.68 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.14 179.342 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' LEU . . . . . 0.952 HD13 HD13 ' A' ' 124' ' ' LEU . 0.5 OUTLIER -62.02 -40.48 95.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.338 179.486 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.485 ' HG2' HD23 ' A' ' 124' ' ' LEU . 0.1 OUTLIER -64.05 -29.75 70.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.687 179.545 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 35.7 t -69.28 -50.31 48.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.658 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.568 ' HB2' ' HG3' ' A' ' 65' ' ' LYS . . . -72.54 -35.33 68.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.452 0.644 . . . . 0.0 109.567 178.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.824 HD11 HD22 ' A' ' 106' ' ' LEU . 13.1 mt -58.26 -49.4 81.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.426 179.195 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -72.56 -38.6 67.91 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.597 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 1.7 m -66.6 -15.67 63.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.184 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 77.16 34.97 0.37 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.972 0.415 . . . . 0.0 110.89 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 49.6 mm-40 -107.16 -28.19 10.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.626 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.67 151.25 39.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.029 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -107.38 108.98 62.49 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.95 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' PRO . . . . . 0.433 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 81.8 Cg_exo -46.29 92.18 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.68 2.253 . . . . 0.0 112.699 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.701 HG21 ' HB2' ' A' ' 47' ' ' ALA . 14.2 m -112.72 -55.69 2.49 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.742 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' TYR . . . . . 0.466 ' HA ' HG23 ' A' ' 6' ' ' ILE . 51.0 t80 -166.55 -57.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.909 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.745 ' HB2' ' NE ' ' A' ' 48' ' ' ARG . . . -54.51 -43.08 71.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.054 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' THR . . . . . 0.468 HG22 ' CD2' ' A' ' 106' ' ' LEU . 9.2 p -58.41 -49.0 78.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.425 179.644 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.963 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -60.98 -49.95 75.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.38 0.61 . . . . 0.0 109.6 178.807 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' MET . . . . . 0.709 ' HE1' HD13 ' A' ' 127' ' ' LEU . 2.2 tmm? -55.95 -30.85 62.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.069 178.915 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.952 HD13 HD13 ' A' ' 106' ' ' LEU . 0.2 OUTLIER -70.02 -46.52 64.91 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.852 178.979 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 59.6 mm-40 -51.45 -38.65 54.79 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.027 179.142 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -77.82 -36.03 50.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.05 179.241 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.709 HD13 ' HE1' ' A' ' 123' ' ' MET . 0.4 OUTLIER -61.34 -18.2 57.51 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.408 178.937 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.603 ' O ' HD12 ' A' ' 128' ' ' LEU . 1.0 OUTLIER -140.64 80.33 1.75 Allowed 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.953 -179.949 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.114 -0.946 . . . . 0.0 110.942 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.076 0 CA-C-O 120.796 0.331 . . . . 0.0 110.792 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.49 138.43 35.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.784 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.462 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 7.7 mp0 -124.5 115.76 21.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.994 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.473 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 8.1 mmt85 -134.58 130.79 37.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.002 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.519 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 0.2 OUTLIER -121.58 137.61 54.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.133 179.792 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.636 ' CZ ' HD11 ' A' ' 75' ' ' LEU . 0.1 OUTLIER -144.09 167.01 23.39 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.292 0.567 . . . . 0.0 112.007 -179.824 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.452 ' CD ' HG21 ' A' ' 88' ' ' ILE . 7.2 ptm180 -149.09 153.47 37.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.525 178.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -153.47 113.39 2.62 Favored Pre-proline 0 C--N 1.328 -0.365 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.612 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.429 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 75.5 Cg_endo -87.65 98.97 0.45 Allowed 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 123.026 2.484 . . . . 0.0 112.214 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -118.53 141.83 48.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.96 0.409 . . . . 0.0 111.076 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.547 HG21 ' HB2' ' A' ' 32' ' ' LYS . 14.6 mt -87.1 147.41 5.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.217 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.428 ' HD2' ' CE1' ' A' ' 53' ' ' HIS . 5.4 mtt180 -69.17 133.47 89.64 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.985 179.259 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.502 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 12.0 Cg_endo -55.76 -49.27 16.31 Favored 'Trans proline' 0 N--CA 1.464 -0.215 0 C-N-CA 122.524 2.15 . . . . 0.0 112.462 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.553 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -51.17 -58.69 5.48 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.307 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.51 ' HA ' ' CG ' ' A' ' 27' ' ' LYS . 1.2 m-20 -69.68 -30.29 67.91 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.094 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.439 ' HB3' ' HA ' ' A' ' 22' ' ' PRO . 0.0 OUTLIER -53.17 -46.15 68.81 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.668 -179.065 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.553 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.3 p90 -98.85 -36.45 9.78 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -177.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.511 ' HG2' ' O ' ' A' ' 23' ' ' ALA . 6.5 ptmt -60.95 -32.23 71.77 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.537 -0.465 . . . . 0.0 111.303 -178.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.432 ' CB ' ' HB2' ' A' ' 31' ' ' ASN . 43.4 m-20 -155.56 117.13 2.32 Favored Pre-proline 0 C--N 1.329 -0.316 0 C-N-CA 121.014 -0.274 . . . . 0.0 111.426 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -66.69 -24.4 47.76 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.418 2.078 . . . . 0.0 112.187 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.1 mp0 -94.58 -43.17 8.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.636 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.432 ' HB2' ' CB ' ' A' ' 28' ' ' ASP . 27.3 m-80 -88.16 53.96 2.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.439 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.547 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -119.62 70.19 0.85 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.253 -179.563 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.9 mmpt? -40.9 133.27 2.17 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.246 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.52 124.21 41.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.719 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -99.68 129.35 9.87 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.586 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.481 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 21.3 m-90 -102.03 124.79 48.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.955 0.407 . . . . 0.0 110.728 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.534 ' HZ3' HD22 ' A' ' 80' ' ' LEU . 82.6 t90 -114.69 117.01 29.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.149 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.701 ' CE1' HD12 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -117.84 148.89 41.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.087 179.216 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.653 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -157.31 124.68 5.23 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.126 0.489 . . . . 0.0 111.723 -179.104 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.519 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 9.5 t-160 -97.64 93.38 6.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.066 178.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.641 ' CZ ' HG21 ' A' ' 78' ' ' THR . 21.7 m-85 -77.53 149.36 34.92 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.535 -179.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.485 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 86.8 m-20 -122.83 110.81 15.91 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.08 178.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.535 ' O ' HD23 ' A' ' 75' ' ' LEU . . . 61.9 -134.01 46.54 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 119.921 -1.133 . . . . 0.0 111.074 -178.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.407 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.4 Cg_exo -73.68 -14.65 24.51 Favored 'Trans proline' 0 CA--C 1.53 0.294 0 C-N-CA 122.448 2.099 . . . . 0.0 112.644 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' TRP . . . . . 0.414 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.6 OUTLIER -121.93 -162.89 1.02 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.665 -178.413 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.798 HD11 ' O ' ' A' ' 48' ' ' ARG . 2.2 tt -135.21 154.45 35.85 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.129 0 CA-C-O 121.028 0.442 . . . . 0.0 111.688 -179.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.423 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -126.55 -19.14 4.65 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.267 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.798 ' O ' HD11 ' A' ' 46' ' ' ILE . 7.2 mtm180 -128.73 133.56 48.17 Favored 'General case' 0 C--O 1.23 0.055 0 CA-C-O 120.951 0.405 . . . . 0.0 111.084 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.509 ' HG2' HD12 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -142.08 137.53 31.08 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.924 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.488 ' HG3' ' HB2' ' A' ' 38' ' ' TYR . 0.6 OUTLIER -146.82 128.5 15.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.614 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.401 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 2.5 mt-10 -117.36 138.76 51.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.196 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.701 HD12 ' CE1' ' A' ' 38' ' ' TYR . 4.7 mt -135.12 120.77 19.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.055 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.428 ' CE1' ' HD2' ' A' ' 21' ' ' ARG . 0.3 OUTLIER -133.61 131.62 21.37 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.5 179.701 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -48.21 -27.05 8.93 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.639 2.226 . . . . 0.0 112.697 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -106.66 -13.87 15.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.27 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.62 120.97 30.25 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.797 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -49.83 168.21 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.585 2.19 . . . . 0.0 112.506 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -60.32 96.96 0.11 Allowed 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.552 2.168 . . . . 0.0 112.405 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.401 ' HB ' ' HB2' ' A' ' 51' ' ' GLU . 7.8 mt -79.1 96.04 2.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.079 0.466 . . . . 0.0 110.755 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.544 HD23 ' CZ3' ' A' ' 97' ' ' TRP . 1.0 OUTLIER -86.83 116.37 24.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.797 -179.903 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.565 HD13 ' HB3' ' A' ' 69' ' ' GLU . 20.1 mt -119.76 151.89 38.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.952 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.885 HG22 ' CE2' ' A' ' 105' ' ' TYR . 16.1 m -143.42 158.5 17.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.114 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.47 148.22 52.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.126 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.51 -55.6 4.18 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.526 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.476 ' HE2' ' HB2' ' A' ' 109' ' ' ALA . 3.4 mttm -80.28 -67.02 0.81 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.864 0.364 . . . . 0.0 110.871 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -97.24 39.82 1.17 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.819 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.85 -28.63 61.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.016 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -82.88 -27.18 30.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.901 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.565 ' HB3' HD13 ' A' ' 61' ' ' LEU . 0.4 OUTLIER -82.45 -54.39 5.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.102 -179.829 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.0 ptp -56.59 174.32 0.15 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.096 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.83 128.12 35.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.989 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.17 43.18 1.41 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.798 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.31 131.45 16.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.801 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -53.96 167.82 0.25 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.017 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.636 HD11 ' CZ ' ' A' ' 15' ' ' PHE . 2.6 mm? -44.04 -53.57 6.2 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.155 -179.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -70.38 -32.03 69.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.966 -179.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -80.09 -11.17 59.79 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.82 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.714 ' CG2' HD21 ' A' ' 80' ' ' LEU . 0.1 OUTLIER -74.41 -67.19 0.65 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.88 0.372 . . . . 0.0 111.054 -179.947 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 124.84 -27.94 5.3 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.287 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.714 HD21 ' CG2' ' A' ' 78' ' ' THR . 0.0 OUTLIER -59.55 -35.0 73.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.999 0.428 . . . . 0.0 110.382 179.684 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.439 ' CG2' HD12 ' A' ' 75' ' ' LEU . 0.6 OUTLIER -66.47 -40.97 89.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.56 179.595 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 13.8 mtt180 -67.35 -28.86 68.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.857 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.7 mtpt -55.28 -176.41 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.972 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.44 76.74 5.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.206 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 72.56 66.83 1.97 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.968 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -83.83 -17.62 40.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.764 0.316 . . . . 0.0 110.954 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.446 ' HA ' ' O ' ' A' ' 14' ' ' PHE . 0.6 OUTLIER -52.27 160.16 0.84 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.932 0.396 . . . . 0.0 111.645 -179.708 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.656 HD12 ' O ' ' A' ' 89' ' ' LEU . 1.5 pp -149.73 -179.72 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.899 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.656 ' O ' HD12 ' A' ' 88' ' ' ILE . 1.2 mp -98.69 148.18 34.2 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.668 179.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -65.64 -22.0 58.4 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.62 2.213 . . . . 0.0 112.443 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.33 -40.32 93.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.046 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -69.85 -45.57 67.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.905 0.383 . . . . 0.0 110.936 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.431 ' CZ ' ' HB3' ' A' ' 48' ' ' ARG . 14.0 t80 -57.38 -51.59 68.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.746 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.03 -22.83 63.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.78 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.11 -50.45 71.85 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.123 0.487 . . . . 0.0 109.793 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.467 HG21 HD11 ' A' ' 52' ' ' LEU . 20.6 mm -76.98 -33.97 21.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.757 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.544 ' CZ3' HD23 ' A' ' 60' ' ' LEU . 3.4 t-105 -52.42 -41.13 62.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.997 179.464 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -86.33 -30.55 22.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.633 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.423 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -56.83 -29.88 63.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.341 -179.694 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 16.2 m -107.23 -77.9 0.59 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.201 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 172.85 33.57 0.03 OUTLIER Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.621 -0.799 . . . . 0.0 112.743 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.478 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -60.08 -48.54 85.61 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.311 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.942 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.6 mp -52.86 -42.53 43.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.816 0.341 . . . . 0.0 111.102 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.91 -44.86 96.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.018 0.437 . . . . 0.0 110.282 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.885 ' CE2' HG22 ' A' ' 62' ' ' VAL . 10.6 t80 -62.58 -43.12 99.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.359 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.884 ' CD1' HD13 ' A' ' 124' ' ' LEU . 0.5 OUTLIER -66.0 -44.6 84.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.89 179.883 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.57 ' NE2' HD11 ' A' ' 128' ' ' LEU . 1.7 mt-30 -61.11 -29.92 70.05 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.987 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.61 -50.44 30.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.894 -179.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.617 ' HB3' ' HB2' ' A' ' 115' ' ' ALA . . . -72.41 -31.66 65.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.443 0.64 . . . . 0.0 109.746 179.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.754 HD11 HD22 ' A' ' 106' ' ' LEU . 9.3 mt -57.91 -49.01 82.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-N 115.063 -0.972 . . . . 0.0 110.448 179.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -70.61 -36.71 73.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.605 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 6.4 p -77.45 -6.61 54.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.214 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 27.6 mmt85 67.89 31.54 5.65 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.864 0.364 . . . . 0.0 110.9 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -107.94 -28.85 9.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.665 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.617 ' HB2' ' HB3' ' A' ' 109' ' ' ALA . . . -59.12 -21.54 59.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.329 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 65.35 82.09 0.21 Allowed Pre-proline 0 C--N 1.332 -0.171 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.851 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . 0.432 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 1.1 Cg_endo -45.36 97.48 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.854 2.37 . . . . 0.0 112.46 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 19.3 m -117.34 -55.81 2.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.91 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.462 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 8.2 t80 -160.32 -52.26 0.05 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.189 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.613 ' HB2' ' HE ' ' A' ' 48' ' ' ARG . . . -56.87 -41.88 78.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.313 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.697 HG22 ' CD2' ' A' ' 106' ' ' LEU . 80.6 p -57.93 -49.25 77.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.559 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.24 -49.02 78.8 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.353 0.597 . . . . 0.0 109.56 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -57.49 -32.56 67.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.855 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.942 HD11 ' HA ' ' A' ' 103' ' ' ILE . 0.4 OUTLIER -68.6 -46.1 70.22 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.026 179.035 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.696 ' HA ' HD12 ' A' ' 128' ' ' LEU . 82.0 mm-40 -51.47 -39.54 57.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.804 -0.634 . . . . 0.0 109.974 179.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 43.2 m-20 -78.94 -32.1 45.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.292 179.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.2 tp -74.14 -7.34 52.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.925 179.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.696 HD12 ' HA ' ' A' ' 125' ' ' GLN . 38.6 mt . . . . . 0 C--N 1.333 -0.152 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.098 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 84.8 mtt-85 . . . . . 0 N--CA 1.458 -0.071 0 CA-C-O 120.78 0.324 . . . . 0.0 110.996 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -76.44 163.67 26.73 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.818 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.5 mp0 -121.43 103.0 8.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.041 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.486 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -116.99 122.09 43.25 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.613 -179.88 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.506 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 2.2 m-85 -108.51 148.71 29.84 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.677 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.571 ' HB2' HD22 ' A' ' 80' ' ' LEU . 1.8 m-85 -146.74 149.57 33.65 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.38 0.609 . . . . 0.0 112.186 -179.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.445 ' HG3' ' CE2' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -148.69 136.67 20.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.229 179.198 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.649 HG23 ' HB1' ' A' ' 86' ' ' ALA . 0.5 OUTLIER -141.67 131.91 12.86 Favored Pre-proline 0 C--N 1.329 -0.305 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.252 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -90.52 115.52 0.52 Allowed 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 123.183 2.589 . . . . 0.0 111.722 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.438 ' CD1' ' N ' ' A' ' 19' ' ' PHE . 2.1 p90 -134.08 149.56 51.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.89 0.376 . . . . 0.0 110.908 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.581 HG21 ' HB2' ' A' ' 32' ' ' LYS . 12.3 mt -98.77 140.59 18.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.122 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.5 mtp180 -65.01 124.53 86.96 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.296 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.487 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 86.2 Cg_exo -46.43 -50.36 10.41 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.523 2.149 . . . . 0.0 112.853 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.565 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -50.24 -58.46 5.56 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.118 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.529 ' HA ' ' CG ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -68.66 -31.37 70.45 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.161 179.838 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.455 ' HB3' ' HA ' ' A' ' 22' ' ' PRO . 0.0 OUTLIER -53.07 -45.48 68.14 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.757 -178.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.565 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.2 p90 -98.08 -36.6 10.04 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -177.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.529 ' CG ' ' HA ' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -59.88 -31.88 70.2 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.353 -179.068 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.443 ' CB ' ' HB2' ' A' ' 31' ' ' ASN . 28.0 m-20 -153.59 125.67 3.84 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 120.835 -0.346 . . . . 0.0 111.475 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -72.97 -28.73 12.77 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.487 2.125 . . . . 0.0 112.014 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.4 mm-40 -94.02 -44.04 8.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.449 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.443 ' HB2' ' CB ' ' A' ' 28' ' ' ASP . 44.5 m-20 -85.67 55.14 3.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.409 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.581 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -122.33 68.77 0.95 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.089 -179.707 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.5 mmpt? -41.5 135.72 2.0 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.123 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.15 109.84 22.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.856 -179.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.407 ' O ' ' CD1' ' A' ' 19' ' ' PHE . . . -83.76 123.63 6.26 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.332 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 8.1 m-90 -98.13 132.57 43.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.796 0.331 . . . . 0.0 110.784 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.711 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 27.2 t90 -114.06 117.86 32.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.259 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.908 ' CE1' HD12 ' A' ' 52' ' ' LEU . 3.3 m-85 -110.1 149.72 29.63 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.006 179.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.615 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -170.34 124.81 0.73 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.162 0.506 . . . . 0.0 112.132 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.506 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 20.1 t-160 -96.9 99.62 11.17 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.623 178.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.731 ' CZ ' HG21 ' A' ' 78' ' ' THR . 18.3 m-85 -85.65 119.95 26.54 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.497 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.448 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 12.1 p-10 -88.18 110.86 21.03 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.38 -136.29 49.48 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 119.954 -1.117 . . . . 0.0 110.842 -178.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_exo -72.09 -16.46 28.69 Favored 'Trans proline' 0 CA--C 1.531 0.33 0 C-N-CA 122.407 2.071 . . . . 0.0 112.335 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' TRP . . . . . 0.414 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.8 OUTLIER -115.81 -173.51 2.36 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.773 0.32 . . . . 0.0 111.795 -178.491 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.615 HD12 ' HB1' ' A' ' 39' ' ' ALA . 3.6 tt -131.02 153.04 38.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 121.227 0.537 . . . . 0.0 112.211 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.449 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -130.33 -22.6 2.76 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.739 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.576 ' O ' HD11 ' A' ' 46' ' ' ILE . 5.2 ttt180 -127.88 140.3 52.1 Favored 'General case' 0 N--CA 1.461 0.084 0 CA-C-O 120.778 0.323 . . . . 0.0 111.159 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.546 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 18.0 tt0 -153.44 136.39 15.45 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.003 0.43 . . . . 0.0 111.136 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.412 ' HG2' ' CZ3' ' A' ' 97' ' ' TRP . 0.0 OUTLIER -136.61 132.65 35.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.63 179.724 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.483 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 0.3 OUTLIER -119.32 125.91 50.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.815 179.865 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.908 HD12 ' CE1' ' A' ' 38' ' ' TYR . 0.8 OUTLIER -125.54 113.53 17.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.965 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.615 ' CE1' HD12 ' A' ' 59' ' ' ILE . 14.6 m80 -122.23 133.89 24.56 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.703 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -50.69 -24.35 12.87 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.405 2.07 . . . . 0.0 112.518 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -106.38 -22.15 12.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.244 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 4.9 mmtt -115.18 125.95 28.34 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.985 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -49.49 167.55 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.425 2.083 . . . . 0.0 112.614 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.433 ' HB3' HD23 ' A' ' 52' ' ' LEU . 37.4 Cg_exo -60.89 84.07 0.08 OUTLIER 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.715 2.277 . . . . 0.0 112.418 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.615 HD12 ' CE1' ' A' ' 53' ' ' HIS . 21.5 mt -60.44 106.73 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.679 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.469 ' HG ' ' CH2' ' A' ' 97' ' ' TRP . 0.9 OUTLIER -83.86 117.31 23.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.949 -179.78 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.883 HD11 ' CB ' ' A' ' 69' ' ' GLU . 1.5 mm? -117.14 146.86 42.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.786 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.536 HG21 HD21 ' A' ' 106' ' ' LEU . 13.5 p -155.11 156.66 4.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.338 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.449 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -72.66 138.79 46.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.758 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.4 ' CA ' ' HD3' ' A' ' 116' ' ' ARG . . . 91.21 -62.74 2.82 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.242 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.446 ' HB2' ' HA ' ' A' ' 115' ' ' ALA . 2.2 tmtp? -67.4 -35.16 78.74 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.992 0.425 . . . . 0.0 110.512 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.5 ' CB ' HD13 ' A' ' 61' ' ' LEU . 71.9 m-20 -134.43 58.23 1.78 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.776 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -66.91 -21.6 65.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.35 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -85.34 -38.79 18.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.838 0.352 . . . . 0.0 110.871 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.883 ' CB ' HD11 ' A' ' 61' ' ' LEU . 0.3 OUTLIER -80.13 -33.82 38.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.896 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -48.66 170.09 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.021 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.622 ' SG ' HG22 ' A' ' 78' ' ' THR . 9.3 t -64.47 -40.75 96.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.184 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 77.09 -66.44 0.24 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.947 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.43 171.7 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.314 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -96.78 -169.67 1.92 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.668 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.716 ' HB3' HG21 ' A' ' 81' ' ' THR . 64.9 mt -66.28 -44.75 82.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.585 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -70.06 -31.21 68.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.462 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -85.31 -24.35 27.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.613 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.731 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.7 OUTLIER -63.81 -77.04 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.758 0.313 . . . . 0.0 111.196 -179.781 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . 0.402 ' HA2' ' CG ' ' A' ' 82' ' ' ARG . . . 140.49 -18.17 2.85 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.55 -0.833 . . . . 0.0 113.104 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.711 HD21 ' CZ3' ' A' ' 37' ' ' TRP . 0.6 OUTLIER -65.82 -51.21 60.86 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.929 0.395 . . . . 0.0 110.828 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.716 HG21 ' HB3' ' A' ' 75' ' ' LEU . 54.8 p -56.02 -52.69 63.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.153 -179.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.402 ' CG ' ' HA2' ' A' ' 79' ' ' GLY . 1.4 ppt_? -62.29 -27.71 69.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.67 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 10.7 tttt -59.95 -168.56 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.796 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -90.91 77.79 6.12 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.536 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 55.04 69.12 1.36 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.327 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.649 ' HB1' HG23 ' A' ' 17' ' ' ILE . . . -89.6 22.54 2.97 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.98 179.51 4.91 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.761 0.315 . . . . 0.0 110.721 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.511 HG22 ' CA ' ' A' ' 15' ' ' PHE . 3.8 tt -159.58 159.07 2.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.074 0.464 . . . . 0.0 111.103 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.572 ' H ' HD12 ' A' ' 89' ' ' LEU . 4.2 mp -73.42 146.41 86.37 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.811 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.5 -30.8 14.62 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.533 2.155 . . . . 0.0 112.309 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.71 -38.48 73.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.935 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -69.23 -48.28 62.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.845 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.404 ' CZ ' ' CG ' ' A' ' 50' ' ' MET . 14.2 t80 -55.23 -52.97 61.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.549 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -22.68 64.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.478 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -50.37 73.97 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.172 0.511 . . . . 0.0 109.687 179.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.41 ' HB ' ' CE ' ' A' ' 50' ' ' MET . 18.2 mm -71.47 -32.96 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.323 179.24 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.469 ' CH2' ' HG ' ' A' ' 60' ' ' LEU . 16.9 t-105 -57.69 -36.74 72.35 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.752 178.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.623 ' HG3' HD11 ' A' ' 103' ' ' ILE . 1.0 OUTLIER -85.11 -25.69 27.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.227 179.136 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 25.0 ttt85 -61.56 -53.62 53.98 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.272 -179.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -81.2 -84.66 0.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.084 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -173.44 36.39 0.13 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.444 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.463 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -54.31 -61.3 7.35 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.538 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.904 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.1 mp -55.31 -46.31 78.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.695 0.283 . . . . 0.0 111.681 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -58.99 -49.26 78.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.941 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.426 ' HB3' HD23 ' A' ' 60' ' ' LEU . 54.4 t80 -60.76 -50.91 71.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.411 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.588 HD12 HD11 ' A' ' 110' ' ' ILE . 0.3 OUTLIER -57.65 -44.79 85.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.787 179.695 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.402 ' HG2' ' CD2' ' A' ' 124' ' ' LEU . 1.8 mm100 -61.43 -29.93 70.25 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.844 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 32.6 t -68.31 -50.67 51.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.968 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.444 ' HB1' ' HB2' ' A' ' 114' ' ' GLN . . . -75.13 -32.37 61.33 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.307 0.575 . . . . 0.0 109.784 179.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.655 HD11 ' HA ' ' A' ' 121' ' ' THR . 7.0 mt -57.71 -48.68 82.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.264 179.353 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -72.42 -36.06 68.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.72 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.5 -8.31 56.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.327 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 15.6 mmt85 72.0 46.6 0.34 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.005 0.431 . . . . 0.0 110.958 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . 0.444 ' HB2' ' HB1' ' A' ' 109' ' ' ALA . 9.2 mm-40 -122.37 -40.41 2.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.67 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.446 ' HA ' ' HB2' ' A' ' 65' ' ' LYS . . . -59.3 -19.88 49.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.413 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.4 ' HD3' ' CA ' ' A' ' 64' ' ' GLY . 26.8 mtp180 62.96 118.1 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.577 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -49.22 90.9 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.409 2.073 . . . . 0.0 112.625 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 10.8 t -119.35 -165.07 1.11 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.513 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -64.45 -47.62 78.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.733 0.302 . . . . 0.0 110.778 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -60.06 -52.08 66.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.273 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.655 ' HA ' HD11 ' A' ' 110' ' ' ILE . 80.3 p -57.83 -49.13 77.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.594 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.25 -54.02 51.47 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.525 0.679 . . . . 0.0 109.721 179.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' MET . . . . . 0.64 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -56.25 -35.41 67.37 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.778 178.663 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.904 HD11 ' HA ' ' A' ' 103' ' ' ILE . 0.3 OUTLIER -65.47 -44.95 85.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.825 178.763 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 60.8 mm-40 -49.97 -44.21 50.61 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.279 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -83.86 -23.71 31.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.782 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.64 HD13 ' CE ' ' A' ' 123' ' ' MET . 4.4 tp -65.73 -19.68 65.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.743 0.306 . . . . 0.0 110.502 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.582 ' O ' HD12 ' A' ' 128' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--N 1.332 -0.161 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.133 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.527 0.068 0 CA-C-O 120.889 0.376 . . . . 0.0 111.175 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.51 156.73 21.55 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.994 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 67.2 mm-40 -131.22 107.46 9.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.027 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.736 ' HD3' HD21 ' A' ' 75' ' ' LEU . 3.0 mtp180 -127.49 139.53 52.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.847 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.515 ' CE2' ' CG ' ' A' ' 40' ' ' HIS . 0.7 OUTLIER -122.47 135.03 54.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.3 -179.652 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.635 ' HB2' HD22 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -138.9 154.93 48.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.288 0.566 . . . . 0.0 111.926 -179.218 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.779 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.22 144.16 26.37 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.608 179.525 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.638 HG21 ' HG2' ' A' ' 83' ' ' LYS . 0.5 OUTLIER -148.97 132.17 8.22 Favored Pre-proline 0 C--N 1.329 -0.301 0 C-N-CA 120.851 -0.34 . . . . 0.0 111.784 -179.693 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.475 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 64.6 Cg_endo -91.65 111.54 0.31 Allowed 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 123.11 2.54 . . . . 0.0 112.25 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.0 p90 -131.11 140.74 50.05 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.795 0.331 . . . . 0.0 110.83 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.647 HD11 ' NZ ' ' A' ' 34' ' ' LYS . 9.3 mt -84.7 143.4 11.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.051 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.401 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 0.0 OUTLIER -64.77 124.73 87.2 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.5 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.636 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 72.1 Cg_exo -39.5 -55.13 1.68 Allowed 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.956 2.437 . . . . 0.0 112.938 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.681 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -44.83 -58.16 3.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.636 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.486 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -63.73 -34.65 78.35 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.969 -178.907 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.636 ' HG3' ' HA ' ' A' ' 22' ' ' PRO . 0.9 OUTLIER -54.99 -51.29 66.67 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -178.393 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.681 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 0.9 OUTLIER -88.23 -40.52 13.6 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -177.862 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.53 ' HG2' ' O ' ' A' ' 23' ' ' ALA . 12.3 ptmt -58.74 -33.01 69.77 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.716 -178.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -160.52 123.31 1.85 Allowed Pre-proline 0 C--N 1.328 -0.338 0 C-N-CA 120.766 -0.373 . . . . 0.0 111.606 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -73.13 -25.67 15.72 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.571 2.18 . . . . 0.0 112.206 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -93.06 -44.34 8.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.461 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -88.0 54.44 3.09 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.443 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.534 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -123.5 64.64 1.02 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.489 -179.384 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.84 143.01 5.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.618 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.647 ' NZ ' HD11 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -97.06 157.97 15.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.085 0.469 . . . . 0.0 111.592 -179.352 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -130.07 132.23 6.91 Favored Glycine 0 N--CA 1.451 -0.326 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.966 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.475 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 22.1 m-90 -97.75 131.09 44.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.879 0.371 . . . . 0.0 111.228 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.585 ' CZ3' HD11 ' A' ' 80' ' ' LEU . 39.2 t90 -115.35 117.65 31.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.085 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.809 ' CE1' HD12 ' A' ' 52' ' ' LEU . 1.6 m-85 -109.91 156.9 19.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.055 179.371 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.63 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.37 124.49 0.72 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.126 0.489 . . . . 0.0 111.906 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.515 ' CG ' ' CE2' ' A' ' 14' ' ' PHE . 11.0 t-160 -97.0 92.41 6.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.288 178.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.551 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 8.8 m-85 -74.47 155.76 37.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.077 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.56 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.7 OUTLIER -125.08 110.91 14.72 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.812 -0.811 . . . . 0.0 108.812 178.957 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 59.06 -133.84 52.52 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 119.706 -1.235 . . . . 0.0 110.678 -177.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -72.53 -19.6 24.58 Favored 'Trans proline' 0 CA--C 1.532 0.394 0 C-N-CA 122.359 2.039 . . . . 0.0 112.133 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' TRP . . . . . 0.439 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.7 OUTLIER -113.17 -160.12 0.71 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.567 -178.756 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.838 HD11 ' O ' ' A' ' 48' ' ' ARG . 7.6 tt -140.75 155.74 22.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-O 121.084 0.469 . . . . 0.0 111.849 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.418 ' O ' ' HE1' ' A' ' 70' ' ' MET . . . -128.65 -16.08 4.33 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.712 -0.676 . . . . 0.0 112.197 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.838 ' O ' HD11 ' A' ' 46' ' ' ILE . 4.2 mtt180 -137.06 137.86 39.79 Favored 'General case' 0 C--O 1.231 0.085 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.192 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.501 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 19.4 tt0 -151.56 125.7 9.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.255 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.569 ' SD ' HD11 ' A' ' 52' ' ' LEU . 0.8 OUTLIER -125.02 111.97 16.0 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.154 179.465 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.43 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 4.2 mt-10 -99.76 132.33 45.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.662 -179.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.809 HD12 ' CE1' ' A' ' 38' ' ' TYR . 3.6 mt -127.17 101.68 6.62 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.254 179.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -125.49 150.04 66.62 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 120.872 0.368 . . . . 0.0 111.332 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -61.69 -31.52 86.31 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.645 2.23 . . . . 0.0 112.198 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -94.7 -8.65 37.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.177 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.701 ' HB3' HD11 ' A' ' 59' ' ' ILE . 0.1 OUTLIER -136.25 114.45 10.65 Favored Pre-proline 0 C--N 1.331 -0.204 0 CA-C-N 116.687 -0.233 . . . . 0.0 110.785 179.974 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -50.96 -176.57 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.459 2.106 . . . . 0.0 112.311 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -59.15 85.2 0.06 OUTLIER 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 122.416 2.077 . . . . 0.0 112.398 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.701 HD11 ' HB3' ' A' ' 56' ' ' LYS . 87.7 mt -76.03 97.47 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.807 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.504 HD13 ' HA2' ' A' ' 102' ' ' GLY . 4.3 mt -83.74 100.53 10.96 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.487 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.797 HD21 ' HB3' ' A' ' 69' ' ' GLU . 0.3 OUTLIER -95.98 152.57 18.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.346 -179.461 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.556 HG21 HD21 ' A' ' 106' ' ' LEU . 11.5 p -152.56 161.64 2.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.656 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.483 ' N ' HG22 ' A' ' 62' ' ' VAL . . . -78.8 158.58 28.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.818 0.342 . . . . 0.0 111.502 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.416 ' HA3' ' HD2' ' A' ' 116' ' ' ARG . . . 70.17 -66.8 0.7 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.459 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.44 ' HB3' HG13 ' A' ' 62' ' ' VAL . 7.5 tptm -62.89 -41.3 99.36 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.836 0.351 . . . . 0.0 110.821 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.427 ' HB3' ' CD1' ' A' ' 61' ' ' LEU . 24.8 m-20 -132.56 56.99 1.81 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.788 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.27 -17.74 62.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.487 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 3.6 mtm -83.12 -30.45 27.91 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.713 0.292 . . . . 0.0 111.147 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.797 ' HB3' HD21 ' A' ' 61' ' ' LEU . 6.0 mm-40 -97.88 -23.75 15.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.242 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.418 ' HE1' ' O ' ' A' ' 47' ' ' ALA . 3.1 ttm -57.44 163.79 2.19 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.863 0.364 . . . . 0.0 111.108 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 8.8 t -46.99 -49.76 20.3 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.332 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 77.2 -57.49 0.51 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.987 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.7 mmtm -55.88 158.84 3.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.018 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -90.81 176.28 6.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.254 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.736 HD21 ' HD3' ' A' ' 13' ' ' ARG . 0.9 OUTLIER -54.75 -51.17 66.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.873 0.368 . . . . 0.0 111.56 -179.617 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -31.52 69.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.283 -179.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -81.42 -10.15 59.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.752 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.407 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 1.4 p -91.51 -73.96 0.52 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.77 0.319 . . . . 0.0 111.143 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 139.09 -20.91 3.0 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.785 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.707 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 3.8 mt -49.29 -30.04 6.8 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.991 0.424 . . . . 0.0 110.813 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.405 HG23 ' HG ' ' A' ' 75' ' ' LEU . 63.0 p -80.56 -31.92 36.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.362 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -94.48 7.87 44.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.046 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.638 ' HG2' HG21 ' A' ' 17' ' ' ILE . 2.2 mptt -92.69 32.05 1.29 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.726 0.298 . . . . 0.0 111.216 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 58.46 63.07 1.79 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.964 0.411 . . . . 0.0 111.053 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 62.76 60.38 7.82 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.627 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.707 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -77.32 -3.65 41.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.65 0.262 . . . . 0.0 111.576 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -51.51 168.13 0.08 Allowed 'General case' 0 CA--C 1.528 0.129 0 CA-C-O 120.839 0.352 . . . . 0.0 111.358 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.779 HG21 ' HB3' ' A' ' 16' ' ' ARG . 1.0 OUTLIER -151.23 179.94 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.151 179.872 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.523 HD12 ' HB3' ' A' ' 91' ' ' ARG . 0.2 OUTLIER -97.82 145.82 30.39 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.717 179.871 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.78 -10.48 28.64 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.591 2.194 . . . . 0.0 112.532 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.523 ' HB3' HD12 ' A' ' 89' ' ' LEU . 0.4 OUTLIER -72.05 -51.93 19.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.56 -179.93 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.404 ' N ' ' HG3' ' A' ' 91' ' ' ARG . 0.5 OUTLIER -67.45 -42.91 82.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.039 -179.907 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -56.98 -53.28 59.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.879 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.88 -19.34 61.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.732 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -62.37 -50.52 71.24 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 179.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.466 ' HB ' ' HE1' ' A' ' 50' ' ' MET . 19.3 mm -75.95 -33.79 25.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.59 179.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.483 ' CZ3' ' CD2' ' A' ' 60' ' ' LEU . 12.9 t-105 -52.45 -40.98 62.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.007 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -86.24 -31.56 21.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.584 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.439 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.1 OUTLIER -57.71 -52.91 63.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.385 -179.637 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 95.0 m -79.77 -82.47 0.11 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.225 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.405 ' C ' HD13 ' A' ' 60' ' ' LEU . . . -178.3 37.89 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.622 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.504 ' HA2' HD13 ' A' ' 60' ' ' LEU . . . -72.02 -41.25 55.1 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.542 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.709 ' HA ' HD11 ' A' ' 124' ' ' LEU . 29.4 mm -64.68 -46.65 91.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.799 0.333 . . . . 0.0 110.897 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -60.17 -49.12 78.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.492 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -57.61 -49.11 77.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.286 179.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.874 HD12 HD11 ' A' ' 110' ' ' ILE . 0.2 OUTLIER -59.03 -45.02 91.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.361 179.355 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.425 ' HG2' ' CD2' ' A' ' 124' ' ' LEU . 0.9 OUTLIER -61.14 -29.75 69.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.997 179.615 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.36 -50.5 45.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.972 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.408 ' HB1' ' HB2' ' A' ' 114' ' ' GLN . . . -74.0 -31.72 63.08 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.333 0.587 . . . . 0.0 109.716 179.033 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.874 HD11 HD12 ' A' ' 106' ' ' LEU . 11.7 mt -59.0 -49.23 83.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.517 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -72.39 -37.18 68.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.783 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 5.8 m -76.0 -8.33 56.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.358 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 72.11 28.59 2.46 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.806 0.336 . . . . 0.0 110.867 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . 0.413 ' CB ' ' HD3' ' A' ' 65' ' ' LYS . 74.2 mt-30 -98.55 -29.73 12.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.652 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.71 -163.92 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.886 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.416 ' HD2' ' HA3' ' A' ' 64' ' ' GLY . 1.5 tpt180 -133.76 91.74 24.56 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.195 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -50.04 90.25 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.578 2.185 . . . . 0.0 111.849 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 2.4 p -136.12 -50.46 0.7 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.553 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -162.23 -61.6 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.339 . . . . 0.0 111.576 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.482 ' O ' ' HB2' ' A' ' 124' ' ' LEU . . . -53.59 -38.59 64.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.558 -179.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.501 HG22 ' CD1' ' A' ' 106' ' ' LEU . 17.7 p -69.3 -35.64 76.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.786 0.327 . . . . 0.0 110.679 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -70.22 -55.44 9.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.279 0.562 . . . . 0.0 110.532 179.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' MET . . . . . 0.503 ' HE1' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -56.44 -29.22 61.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.374 179.207 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.709 HD11 ' HA ' ' A' ' 103' ' ' ILE . 0.3 OUTLIER -69.47 -44.61 70.82 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.095 0.474 . . . . 0.0 109.937 178.96 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.675 ' HA ' HD12 ' A' ' 128' ' ' LEU . 42.5 mm-40 -54.03 -44.84 71.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.584 179.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.07 -30.11 31.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.707 179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.515 ' C ' HD23 ' A' ' 127' ' ' LEU . 1.2 tt -66.61 -16.05 63.9 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.282 179.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.675 HD12 ' HA ' ' A' ' 125' ' ' GLN . 10.0 mt . . . . . 0 C--N 1.332 -0.167 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.953 179.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? . . . . . 0 C--O 1.231 0.085 0 CA-C-O 120.912 0.387 . . . . 0.0 111.36 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -69.01 177.6 2.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.921 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.441 ' HG3' ' CZ ' ' A' ' 119' ' ' TYR . 12.5 mm100 -127.74 111.91 14.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.948 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.468 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -116.43 135.51 53.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.749 179.882 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.523 ' CD1' ' N ' ' A' ' 14' ' ' PHE . 0.0 OUTLIER -126.85 149.74 49.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.55 -179.524 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.789 ' HB2' HD22 ' A' ' 80' ' ' LEU . 0.2 OUTLIER -154.67 162.46 41.12 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.226 0.536 . . . . 0.0 111.653 179.981 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.48 ' CG ' HG21 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.29 154.08 38.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.627 178.843 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -151.93 127.64 5.0 Favored Pre-proline 0 C--N 1.328 -0.361 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.891 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.453 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 75.3 Cg_endo -87.43 94.73 0.46 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.953 2.435 . . . . 0.0 111.981 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.0 p90 -111.76 155.08 24.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.87 0.366 . . . . 0.0 110.907 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.589 HG12 ' CG ' ' A' ' 34' ' ' LYS . 1.4 mt -100.0 153.11 4.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.344 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 -82.47 134.9 47.32 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.526 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.592 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 72.9 Cg_exo -39.96 -60.25 0.59 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.956 2.438 . . . . 0.0 113.051 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.682 ' HB1' ' HD2' ' A' ' 27' ' ' LYS . . . -46.11 -54.01 9.33 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.826 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.414 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -61.02 -37.53 82.89 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.213 -178.93 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.592 ' HG3' ' HA ' ' A' ' 22' ' ' PRO . 0.9 OUTLIER -55.7 -57.35 12.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.913 0.387 . . . . 0.0 111.805 -178.965 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.627 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.6 p90 -86.47 -9.0 57.14 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.87 -179.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.682 ' HD2' ' HB1' ' A' ' 23' ' ' ALA . 2.9 mtpp -70.25 -44.49 68.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.948 0.404 . . . . 0.0 110.366 179.357 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -174.18 138.85 0.7 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.867 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -67.96 -23.44 40.71 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.549 2.166 . . . . 0.0 112.449 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.5 mm100 -95.76 -40.5 9.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.005 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -93.73 48.32 1.28 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.962 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.412 ' HD3' ' O ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -110.0 61.88 0.6 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.671 179.785 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.01 135.62 0.88 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.663 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.589 ' CG ' HG12 ' A' ' 20' ' ' ILE . 8.4 mtmt -104.82 141.15 37.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.519 -179.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -112.95 135.75 12.91 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.524 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.453 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 15.6 m-90 -100.47 111.67 23.95 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.929 0.395 . . . . 0.0 110.845 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.607 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 39.0 t90 -95.04 117.66 30.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.808 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.8 ' CE1' HD12 ' A' ' 52' ' ' LEU . 14.5 m-85 -105.58 152.43 23.09 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.372 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.665 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -163.43 123.46 2.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.267 0.556 . . . . 0.0 111.445 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.52 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 3.5 t-160 -99.39 86.89 3.48 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.401 -0.818 . . . . 0.0 108.796 178.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.693 ' CG ' ' HB ' ' A' ' 46' ' ' ILE . 7.6 m-85 -71.81 156.41 39.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.747 -178.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.536 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 4.3 t70 -130.38 118.25 20.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.317 -0.856 . . . . 0.0 108.81 178.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 58.63 -136.46 51.1 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 119.732 -1.223 . . . . 0.0 110.828 -178.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.415 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.4 Cg_exo -73.71 -15.46 24.16 Favored 'Trans proline' 0 CA--C 1.53 0.292 0 C-N-CA 122.495 2.13 . . . . 0.0 112.332 179.425 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' TRP . . . . . 0.415 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 0.8 OUTLIER -119.83 -157.68 0.71 Allowed 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.714 -178.467 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.863 HD11 ' O ' ' A' ' 48' ' ' ARG . 5.8 tt -137.81 156.54 31.96 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.104 0 CA-C-O 121.149 0.5 . . . . 0.0 112.094 -179.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.651 ' CB ' HG21 ' A' ' 118' ' ' THR . . . -129.94 -15.15 3.88 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.521 -0.763 . . . . 0.0 112.166 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.863 ' O ' HD11 ' A' ' 46' ' ' ILE . 11.2 mtt180 -136.28 138.64 41.98 Favored 'General case' 0 C--O 1.23 0.053 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.753 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.452 ' OE1' HD12 ' A' ' 61' ' ' LEU . 0.6 OUTLIER -146.43 130.81 17.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.226 -179.735 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.452 ' HE1' ' HB ' ' A' ' 96' ' ' ILE . 0.2 OUTLIER -127.46 112.81 15.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.608 179.821 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.491 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -89.93 118.94 29.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.053 -179.753 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.8 HD12 ' CE1' ' A' ' 38' ' ' TYR . 43.3 mt -120.38 102.73 8.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.806 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -130.82 136.22 28.57 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.914 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -52.25 -25.95 25.41 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.354 2.036 . . . . 0.0 112.28 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -94.87 -28.26 15.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.14 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.3 mttp -119.79 119.5 31.19 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.086 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.453 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 72.6 Cg_exo -48.79 171.0 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.565 2.177 . . . . 0.0 112.121 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.453 ' HD2' ' HB3' ' A' ' 57' ' ' PRO . 19.1 Cg_endo -59.02 83.42 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.462 2.108 . . . . 0.0 112.367 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.594 HG22 ' HG ' ' A' ' 61' ' ' LEU . 63.8 mt -61.39 104.87 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.776 179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.446 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.2 OUTLIER -79.92 100.8 8.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.848 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.594 ' HG ' HG22 ' A' ' 59' ' ' ILE . 84.0 mt -109.51 145.09 36.86 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.735 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.527 HG21 ' HG ' ' A' ' 106' ' ' LEU . 8.5 t -141.66 147.2 22.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.085 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.584 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -59.53 151.74 23.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.01 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.04 -58.87 4.99 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.406 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.531 ' HG3' ' HB1' ' A' ' 109' ' ' ALA . 0.0 OUTLIER -80.12 -31.64 39.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.92 0.39 . . . . 0.0 110.802 179.783 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -123.62 54.13 1.31 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.74 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.38 -30.21 71.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.891 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.24 -40.48 16.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.826 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.407 ' HB3' ' CD2' ' A' ' 61' ' ' LEU . 6.1 mm-40 -73.13 -54.94 7.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.902 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.424 ' HE2' ' N ' ' A' ' 49' ' ' GLN . 46.0 ttm -52.24 163.23 0.41 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.842 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 3.0 t -51.39 136.67 24.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.844 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -119.93 47.25 1.77 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.0 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.52 134.21 10.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.015 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -55.28 164.95 0.82 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.885 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.728 HD11 ' CE1' ' A' ' 15' ' ' PHE . 1.2 tp -50.78 -45.5 59.18 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.721 -179.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.21 -31.79 69.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.602 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.26 -21.58 28.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.699 -179.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.623 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -62.47 -74.51 0.09 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.85 0.357 . . . . 0.0 111.177 -179.805 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 138.67 -25.19 2.85 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.326 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.789 HD22 ' HB2' ' A' ' 15' ' ' PHE . 0.8 OUTLIER -53.5 -36.21 61.47 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.972 0.415 . . . . 0.0 110.661 179.844 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.5 p -74.21 -30.64 62.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.66 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.3 mmm180 -72.68 -31.95 65.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.609 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.4 mptt -60.9 -168.22 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.812 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.52 73.81 2.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.994 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 72.03 66.38 2.12 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.535 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.0 -10.04 59.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.569 0.223 . . . . 0.0 111.349 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.403 ' HA ' ' O ' ' A' ' 14' ' ' PHE . 8.3 tt0 -52.55 154.7 2.47 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.896 0.379 . . . . 0.0 111.415 -179.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.48 HG21 ' CG ' ' A' ' 16' ' ' ARG . 1.2 pt -144.78 168.28 9.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.198 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.57 HD23 ' CD ' ' A' ' 90' ' ' PRO . 2.3 mt -78.81 144.75 64.94 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.554 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . 0.57 ' CD ' HD23 ' A' ' 89' ' ' LEU . 11.5 Cg_exo -69.02 -35.4 14.91 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.369 2.046 . . . . 0.0 111.387 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 6.9 mtm180 -55.35 -54.4 44.14 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.344 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -57.62 -45.18 85.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.279 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.423 ' HD2' HD11 ' A' ' 88' ' ' ILE . 14.0 t80 -55.29 -53.09 60.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.824 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.64 -21.15 60.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.825 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -50.77 71.56 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.261 0.553 . . . . 0.0 109.649 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.452 ' HB ' ' HE1' ' A' ' 50' ' ' MET . 16.7 mm -72.9 -34.93 47.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.246 179.032 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.45 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 11.9 t-105 -54.08 -39.08 66.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.142 179.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.519 ' HG3' HD13 ' A' ' 103' ' ' ILE . 1.5 tt0 -85.67 -25.96 26.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.604 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.445 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -56.36 -54.3 47.18 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.393 -179.759 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 8.3 t -83.68 -67.52 0.78 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.061 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 160.62 40.91 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.563 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.45 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -60.76 -52.93 49.38 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.349 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.787 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.7 mp -53.86 -42.12 51.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.72 0.295 . . . . 0.0 111.136 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.64 -43.9 97.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.013 0.435 . . . . 0.0 110.2 179.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -63.88 -40.97 97.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.132 179.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.608 HD13 HD13 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -68.21 -38.52 82.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.659 179.69 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.595 ' CD ' HD22 ' A' ' 128' ' ' LEU . 0.2 OUTLIER -65.58 -30.07 70.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.516 179.607 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.3 m -70.62 -50.05 41.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.342 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.531 ' HB1' ' HG3' ' A' ' 65' ' ' LYS . . . -71.76 -33.5 68.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.33 0.586 . . . . 0.0 109.747 179.051 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.643 ' CD1' HD22 ' A' ' 124' ' ' LEU . 5.1 mt -56.93 -49.18 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.48 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -72.27 -38.08 68.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.598 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 59.0 m -66.39 -15.86 63.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.124 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.0 mmm180 76.81 30.43 0.59 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.892 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 42.2 mm-40 -102.76 -28.69 11.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.586 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.86 158.09 22.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.046 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.442 ' O ' HG22 ' A' ' 118' ' ' THR . 2.1 mtt85 -110.15 95.32 21.03 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.782 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . 0.408 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 87.9 Cg_exo -47.91 129.64 18.26 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.72 2.28 . . . . 0.0 112.588 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.651 HG21 ' CB ' ' A' ' 47' ' ' ALA . 1.1 t -161.1 -54.38 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.004 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.441 ' CZ ' ' HG3' ' A' ' 12' ' ' GLN . 68.5 t80 -159.59 -62.17 0.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.081 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.509 ' HB1' ' NE ' ' A' ' 48' ' ' ARG . . . -53.99 -44.18 70.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.276 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.449 HG22 ' CG1' ' A' ' 110' ' ' ILE . 0.5 OUTLIER -62.15 -34.89 77.24 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.912 0.387 . . . . 0.0 110.465 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -71.37 -58.7 3.28 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.675 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' MET . . . . . 0.58 ' HE1' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -58.22 -29.41 65.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.325 179.397 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.833 HD23 HD23 ' A' ' 128' ' ' LEU . 7.4 tt -68.23 -48.87 63.97 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.146 0.498 . . . . 0.0 109.971 179.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.493 ' HA ' HD21 ' A' ' 128' ' ' LEU . 0.6 OUTLIER -53.15 -36.39 60.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.159 179.33 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 18.5 m-20 -86.65 -29.28 22.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.536 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.58 HD13 ' HE1' ' A' ' 123' ' ' MET . 1.3 tt -72.83 -10.0 59.3 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.879 179.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.833 HD23 HD23 ' A' ' 124' ' ' LEU . 4.0 pp . . . . . 0 C--N 1.333 -0.122 0 CA-C-O 120.763 0.316 . . . . 0.0 111.165 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.4 mtt85 . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 120.791 0.329 . . . . 0.0 110.916 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.27 158.99 16.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.931 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.424 ' HG3' ' CE2' ' A' ' 119' ' ' TYR . 89.3 mm-40 -130.14 102.9 6.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.806 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.547 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -122.26 127.95 50.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.097 -179.579 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.498 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 0.4 OUTLIER -115.46 151.34 34.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.296 179.772 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.702 ' HB2' HD22 ' A' ' 80' ' ' LEU . 0.8 OUTLIER -151.51 159.09 44.3 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-O 121.289 0.566 . . . . 0.0 112.041 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.724 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.29 145.67 27.17 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.961 179.332 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.565 ' CD1' HD23 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -153.07 124.69 3.71 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.684 0.278 . . . . 0.0 111.745 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.471 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 68.3 Cg_endo -89.27 103.61 0.38 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.063 2.509 . . . . 0.0 111.914 179.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.2 p90 -116.87 138.25 51.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.957 0.408 . . . . 0.0 111.076 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.489 HG12 ' HG3' ' A' ' 34' ' ' LYS . 37.4 mt -78.87 134.42 27.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.117 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.5 ttp180 -58.19 139.88 83.54 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.643 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.462 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 14.3 Cg_endo -56.59 -45.38 37.46 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.395 2.063 . . . . 0.0 112.434 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.533 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -55.92 -58.35 8.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.173 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.57 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 0.6 OUTLIER -68.35 -29.85 68.67 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.765 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.39 -57.08 10.94 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.319 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.533 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.8 p90 -91.74 -13.56 31.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.747 -179.485 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.57 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 0.1 OUTLIER -62.31 -46.31 89.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.844 0.354 . . . . 0.0 110.554 179.785 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -166.39 142.94 4.08 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.244 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -69.75 -26.1 27.98 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.636 2.224 . . . . 0.0 112.258 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -94.95 -36.17 11.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.627 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -98.3 49.88 1.0 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.687 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.466 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -109.66 63.36 0.6 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.826 179.999 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.431 ' HB3' ' HG2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -41.98 142.81 0.64 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.368 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.489 ' HG3' HG12 ' A' ' 20' ' ' ILE . 0.4 OUTLIER -113.42 152.18 30.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.32 -179.618 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.427 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -127.94 138.28 10.32 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.289 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.471 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 28.3 m-90 -97.73 128.32 44.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.887 0.375 . . . . 0.0 110.708 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.554 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 23.2 t90 -113.91 117.36 31.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.309 -179.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.587 ' CE1' HD12 ' A' ' 52' ' ' LEU . 1.3 m-85 -111.72 155.34 23.62 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.031 179.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.758 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.53 126.74 0.77 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.043 0.449 . . . . 0.0 111.884 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.498 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 17.0 t-160 -98.1 99.12 10.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.608 178.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.811 ' CZ ' HG21 ' A' ' 78' ' ' THR . 34.1 m-85 -85.25 114.52 22.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.629 -179.117 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.445 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 51.9 t0 -88.39 113.89 24.45 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 59.67 -136.04 50.6 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 119.966 -1.111 . . . . 0.0 111.062 -178.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.406 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.4 Cg_exo -73.53 -15.25 24.74 Favored 'Trans proline' 0 N--CA 1.463 -0.28 0 C-N-CA 122.527 2.151 . . . . 0.0 112.266 179.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' TRP . . . . . 0.408 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -118.05 -173.99 2.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.965 0.412 . . . . 0.0 111.765 -178.527 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.788 HD11 ' O ' ' A' ' 48' ' ' ARG . 1.5 tt -129.62 147.1 33.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.59 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.503 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -122.5 -21.03 5.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.98 -179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.788 ' O ' HD11 ' A' ' 46' ' ' ILE . 5.3 ttm180 -127.17 139.23 53.1 Favored 'General case' 0 C--N 1.334 -0.089 0 C-N-CA 120.868 -0.333 . . . . 0.0 111.253 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.536 HE21 HD13 ' A' ' 61' ' ' LEU . 1.1 tt0 -154.51 139.24 17.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.786 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.431 ' HE2' ' HB ' ' A' ' 96' ' ' ILE . 1.2 ttm -140.44 116.75 10.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.9 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.444 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -95.95 136.83 35.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.002 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.587 HD12 ' CE1' ' A' ' 38' ' ' TYR . 81.0 mt -134.46 119.13 18.14 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.075 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.427 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 1.7 m-70 -143.24 135.0 12.95 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.915 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.431 ' HG2' ' HB3' ' A' ' 33' ' ' LYS . 9.8 Cg_endo -52.65 -26.86 31.11 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.565 2.177 . . . . 0.0 112.181 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -98.9 -24.46 14.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.968 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.442 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 0.5 OUTLIER -118.01 120.61 32.34 Favored Pre-proline 0 C--O 1.234 0.275 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.84 179.899 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.442 ' HD2' ' HA ' ' A' ' 56' ' ' LYS . 10.8 Cg_endo -54.15 168.89 0.78 Allowed 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.456 2.104 . . . . 0.0 112.204 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.428 ' HA ' ' O ' ' A' ' 51' ' ' GLU . 50.8 Cg_exo -55.52 86.77 0.04 OUTLIER 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.577 2.185 . . . . 0.0 112.38 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.444 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 88.6 mt -67.44 95.56 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.099 0.476 . . . . 0.0 110.62 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.46 HD21 ' N ' ' A' ' 102' ' ' GLY . 0.1 OUTLIER -71.65 127.63 33.18 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.913 -179.774 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.898 HD11 ' HB3' ' A' ' 69' ' ' GLU . 0.3 OUTLIER -132.67 147.18 52.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.085 -179.764 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.489 ' HA ' ' HE1' ' A' ' 70' ' ' MET . 10.5 p -156.24 142.1 10.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.837 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.503 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -56.27 164.03 1.46 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.285 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.408 ' HA3' ' HB2' ' A' ' 116' ' ' ARG . . . 76.24 -70.02 2.17 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.324 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -57.21 6.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.862 0.363 . . . . 0.0 110.654 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.424 ' HB3' ' CD2' ' A' ' 61' ' ' LEU . 11.1 m-20 -110.08 45.61 1.09 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.58 179.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.59 -21.71 65.82 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.399 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 5.5 ptp -81.26 -31.81 33.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.89 0.376 . . . . 0.0 110.625 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.898 ' HB3' HD11 ' A' ' 61' ' ' LEU . 27.2 mp0 -85.29 -36.8 20.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.897 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.489 ' HE1' ' HA ' ' A' ' 62' ' ' VAL . 0.8 OUTLIER -46.0 170.07 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.518 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.742 ' SG ' HD13 ' A' ' 46' ' ' ILE . 3.8 m -51.51 -26.6 8.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.109 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 68.16 -78.11 0.04 OUTLIER 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.971 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.51 -178.63 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.22 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -95.4 -164.72 1.19 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.691 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.537 HD21 ' HB3' ' A' ' 41' ' ' PHE . 3.8 mm? -69.48 -49.36 55.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.508 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -62.46 -31.59 72.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.688 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -83.31 -27.94 29.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.505 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.811 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.6 OUTLIER -67.2 -78.42 0.06 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.835 0.35 . . . . 0.0 111.085 -179.763 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 144.44 -21.97 2.04 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.76 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.702 HD22 ' HB2' ' A' ' 15' ' ' PHE . 2.5 mt -51.88 -33.13 35.32 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.91 0.386 . . . . 0.0 111.075 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 68.1 p -83.55 -31.45 26.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.789 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 46.7 mtm-85 -66.45 -29.78 69.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.886 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.412 ' CD ' HG21 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -70.02 -166.5 0.12 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.854 179.977 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -100.61 92.21 5.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.008 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 53.81 74.13 0.34 Allowed Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.803 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -85.41 4.44 35.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.592 0.234 . . . . 0.0 111.56 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.407 ' HA ' ' O ' ' A' ' 14' ' ' PHE . 8.4 tm-20 -59.98 158.09 11.55 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.813 0.339 . . . . 0.0 111.4 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.724 HG21 ' HB3' ' A' ' 16' ' ' ARG . 0.9 OUTLIER -147.38 -179.95 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.177 179.985 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.03 146.59 33.21 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.626 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -68.18 -16.85 44.96 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.6 2.2 . . . . 0.0 112.69 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.07 -54.58 39.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.147 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -70.36 -41.32 73.28 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.916 0.389 . . . . 0.0 110.992 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.43 ' CE2' ' HD2' ' A' ' 48' ' ' ARG . 9.4 t80 -57.8 -53.01 63.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.941 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.65 -21.22 60.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.849 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -60.68 -50.34 73.88 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.283 0.563 . . . . 0.0 109.616 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.538 HG21 HD11 ' A' ' 52' ' ' LEU . 19.9 mm -75.44 -34.9 31.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.636 179.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.458 ' CE2' ' HA3' ' A' ' 102' ' ' GLY . 41.4 t-105 -52.92 -40.46 63.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.915 179.307 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -85.94 -28.22 24.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.717 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.429 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.4 OUTLIER -56.75 -44.08 81.38 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.251 -179.75 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 50.2 t -90.09 -76.91 0.41 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.01 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.408 ' C ' HD21 ' A' ' 60' ' ' LEU . . . 173.95 37.45 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.573 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.46 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -68.76 -44.27 70.82 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.499 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.853 HD13 HD21 ' A' ' 127' ' ' LEU . 4.3 mt -60.88 -39.9 83.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.935 0.397 . . . . 0.0 110.922 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -63.39 -45.81 89.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.12 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 21.9 t80 -62.05 -36.22 80.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.174 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 1.043 HD13 HD13 ' A' ' 124' ' ' LEU . 0.3 OUTLIER -71.47 -40.23 70.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.58 179.605 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -64.73 -29.9 70.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.597 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 5.1 m -71.95 -50.06 32.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.475 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.539 ' HB3' ' HB2' ' A' ' 115' ' ' ALA . . . -69.94 -34.07 72.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.5 0.667 . . . . 0.0 109.622 178.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.607 HD11 HD22 ' A' ' 106' ' ' LEU . 5.9 mt -56.95 -49.18 80.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.512 179.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -72.13 -34.17 68.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.642 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.406 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 12.3 t -75.79 -8.97 58.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.303 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . 0.406 ' HB2' ' O ' ' A' ' 112' ' ' SER . 5.3 mmm180 68.41 27.66 6.32 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.855 0.359 . . . . 0.0 110.909 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -109.62 -24.11 11.11 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.761 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.539 ' HB2' ' HB3' ' A' ' 109' ' ' ALA . . . -56.96 -21.96 34.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.32 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.408 ' HB2' ' HA3' ' A' ' 64' ' ' GLY . 75.2 ttt180 67.68 92.95 0.06 OUTLIER Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.316 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -46.66 90.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.877 2.385 . . . . 0.0 112.305 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -114.06 -63.41 1.45 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.183 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.424 ' CE2' ' HG3' ' A' ' 12' ' ' GLN . 9.5 t80 -161.8 -55.75 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.037 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.672 ' HB2' ' HE ' ' A' ' 48' ' ' ARG . . . -53.73 -30.12 42.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.18 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.435 ' HA ' HD11 ' A' ' 110' ' ' ILE . 22.2 p -69.79 -37.9 76.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.747 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -68.48 -54.06 19.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.011 0.434 . . . . 0.0 110.704 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' MET . . . . . 0.64 ' HE1' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -57.92 -29.63 65.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.564 179.519 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 1.043 HD13 HD13 ' A' ' 106' ' ' LEU . 0.2 OUTLIER -67.08 -50.13 62.71 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.084 0.469 . . . . 0.0 110.312 179.012 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.566 ' HA ' HD12 ' A' ' 128' ' ' LEU . 44.8 mm-40 -53.42 -41.62 66.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.618 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -80.95 -31.13 35.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.39 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.853 HD21 HD13 ' A' ' 103' ' ' ILE . 0.9 OUTLIER -70.36 -12.04 61.31 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.534 179.073 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.566 HD12 ' HA ' ' A' ' 125' ' ' GLN . 8.7 mt . . . . . 0 C--N 1.332 -0.154 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.382 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.802 0.334 . . . . 0.0 111.05 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -95.18 170.46 9.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.098 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.48 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 4.3 mp0 -131.25 102.81 6.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.936 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.534 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 3.2 mtt-85 -122.08 126.6 48.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.002 0.43 . . . . 0.0 111.015 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.511 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 2.7 m-85 -108.77 134.84 50.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.811 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.808 ' CE2' HG22 ' A' ' 81' ' ' THR . 2.9 m-85 -131.43 153.49 49.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.38 0.61 . . . . 0.0 112.542 -178.307 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.503 ' CB ' HG21 ' A' ' 88' ' ' ILE . 0.8 OUTLIER -145.99 142.78 28.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.622 179.21 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.983 HD11 HD22 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -151.35 114.68 3.08 Favored Pre-proline 0 C--N 1.328 -0.362 0 C-N-CA 120.759 -0.377 . . . . 0.0 111.628 -179.456 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.451 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 74.7 Cg_endo -87.49 98.12 0.45 Allowed 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.894 2.396 . . . . 0.0 111.956 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 42.9 p90 -116.72 137.9 51.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.925 0.393 . . . . 0.0 111.059 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.63 HD11 ' NZ ' ' A' ' 34' ' ' LYS . 24.2 mt -78.92 145.72 9.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.325 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.16 142.32 94.86 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.429 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.446 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 19.1 Cg_endo -58.68 -50.78 8.45 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.508 2.139 . . . . 0.0 112.22 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.509 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -55.25 -58.23 8.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.066 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.524 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 1.1 m-20 -65.37 -30.25 71.06 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.0 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.51 -56.05 20.3 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.393 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.509 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.7 p90 -94.52 -5.0 47.03 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.976 -179.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.524 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 5.3 mtpp -73.02 -46.58 51.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.885 0.374 . . . . 0.0 110.818 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -162.59 141.48 6.87 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.287 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -73.18 -9.28 23.16 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.686 2.258 . . . . 0.0 112.543 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 78.5 mm-40 -110.83 -33.8 6.43 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.958 0.409 . . . . 0.0 110.814 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -97.44 37.07 1.39 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.761 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.495 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -71.36 -35.02 70.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.412 -179.753 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 46.96 93.35 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.196 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.63 ' NZ ' HD11 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -77.9 149.9 34.17 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.479 -179.763 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.436 ' HA3' ' CD2' ' A' ' 53' ' ' HIS . . . -121.79 132.94 9.18 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.247 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.451 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 21.5 m-90 -98.26 124.23 42.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.894 0.378 . . . . 0.0 110.957 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.422 ' CD1' ' HG2' ' A' ' 51' ' ' GLU . 63.4 t90 -107.64 117.13 33.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.973 -179.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.864 ' CE1' HD12 ' A' ' 52' ' ' LEU . 22.5 m-85 -111.54 151.43 28.7 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.432 179.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.487 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -169.99 124.07 0.75 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.078 0.466 . . . . 0.0 111.343 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.511 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 16.8 t-160 -99.83 96.17 7.4 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.73 179.307 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.606 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 5.1 m-85 -79.09 143.39 35.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.225 -179.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.553 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.3 OUTLIER -113.37 111.71 22.44 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.822 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.87 -133.21 49.5 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 119.907 -1.139 . . . . 0.0 111.224 -178.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_exo -73.36 -16.78 24.53 Favored 'Trans proline' 0 CA--C 1.531 0.325 0 C-N-CA 122.509 2.139 . . . . 0.0 112.517 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' TRP . . . . . 0.425 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.5 OUTLIER -119.06 -163.48 0.97 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.751 -178.501 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.606 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 4.9 tt -134.85 155.53 38.49 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.693 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.604 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -131.59 -20.88 2.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.427 -179.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.558 ' O ' HD11 ' A' ' 46' ' ' ILE . 14.5 mtt180 -128.9 134.8 48.39 Favored 'General case' 0 C--O 1.23 0.064 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.764 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.425 ' HB3' ' HB2' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -143.98 122.61 12.54 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.971 0.415 . . . . 0.0 111.466 -179.564 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.432 ' HE1' ' HB ' ' A' ' 96' ' ' ILE . 24.2 ttp -122.77 115.6 22.3 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.038 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.44 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 1.4 mt-10 -105.2 129.61 53.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.005 0.431 . . . . 0.0 111.69 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.864 HD12 ' CE1' ' A' ' 38' ' ' TYR . 5.2 mt -128.75 106.43 8.93 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.312 179.456 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.44 ' HB2' ' HG2' ' A' ' 56' ' ' LYS . 0.2 OUTLIER -131.7 138.7 33.17 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.543 -0.298 . . . . 0.0 111.13 -179.635 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.43 -23.91 26.09 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.381 2.054 . . . . 0.0 112.202 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -88.46 -32.85 18.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.129 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.514 ' HB2' HD11 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -127.12 125.74 24.17 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.09 -179.983 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.421 ' CB ' ' CD ' ' A' ' 58' ' ' PRO . 76.9 Cg_exo -50.81 -175.66 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.692 2.261 . . . . 0.0 112.485 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.421 ' CD ' ' CB ' ' A' ' 57' ' ' PRO . 33.3 Cg_exo -58.7 81.3 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.584 2.189 . . . . 0.0 112.498 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.514 HD11 ' HB2' ' A' ' 56' ' ' LYS . 94.6 mt -65.56 95.29 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.092 0.472 . . . . 0.0 110.441 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.452 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.4 OUTLIER -78.0 117.55 19.43 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.108 -179.608 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.425 ' HB2' ' HB3' ' A' ' 49' ' ' GLN . 53.9 mt -121.52 151.37 40.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.732 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.771 HG21 HD21 ' A' ' 106' ' ' LEU . 11.8 p -151.63 145.74 16.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.091 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.604 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -61.38 139.89 58.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.916 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.403 ' HA3' ' HG3' ' A' ' 116' ' ' ARG . . . 98.83 -47.43 1.4 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.394 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.543 ' HG3' ' HB1' ' A' ' 109' ' ' ALA . 0.0 OUTLIER -92.67 -42.46 9.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.901 0.381 . . . . 0.0 110.685 179.829 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -121.32 47.9 1.76 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.699 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.53 -29.84 70.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.045 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -85.38 -30.33 23.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.201 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -79.41 -50.11 11.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.196 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.4 ' HE1' ' N ' ' A' ' 63' ' ' ALA . 2.1 ptp -52.93 -177.47 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.157 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.48 -50.92 61.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.764 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 75.17 -57.8 0.59 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.311 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -46.26 154.77 0.25 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.326 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -74.83 174.11 9.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.922 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.486 HD12 ' CZ ' ' A' ' 15' ' ' PHE . 4.0 mm? -58.19 -45.99 86.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.473 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -69.71 -40.84 76.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.925 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -65.82 -22.63 66.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.547 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.422 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -77.45 -69.94 0.5 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.722 0.296 . . . . 0.0 110.921 -179.898 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 126.11 -19.83 6.39 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.684 -0.769 . . . . 0.0 112.671 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.983 HD22 HD11 ' A' ' 17' ' ' ILE . 0.1 OUTLIER -51.14 -53.11 37.58 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.851 0.358 . . . . 0.0 110.713 -179.916 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.808 HG22 ' CE2' ' A' ' 15' ' ' PHE . 11.6 p -58.06 -49.88 75.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.665 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -58.17 -27.15 63.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.456 179.483 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -163.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.578 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -99.71 82.22 2.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.792 0.33 . . . . 0.0 110.81 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.67 70.27 1.03 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.565 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -95.93 32.62 1.85 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.602 0.239 . . . . 0.0 111.164 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.487 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 0.7 OUTLIER -113.07 141.38 46.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.35 -179.891 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.503 HG21 ' CB ' ' A' ' 16' ' ' ARG . 0.1 OUTLIER -124.67 157.28 32.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.78 179.545 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.595 HD12 ' H ' ' A' ' 92' ' ' GLN . 0.3 OUTLIER -61.52 145.63 90.93 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.506 179.747 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -60.6 -23.38 75.54 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.599 2.199 . . . . 0.0 112.51 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -53.3 57.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.22 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.595 ' H ' HD12 ' A' ' 89' ' ' LEU . 6.1 mm-40 -57.71 -56.34 23.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.28 -179.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -50.18 -53.35 28.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.806 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.36 -20.45 62.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.525 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.403 ' HB2' ' HA ' ' A' ' 92' ' ' GLN . 0.4 OUTLIER -60.59 -50.01 75.23 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 109.541 -0.541 . . . . 0.0 109.541 179.089 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.432 ' HB ' ' HE1' ' A' ' 50' ' ' MET . 15.0 mm -72.38 -35.41 51.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.579 179.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.439 ' CH2' ' HG ' ' A' ' 60' ' ' LEU . 12.7 t-105 -52.58 -41.93 64.05 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.125 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -85.99 -26.46 25.43 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.655 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.17 -53.24 60.45 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.449 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 70.9 m -86.85 -87.16 0.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.341 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -167.23 48.64 0.25 Allowed Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.543 -0.837 . . . . 0.0 112.683 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.452 ' HA2' ' CD2' ' A' ' 60' ' ' LEU . . . -69.37 -39.56 80.87 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.565 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.79 HD12 HD22 ' A' ' 127' ' ' LEU . 16.7 mm -70.08 -44.95 77.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.799 0.333 . . . . 0.0 111.288 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.03 -49.21 78.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.813 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 94.0 t80 -59.5 -50.45 73.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.053 0.454 . . . . 0.0 110.407 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.771 HD21 HG21 ' A' ' 62' ' ' VAL . 0.2 OUTLIER -57.29 -46.53 83.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.393 179.508 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.408 ' HG2' HD23 ' A' ' 124' ' ' LEU . 2.8 mm-40 -59.67 -29.82 68.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.663 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 15.1 m -67.11 -50.32 61.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.777 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.543 ' HB1' ' HG3' ' A' ' 65' ' ' LYS . . . -70.32 -33.78 71.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.564 0.697 . . . . 0.0 109.436 178.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.553 ' CG1' HG22 ' A' ' 121' ' ' THR . 9.5 mt -56.31 -48.73 79.25 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.258 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -72.0 -32.56 67.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.245 179.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.46 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 0.3 OUTLIER -74.71 -9.28 58.41 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.062 179.491 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . 0.46 ' HB2' ' O ' ' A' ' 112' ' ' SER . 15.7 mmm180 69.66 31.37 3.63 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.966 0.413 . . . . 0.0 110.998 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . 0.406 ' HB3' ' CG ' ' A' ' 65' ' ' LYS . 11.2 mt-30 -108.9 -29.97 8.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.555 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.51 ' HB1' ' CG2' ' A' ' 121' ' ' THR . . . -71.38 102.15 2.56 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.866 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.907 ' O ' HG22 ' A' ' 118' ' ' THR . 39.2 mtt85 -58.04 109.78 2.06 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.191 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . 0.6 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 75.6 Cg_exo -50.5 89.82 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.676 2.25 . . . . 0.0 112.187 179.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.907 HG22 ' O ' ' A' ' 116' ' ' ARG . 1.5 t -141.58 81.77 1.79 Allowed 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.834 0.349 . . . . 0.0 111.822 -179.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.48 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 7.8 t80 65.13 -64.34 0.17 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 179.003 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.401 ' N ' ' O ' ' A' ' 118' ' ' THR . . . -53.54 -52.22 60.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.921 0.391 . . . . 0.0 111.397 -179.184 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.6 ' OG1' ' HA ' ' A' ' 117' ' ' PRO . 0.6 OUTLIER -65.26 -46.58 79.95 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.677 179.669 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.85 -56.27 21.24 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.387 0.613 . . . . 0.0 110.256 179.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' MET . . . . . 0.828 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -53.69 -33.66 56.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.335 179.17 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.492 HD13 ' CG ' ' A' ' 106' ' ' LEU . 0.1 OUTLIER -63.72 -49.04 74.64 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.15 0.5 . . . . 0.0 109.818 178.997 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 40.7 mm-40 -50.79 -40.2 54.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.909 178.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -79.3 -32.0 43.38 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.068 178.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.828 HD13 ' CE ' ' A' ' 123' ' ' MET . 0.3 OUTLIER -59.31 -21.43 59.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.118 178.922 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.472 ' O ' HD12 ' A' ' 128' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--N 1.332 -0.173 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.952 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.431 ' HD2' ' HA2' ' A' ' 43' ' ' GLY . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.207 0 CA-C-O 120.683 0.278 . . . . 0.0 111.023 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -44.76 147.4 0.63 Allowed 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.951 0.405 . . . . 0.0 111.705 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.436 ' HB3' ' HE2' ' A' ' 40' ' ' HIS . 74.2 mm-40 -118.91 112.64 19.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.952 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.594 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 1.1 mtp180 -115.4 132.36 56.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.006 0.432 . . . . 0.0 110.767 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.498 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 1.3 m-85 -115.59 135.21 54.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.399 -179.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.601 ' HB3' HD12 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -136.76 154.17 50.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.289 0.566 . . . . 0.0 112.007 -178.759 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.477 ' HD2' ' CE2' ' A' ' 38' ' ' TYR . 0.6 OUTLIER -149.21 147.16 28.08 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.767 179.872 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.746 HD13 HD13 ' A' ' 80' ' ' LEU . 0.4 OUTLIER -153.28 127.63 4.58 Favored Pre-proline 0 C--O 1.233 0.213 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.781 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.411 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 66.2 Cg_endo -91.87 114.83 0.37 Allowed 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 123.222 2.614 . . . . 0.0 111.573 179.17 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.7 p90 -131.31 142.95 50.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.955 0.407 . . . . 0.0 111.573 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.716 HD13 ' HE3' ' A' ' 32' ' ' LYS . 23.4 mt -88.03 134.2 28.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.801 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -56.21 122.84 51.29 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.571 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.467 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 84.5 Cg_exo -44.5 -46.82 11.73 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.568 2.178 . . . . 0.0 112.787 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.529 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -54.74 -58.24 8.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.109 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.541 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 7.0 m-20 -67.96 -29.39 68.43 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.853 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.67 -55.04 25.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.273 -179.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.529 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.1 p90 -94.03 -14.31 25.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.91 -179.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.541 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 3.3 mtpt -62.98 -50.95 68.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.797 0.332 . . . . 0.0 110.768 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 179.07 144.53 0.34 Allowed Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.347 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.44 ' HA ' ' HG2' ' A' ' 32' ' ' LYS . 71.9 Cg_endo -73.55 -2.29 11.94 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.756 2.304 . . . . 0.0 112.824 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.38 -46.55 8.65 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.026 0.441 . . . . 0.0 110.575 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -95.33 33.55 1.56 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.195 179.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.716 ' HE3' HD13 ' A' ' 20' ' ' ILE . 2.8 mmtt -45.83 -76.59 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.518 -179.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 61.83 93.87 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.727 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.641 ' NZ ' HD11 ' A' ' 20' ' ' ILE . 1.2 ttmt -91.06 138.28 31.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.375 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -107.66 134.63 12.31 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.269 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.42 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 11.4 m-90 -98.61 134.58 41.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.879 0.371 . . . . 0.0 110.82 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.411 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 26.2 t90 -113.39 117.27 31.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.06 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.787 ' CE1' HD12 ' A' ' 52' ' ' LEU . 53.2 m-85 -116.28 142.74 46.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.053 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.718 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -164.97 124.22 1.8 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.279 0.561 . . . . 0.0 111.883 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.507 ' HB3' ' HG3' ' A' ' 48' ' ' ARG . 5.5 t-160 -90.81 95.75 10.29 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.341 -0.845 . . . . 0.0 108.733 178.403 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.629 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 7.7 m-85 -76.98 158.57 30.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.544 -178.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.609 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 3.5 t70 -126.32 115.09 19.14 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.431 ' HA2' ' HD2' ' A' ' 10' ' ' ARG . . . 57.65 -135.61 51.55 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 119.804 -1.189 . . . . 0.0 111.124 -178.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_exo -71.7 -18.26 28.86 Favored 'Trans proline' 0 CA--C 1.53 0.289 0 C-N-CA 122.53 2.154 . . . . 0.0 112.278 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' TRP . . . . . 0.402 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.7 OUTLIER -116.15 -159.34 0.72 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.391 -178.83 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.837 HD11 ' O ' ' A' ' 48' ' ' ARG . 4.7 tt -131.62 157.73 43.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 CA-C-O 121.304 0.573 . . . . 0.0 112.255 -179.287 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.446 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -112.45 -37.3 5.0 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.013 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.837 ' O ' HD11 ' A' ' 46' ' ' ILE . 0.1 OUTLIER -146.38 160.32 42.2 Favored 'General case' 0 CA--C 1.523 -0.084 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.964 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.508 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 9.1 tt0 -149.9 150.55 32.06 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.158 0.504 . . . . 0.0 111.646 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.418 ' HE1' ' N ' ' A' ' 97' ' ' TRP . 3.3 ttm -138.85 122.51 17.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.134 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.402 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 4.3 mt-10 -111.44 139.75 46.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.043 0.449 . . . . 0.0 111.583 -179.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.787 HD12 ' CE1' ' A' ' 38' ' ' TYR . 0.7 OUTLIER -135.08 101.77 4.98 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.364 179.652 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -116.68 138.05 24.21 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.096 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -52.06 -26.6 26.19 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.662 2.241 . . . . 0.0 112.331 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -98.89 -25.04 14.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.968 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.613 ' CB ' HD11 ' A' ' 59' ' ' ILE . 0.1 OUTLIER -117.06 118.98 35.53 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.774 -179.807 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.403 ' O ' ' N ' ' A' ' 59' ' ' ILE . 73.1 Cg_exo -48.72 177.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.405 2.07 . . . . 0.0 112.261 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -56.75 82.4 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.536 2.157 . . . . 0.0 112.345 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.613 HD11 ' CB ' ' A' ' 56' ' ' LYS . 5.8 mt -65.01 107.05 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.861 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.654 HD23 ' HB2' ' A' ' 105' ' ' TYR . 0.3 OUTLIER -83.28 136.96 34.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.893 -179.93 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.813 HD21 ' HB3' ' A' ' 69' ' ' GLU . 0.2 OUTLIER -132.68 145.79 51.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.024 -179.804 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.928 HG21 HD21 ' A' ' 106' ' ' LEU . 12.0 p -150.37 131.91 5.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.982 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.67 164.7 1.02 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.414 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.79 -70.71 1.15 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.407 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.473 ' HG3' ' HB1' ' A' ' 109' ' ' ALA . 0.0 OUTLIER -64.62 -55.67 18.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.948 0.404 . . . . 0.0 110.788 179.868 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.446 ' CB ' HD13 ' A' ' 61' ' ' LEU . 66.6 m-20 -99.13 59.33 1.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.864 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -69.04 -23.97 64.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.203 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 7.1 mmt -85.25 -37.87 19.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.994 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.813 ' HB3' HD21 ' A' ' 61' ' ' LEU . 6.0 mt-10 -81.69 -36.59 28.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.202 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.418 ' N ' HD11 ' A' ' 61' ' ' LEU . 63.4 tpp -52.11 158.62 1.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.18 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 5.4 t -49.1 -58.7 4.51 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.105 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 66.03 19.36 11.19 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.216 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.61 ' HB2' HG23 ' A' ' 78' ' ' THR . 15.6 mmtt -123.69 131.67 53.66 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.782 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -58.64 166.4 1.85 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.41 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.438 ' HA ' HD23 ' A' ' 75' ' ' LEU . 12.2 mt -58.8 -53.11 62.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.682 0.277 . . . . 0.0 111.432 -179.458 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -62.87 -31.93 73.07 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.275 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -77.82 -36.67 49.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.322 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.61 HG23 ' HB2' ' A' ' 73' ' ' LYS . 0.7 OUTLIER -62.8 -73.27 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.118 -179.808 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 140.23 -6.6 2.81 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.532 -0.842 . . . . 0.0 113.101 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.746 HD13 HD13 ' A' ' 17' ' ' ILE . 2.6 mm? -63.12 -38.15 90.02 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.249 0.547 . . . . 0.0 110.161 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 69.0 p -87.56 -28.52 21.91 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.978 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.04 -36.11 82.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.612 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.624 ' HD3' ' HB2' ' A' ' 86' ' ' ALA . 0.3 OUTLIER -80.24 -164.61 0.71 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.753 179.824 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -109.86 112.88 25.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.911 0.386 . . . . 0.0 111.302 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.82 82.6 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.954 -0.641 . . . . 0.0 113.227 179.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -118.63 15.19 13.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.718 0.294 . . . . 0.0 111.163 179.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.423 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 14.6 mt-10 -87.02 166.4 15.07 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.895 0.378 . . . . 0.0 111.286 -179.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.472 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 0.8 OUTLIER -146.98 168.11 5.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.008 179.688 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.867 HD12 ' HB2' ' A' ' 91' ' ' ARG . 0.8 OUTLIER -90.01 140.82 27.61 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.742 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.13 -16.47 54.62 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.632 2.221 . . . . 0.0 112.649 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.867 ' HB2' HD12 ' A' ' 89' ' ' LEU . 0.6 OUTLIER -71.76 -54.06 11.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.205 -179.817 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.435 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 0.0 OUTLIER -66.95 -39.83 87.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.972 -179.803 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -58.5 -53.21 60.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.477 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.75 -19.32 62.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.411 179.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.435 ' HB2' ' HA ' ' A' ' 92' ' ' GLN . 0.1 OUTLIER -61.82 -50.18 73.35 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.117 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.404 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 14.0 mm -72.23 -37.76 60.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.405 179.11 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.441 ' O ' ' N ' ' A' ' 102' ' ' GLY . 41.2 t-105 -52.88 -42.15 65.01 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.152 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -85.72 -21.9 28.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.699 179.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.404 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 4.9 tpt180 -58.24 -54.07 51.1 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.356 -179.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 41.6 t -86.12 -83.01 0.19 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.29 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.577 ' C ' HD21 ' A' ' 60' ' ' LEU . . . -165.84 31.45 0.22 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.601 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.532 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -52.64 -48.06 56.73 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.65 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.731 ' HA ' HD11 ' A' ' 124' ' ' LEU . 24.2 mm -66.29 -43.13 91.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.742 0.306 . . . . 0.0 111.056 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.86 -39.43 74.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.97 0.415 . . . . 0.0 110.552 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.654 ' HB2' HD23 ' A' ' 60' ' ' LEU . 17.7 t80 -64.2 -53.48 48.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.637 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.928 HD21 HG21 ' A' ' 62' ' ' VAL . 1.5 mt -61.59 -37.66 84.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.632 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.519 ' HG2' HD21 ' A' ' 124' ' ' LEU . 0.3 OUTLIER -64.36 -31.05 72.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.702 179.757 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 14.7 m -70.14 -50.33 41.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.642 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.473 ' HB1' ' HG3' ' A' ' 65' ' ' LYS . . . -72.06 -31.91 66.57 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.246 0.546 . . . . 0.0 109.729 179.063 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.595 ' CD1' HD22 ' A' ' 124' ' ' LEU . 4.6 mt -56.89 -47.14 83.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.247 179.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -69.59 -39.31 77.35 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.436 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.57 -14.1 62.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.111 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . 0.401 ' HB3' ' NH1' ' A' ' 113' ' ' ARG . 3.6 mmm180 72.45 29.47 2.11 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.817 0.341 . . . . 0.0 111.004 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -111.81 -21.32 11.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.05 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.403 ' HA ' ' HB2' ' A' ' 65' ' ' LYS . . . -56.68 -26.36 56.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.443 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 56.7 mtt180 60.74 96.56 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.631 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -47.11 92.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.592 2.195 . . . . 0.0 112.566 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 23.8 m -106.24 -59.54 1.77 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.59 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -165.59 -56.26 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.151 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.406 ' CB ' HD11 ' A' ' 106' ' ' LEU . . . -53.8 -40.85 66.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.191 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.623 HG22 HD22 ' A' ' 106' ' ' LEU . 6.6 p -60.79 -40.68 93.5 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.164 179.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -63.99 -54.26 37.17 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.42 0.628 . . . . 0.0 109.424 178.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' MET . . . . . 0.561 ' CE ' HD13 ' A' ' 127' ' ' LEU . 2.5 tmm? -56.35 -33.63 65.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.662 178.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.781 HD13 ' HB3' ' A' ' 106' ' ' LEU . 1.2 tt -67.55 -44.81 77.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.04 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.693 ' HA ' HD12 ' A' ' 128' ' ' LEU . 46.3 mm-40 -52.88 -38.73 61.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.014 179.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 49.9 m-20 -80.99 -34.28 33.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.345 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.561 HD13 ' CE ' ' A' ' 123' ' ' MET . 1.7 tp -68.98 -11.25 60.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.823 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.693 HD12 ' HA ' ' A' ' 125' ' ' GLN . 14.5 mt . . . . . 0 C--O 1.231 0.121 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.224 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.6 ttm-85 . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.936 0.398 . . . . 0.0 111.01 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 63.67 133.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.108 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.422 ' HG3' ' CZ ' ' A' ' 119' ' ' TYR . 90.6 mm-40 -125.0 102.82 7.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.69 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.477 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 18.3 mtp180 -117.53 129.35 55.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.159 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.504 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 1.3 m-85 -113.46 134.64 54.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.982 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.828 ' HB2' HD22 ' A' ' 80' ' ' LEU . 2.2 m-85 -134.67 153.49 51.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.215 0.531 . . . . 0.0 112.019 -178.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.466 ' HB3' ' CG2' ' A' ' 88' ' ' ILE . 0.6 OUTLIER -149.17 146.11 27.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.803 179.486 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.507 HG12 HD23 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -143.06 122.31 7.56 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 120.656 0.265 . . . . 0.0 111.359 -179.589 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.463 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 74.3 Cg_endo -88.44 89.49 0.47 Allowed 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.938 2.425 . . . . 0.0 112.354 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 29.1 p90 -109.15 144.78 36.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.819 0.342 . . . . 0.0 110.878 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.814 HG23 ' O ' ' A' ' 33' ' ' LYS . 4.8 mt -90.77 144.96 8.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.045 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.409 ' O ' ' CG ' ' A' ' 25' ' ' GLN . 7.5 mtt180 -70.12 134.4 87.41 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.503 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.583 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 85.3 Cg_exo -41.26 -60.81 0.58 Allowed 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.949 2.432 . . . . 0.0 113.19 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.698 ' HB1' ' HD2' ' A' ' 27' ' ' LYS . . . -46.22 -53.89 9.77 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.899 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.546 ' HB3' ' HA ' ' A' ' 32' ' ' LYS . 1.4 m-20 -60.34 -36.79 78.79 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.651 -0.704 . . . . 0.0 112.072 -178.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.583 ' HG3' ' HA ' ' A' ' 22' ' ' PRO . 1.3 mt-30 -56.92 -57.59 11.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.723 -179.147 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.645 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.8 p90 -86.36 -3.03 58.92 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.71 -179.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.698 ' HD2' ' HB1' ' A' ' 23' ' ' ALA . 0.4 OUTLIER -76.85 -43.69 35.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.865 0.364 . . . . 0.0 110.424 179.353 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.434 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 3.4 t70 -168.39 148.69 4.29 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.121 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 2.8 Cg_exo -73.44 -30.38 10.14 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.758 2.305 . . . . 0.0 111.781 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -94.6 -41.97 9.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.802 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -87.35 53.59 2.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.642 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.546 ' HA ' ' HB3' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -122.34 62.09 0.97 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.859 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.814 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -43.02 148.7 0.24 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.313 -179.921 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.92 117.65 34.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.332 -179.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -85.39 124.34 6.75 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.793 -0.718 . . . . 0.0 111.948 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.463 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 24.2 m-90 -97.88 131.31 44.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.038 0.447 . . . . 0.0 111.258 -179.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.697 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 33.2 t90 -116.2 117.15 29.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.636 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.737 ' CE1' HD12 ' A' ' 52' ' ' LEU . 11.7 m-85 -110.11 152.08 26.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.622 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.511 ' HB3' ' HE1' ' A' ' 41' ' ' PHE . . . -170.3 124.26 0.72 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.013 0.435 . . . . 0.0 111.319 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.504 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 14.1 t-160 -97.11 101.0 12.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.75 179.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.631 ' CE2' HG21 ' A' ' 78' ' ' THR . 7.7 m-85 -87.96 123.38 32.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.495 -179.263 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.459 ' OD2' ' HB3' ' A' ' 47' ' ' ALA . 38.3 m-20 -95.87 121.45 37.62 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 56.09 -137.77 46.36 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 119.944 -1.122 . . . . 0.0 111.042 -178.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.404 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 7.2 Cg_exo -73.33 -16.06 24.93 Favored 'Trans proline' 0 CA--C 1.531 0.355 0 C-N-CA 122.38 2.053 . . . . 0.0 112.28 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' TRP . . . . . 0.405 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -117.26 -170.25 1.81 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.943 0.401 . . . . 0.0 111.89 -178.434 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.638 HD11 ' O ' ' A' ' 48' ' ' ARG . 3.9 tt -128.28 154.65 39.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.878 -179.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.459 ' HB3' ' OD2' ' A' ' 42' ' ' ASP . . . -131.97 -19.37 2.58 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.132 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.638 ' O ' HD11 ' A' ' 46' ' ' ILE . 5.9 mtm180 -130.27 142.65 50.54 Favored 'General case' 0 C--N 1.337 0.054 0 CA-C-O 120.85 0.357 . . . . 0.0 111.039 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.416 ' HG3' ' HG3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -147.38 132.88 18.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.207 -179.76 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.403 ' HB3' ' HB2' ' A' ' 38' ' ' TYR . 14.1 ttp -133.4 120.71 21.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.331 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.552 ' HB3' HD12 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -105.24 135.0 47.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.267 -179.648 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.737 HD12 ' CE1' ' A' ' 38' ' ' TYR . 54.7 mt -135.15 101.88 5.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.71 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.413 ' HB2' ' HB2' ' A' ' 56' ' ' LYS . 0.4 OUTLIER -120.75 155.4 57.19 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.015 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.16 -30.03 81.53 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.757 2.305 . . . . 0.0 112.457 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -109.82 9.67 24.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.478 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.54 ' HB3' HD11 ' A' ' 59' ' ' ILE . 0.9 OUTLIER -142.3 113.12 6.16 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.792 179.895 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -50.92 -179.9 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.432 2.088 . . . . 0.0 112.336 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.25 82.69 0.07 OUTLIER 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.665 2.244 . . . . 0.0 112.488 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.552 HD12 ' HB3' ' A' ' 51' ' ' GLU . 7.1 mt -64.8 98.48 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.991 0.424 . . . . 0.0 110.709 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.567 HD21 ' N ' ' A' ' 102' ' ' GLY . 0.2 OUTLIER -76.1 112.69 12.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.773 -179.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.792 HD21 ' HB3' ' A' ' 69' ' ' GLU . 0.9 OUTLIER -115.74 152.6 32.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.847 -179.719 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.677 HG21 HD21 ' A' ' 106' ' ' LEU . 12.1 p -158.79 146.47 7.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.048 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.22 162.03 2.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.026 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.401 ' CA ' ' HD3' ' A' ' 116' ' ' ARG . . . 75.09 -65.75 2.26 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.065 -179.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.3 -36.4 66.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.034 0.445 . . . . 0.0 110.342 179.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -119.49 54.83 0.98 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.505 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.44 -34.22 77.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.203 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 36.5 mmm -85.71 -38.94 17.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.881 0.372 . . . . 0.0 110.777 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.792 ' HB3' HD21 ' A' ' 61' ' ' LEU . 0.3 OUTLIER -72.58 -44.9 61.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.976 -179.804 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.416 ' HG3' ' HG3' ' A' ' 49' ' ' GLN . 21.3 ttm -52.32 163.51 0.4 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.927 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.484 ' SG ' HG22 ' A' ' 78' ' ' THR . 1.8 t -46.7 -55.07 8.36 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.208 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.425 ' CB ' ' O ' ' A' ' 71' ' ' CYS . 2.7 tt0 84.04 -21.89 0.24 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.786 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.47 -179.69 5.87 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.922 0.391 . . . . 0.0 111.163 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -99.26 -171.58 2.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.463 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.558 HD11 ' HB2' ' A' ' 41' ' ' PHE . 3.6 mm? -67.3 -49.99 61.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.568 -179.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.27 -41.72 73.08 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.854 0.359 . . . . 0.0 111.338 -179.394 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -61.81 -38.4 88.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.684 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.631 HG21 ' CE2' ' A' ' 41' ' ' PHE . 1.0 OUTLIER -59.82 -72.42 0.11 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.146 -179.643 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 132.88 -19.4 4.42 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.551 -179.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.828 HD22 ' HB2' ' A' ' 15' ' ' PHE . 1.5 mp -52.79 -42.83 65.4 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.032 0.444 . . . . 0.0 110.765 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 28.3 p -71.2 -39.63 71.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.649 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -60.87 -30.41 70.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.557 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.6 mtpp -60.11 -177.11 0.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.691 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.54 68.88 2.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.767 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.56 64.55 1.68 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.638 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -92.6 26.25 2.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.709 0.29 . . . . 0.0 111.233 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.99 155.65 16.65 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.85 0.357 . . . . 0.0 110.928 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.466 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 1.0 OUTLIER -133.56 178.69 5.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.072 179.818 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.593 ' H ' HD23 ' A' ' 89' ' ' LEU . 0.9 OUTLIER -93.75 158.45 36.51 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.828 179.821 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo -73.0 -35.81 4.98 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.736 2.291 . . . . 0.0 112.107 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.592 ' HB2' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -53.96 -54.26 41.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.223 -179.781 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.441 ' HG3' HD21 ' A' ' 89' ' ' LEU . 0.5 OUTLIER -64.3 -45.87 86.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.18 -179.78 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -55.33 -53.25 58.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.014 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -72.6 -20.22 61.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.679 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.408 ' HB2' ' HA ' ' A' ' 92' ' ' GLN . 1.3 tm-20 -59.93 -49.63 76.93 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.468 HG21 HD11 ' A' ' 52' ' ' LEU . 16.7 mm -73.76 -35.06 42.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.366 179.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.449 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 5.8 t-105 -54.65 -39.7 68.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.991 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.63 -25.59 26.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.531 179.272 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.8 -53.7 54.8 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.085 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 52.3 t -83.96 -76.65 0.29 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.026 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 175.01 39.0 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.598 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.567 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -58.9 -62.22 6.48 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.429 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.619 ' H ' HD12 ' A' ' 103' ' ' ILE . 3.7 mp -52.93 -38.37 28.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.784 0.326 . . . . 0.0 111.258 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.96 -40.13 87.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.982 0.42 . . . . 0.0 110.515 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -69.72 -41.55 75.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.496 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.719 HD12 HD11 ' A' ' 110' ' ' ILE . 0.3 OUTLIER -68.22 -50.31 54.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.876 179.888 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -29.68 70.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.037 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 4.0 m -68.52 -50.51 51.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.793 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.518 ' HB1' ' HB2' ' A' ' 114' ' ' GLN . . . -71.29 -35.1 71.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.645 0.736 . . . . 0.0 109.389 178.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.719 HD11 HD12 ' A' ' 106' ' ' LEU . 15.9 mt -56.24 -45.23 81.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.534 179.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -70.34 -41.16 73.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.031 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.501 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 21.6 p -76.55 -4.63 43.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.424 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . 0.501 ' HB2' ' O ' ' A' ' 112' ' ' SER . 24.2 mmm180 75.38 24.12 1.43 Allowed 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.79 0.329 . . . . 0.0 111.332 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . 0.518 ' HB2' ' HB1' ' A' ' 109' ' ' ALA . 0.0 OUTLIER -90.38 -24.19 20.87 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.386 179.082 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -102.11 107.7 18.87 Favored 'General case' 0 N--CA 1.456 -0.136 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.873 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.648 ' HG3' HG23 ' A' ' 118' ' ' THR . 0.2 OUTLIER -56.17 135.15 74.92 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.937 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_exo -52.42 84.95 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.596 2.197 . . . . 0.0 112.517 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.648 HG23 ' HG3' ' A' ' 116' ' ' ARG . 3.6 p -107.62 -176.59 3.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.413 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.422 ' CZ ' ' HG3' ' A' ' 12' ' ' GLN . 40.2 t80 -59.17 -36.35 75.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.87 0.367 . . . . 0.0 110.77 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.482 ' HB2' ' HE ' ' A' ' 48' ' ' ARG . . . -69.15 -52.08 31.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.116 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.595 ' HA ' HD11 ' A' ' 110' ' ' ILE . 60.5 p -58.63 -49.28 78.09 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.835 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.97 -48.54 79.69 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.244 0.545 . . . . 0.0 109.826 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' MET . . . . . 0.621 ' HE1' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -62.14 -33.37 74.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.883 178.785 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.509 HD21 ' O ' ' A' ' 103' ' ' ILE . 0.1 OUTLIER -63.97 -50.26 69.28 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.168 179.2 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.529 ' NE2' HG21 ' A' ' 110' ' ' ILE . 86.6 mm-40 -52.92 -42.57 65.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.359 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -79.06 -29.84 43.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.638 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.621 HD13 ' HE1' ' A' ' 123' ' ' MET . 1.3 tt -76.73 -7.02 54.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.647 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.408 HD12 ' HA ' ' A' ' 125' ' ' GLN . 20.3 mt . . . . . 0 C--N 1.332 -0.163 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.896 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 18.6 mtt180 . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.781 0.324 . . . . 0.0 111.029 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.2 134.14 42.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.943 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 89.7 mm-40 -119.1 102.68 8.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.941 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.498 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -122.34 143.23 49.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.787 179.868 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.543 ' CD1' ' N ' ' A' ' 14' ' ' PHE . 0.7 OUTLIER -124.34 134.74 53.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.709 -179.621 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.498 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 0.2 OUTLIER -143.56 155.53 44.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.236 0.541 . . . . 0.0 111.881 -179.695 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.854 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.6 153.4 37.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.897 178.71 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.634 HG21 ' CD ' ' A' ' 83' ' ' LYS . 0.1 OUTLIER -148.79 133.09 8.82 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.757 0.313 . . . . 0.0 111.535 -179.776 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.428 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 70.7 Cg_endo -91.97 120.25 0.54 Allowed 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.183 2.589 . . . . 0.0 111.777 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.7 p90 -144.59 155.99 43.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.99 0.424 . . . . 0.0 111.154 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.513 HG23 ' O ' ' A' ' 33' ' ' LYS . 2.2 mt -108.9 150.53 11.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.812 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -69.23 123.22 87.82 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.25 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.635 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 67.2 Cg_exo -40.0 -50.79 3.3 Favored 'Trans proline' 0 C--O 1.239 0.554 0 C-N-CA 122.952 2.435 . . . . 0.0 112.996 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.683 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -47.6 -59.09 3.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.879 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.492 ' HA ' ' HG2' ' A' ' 27' ' ' LYS . 0.8 OUTLIER -62.63 -33.59 75.33 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.505 -0.77 . . . . 0.0 112.833 -178.831 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.635 ' HG3' ' HA ' ' A' ' 22' ' ' PRO . 0.5 OUTLIER -55.89 -53.89 51.28 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -178.314 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.683 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.9 p90 -88.88 -40.72 12.91 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -178.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.545 ' HG2' ' O ' ' A' ' 23' ' ' ALA . 11.0 ptmt -58.34 -36.26 73.17 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 -178.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -156.91 116.67 2.06 Favored Pre-proline 0 C--N 1.33 -0.28 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.893 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.27 -7.01 19.85 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.617 2.212 . . . . 0.0 112.366 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -95.8 -36.14 11.26 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.947 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -88.99 46.02 1.35 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.441 178.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.431 ' HD3' ' HA ' ' A' ' 25' ' ' GLN . 3.9 mmtp -78.86 59.65 2.64 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.948 -179.272 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.513 ' O ' HG23 ' A' ' 20' ' ' ILE . 12.2 mmtm -53.8 100.7 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.025 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.92 121.35 31.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.949 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -113.66 144.48 18.18 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.727 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.451 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 11.2 m-90 -106.21 132.73 51.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.843 0.354 . . . . 0.0 110.745 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.513 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 22.4 t90 -115.05 117.56 30.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.222 -179.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.833 ' CE1' HD12 ' A' ' 52' ' ' LEU . 0.4 OUTLIER -117.24 152.28 35.16 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.32 179.146 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.61 ' HB3' ' HE1' ' A' ' 41' ' ' PHE . . . -170.58 130.29 0.86 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.203 0.525 . . . . 0.0 111.807 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.575 ' HB3' ' HG3' ' A' ' 48' ' ' ARG . 8.4 t-160 -96.68 103.68 15.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.496 -0.775 . . . . 0.0 108.997 178.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.759 ' CE2' HG21 ' A' ' 78' ' ' THR . 7.1 m-85 -90.3 127.42 36.16 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.589 -179.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.428 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 1.1 m-20 -93.88 113.36 25.36 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 178.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 57.48 -136.51 50.6 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.025 -1.084 . . . . 0.0 110.959 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -71.17 -19.2 29.89 Favored 'Trans proline' 0 N--CA 1.465 -0.192 0 C-N-CA 122.385 2.056 . . . . 0.0 112.08 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' TRP . . . . . 0.404 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -111.4 -174.0 2.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.505 -178.864 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.675 HG21 ' SG ' ' A' ' 71' ' ' CYS . 1.4 tt -121.44 149.33 24.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.172 0.51 . . . . 0.0 112.198 -179.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.415 ' N ' HG13 ' A' ' 46' ' ' ILE . . . -105.42 -40.33 5.84 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.832 -179.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.575 ' HG3' ' HB3' ' A' ' 40' ' ' HIS . 1.6 ptp180 -149.58 153.24 36.8 Favored 'General case' 0 CA--C 1.523 -0.084 0 C-N-CA 120.542 -0.463 . . . . 0.0 111.512 -179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.71 ' OE1' HD12 ' A' ' 61' ' ' LEU . 6.7 tt0 -148.23 156.11 42.17 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.896 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.782 ' HE1' HD11 ' A' ' 52' ' ' LEU . 22.8 ptm -142.61 122.64 13.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.297 179.523 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.477 ' O ' ' HA ' ' A' ' 58' ' ' PRO . 0.0 OUTLIER -98.78 126.51 44.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.324 -179.405 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.833 HD12 ' CE1' ' A' ' 38' ' ' TYR . 20.4 mt -128.21 112.05 14.09 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.752 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -140.02 134.63 15.87 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.2 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -50.99 -26.19 17.95 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.399 2.066 . . . . 0.0 112.234 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -96.68 -28.76 14.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.949 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.44 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 5.5 mttp -116.26 121.68 33.23 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.79 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.44 ' HD2' ' HA ' ' A' ' 56' ' ' LYS . 9.5 Cg_endo -50.94 169.63 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.341 2.028 . . . . 0.0 112.111 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.477 ' HA ' ' O ' ' A' ' 51' ' ' GLU . 19.2 Cg_endo -60.84 78.54 0.07 OUTLIER 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.536 2.157 . . . . 0.0 112.477 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 11.8 mt -65.46 89.96 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 121.075 0.464 . . . . 0.0 110.7 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.504 HD13 ' HA2' ' A' ' 102' ' ' GLY . 7.2 mt -68.68 113.72 6.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.558 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.932 HD21 ' HB3' ' A' ' 69' ' ' GLU . 5.7 mt -101.96 155.72 17.98 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.399 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.588 HG13 ' O ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -164.52 140.08 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.867 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.12 161.2 7.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.928 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.403 ' HA3' ' HB2' ' A' ' 116' ' ' ARG . . . 79.39 -69.86 2.92 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.84 -179.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -45.12 73.12 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.043 0.449 . . . . 0.0 110.426 179.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.479 ' OD2' HD23 ' A' ' 61' ' ' LEU . 21.9 m-20 -114.35 52.64 0.83 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.569 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -62.46 -38.22 88.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.107 -179.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 75.7 mmm -85.64 -31.08 22.75 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.949 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.932 ' HB3' HD21 ' A' ' 61' ' ' LEU . 0.3 OUTLIER -75.52 -36.54 60.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.049 -179.754 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.86 ' HA ' HD13 ' A' ' 61' ' ' LEU . 0.2 OUTLIER -47.42 172.45 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.244 179.861 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.675 ' SG ' HG21 ' A' ' 46' ' ' ILE . 21.5 p -45.88 -41.55 11.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.181 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.424 ' CB ' ' O ' ' A' ' 71' ' ' CYS . 10.5 tt0 82.19 -13.78 0.83 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.84 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.88 -176.41 3.05 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.908 0.385 . . . . 0.0 110.864 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -106.4 174.07 6.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.463 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.496 HD11 ' CZ ' ' A' ' 15' ' ' PHE . 32.4 tp -56.21 -44.21 79.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.461 -179.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -70.96 -46.18 62.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.714 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.48 -28.88 65.33 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -178.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.759 HG21 ' CE2' ' A' ' 41' ' ' PHE . 0.9 OUTLIER -56.49 -67.28 0.32 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.736 0.303 . . . . 0.0 111.243 -179.589 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 131.46 -20.28 4.69 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.876 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.582 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 6.7 mt -53.22 -29.91 34.95 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.977 0.418 . . . . 0.0 110.822 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 11.2 p -86.24 -43.36 13.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.737 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.53 -30.18 69.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.703 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.634 ' CD ' HG21 ' A' ' 17' ' ' ILE . 43.6 mttt -67.45 -177.25 0.69 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.978 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 20.5 mmt85 -81.62 73.75 8.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.1 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.92 65.05 3.81 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.65 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.582 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -76.82 -5.35 47.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.573 0.225 . . . . 0.0 111.501 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -55.03 150.03 11.02 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.973 0.416 . . . . 0.0 111.147 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.854 HG21 ' HB3' ' A' ' 16' ' ' ARG . 9.8 pt -136.46 169.45 20.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.135 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.893 HD12 ' HB2' ' A' ' 91' ' ' ARG . 1.0 OUTLIER -82.58 146.17 52.79 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.757 179.789 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -67.34 -24.78 42.92 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.557 2.171 . . . . 0.0 112.534 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.893 ' HB2' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -60.35 -54.1 49.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.992 -179.926 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.414 ' HG3' HD21 ' A' ' 89' ' ' LEU . 5.9 mm-40 -58.61 -49.0 79.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.006 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -55.66 -53.32 58.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.714 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.83 -21.82 65.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.791 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.74 -50.59 68.48 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.059 0.457 . . . . 0.0 109.862 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.405 ' HB ' ' CE ' ' A' ' 50' ' ' MET . 18.8 mm -77.85 -34.48 19.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.71 179.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.56 ' HZ2' HD12 ' A' ' 106' ' ' LEU . 28.0 t-105 -52.59 -40.68 62.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.909 179.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -86.12 -30.91 22.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.425 179.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -57.34 -54.23 49.19 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.424 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 73.7 m -74.69 -75.85 0.15 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.162 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.418 ' C ' HD13 ' A' ' 60' ' ' LEU . . . 171.25 38.32 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.619 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.504 ' HA2' HD13 ' A' ' 60' ' ' LEU . . . -69.21 -41.7 78.61 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.342 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.583 HG23 ' HG ' ' A' ' 124' ' ' LEU . 37.1 mm -65.15 -44.08 95.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.757 0.313 . . . . 0.0 110.824 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -49.09 78.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.328 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.421 ' CE2' ' CG2' ' A' ' 62' ' ' VAL . 2.2 t80 -62.6 -37.89 88.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.065 179.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.68 HD13 ' CD1' ' A' ' 124' ' ' LEU . 0.1 OUTLIER -69.1 -35.72 76.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.442 179.462 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.91 -33.24 75.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.306 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 2.6 m -68.78 -49.92 54.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.3 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.418 ' HB3' ' HB2' ' A' ' 115' ' ' ALA . . . -69.07 -34.79 75.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.398 0.618 . . . . 0.0 109.772 179.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.727 HD11 ' HA ' ' A' ' 121' ' ' THR . 2.6 mt -56.94 -47.13 83.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.61 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -72.15 -33.1 67.47 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.562 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 10.0 t -77.57 -8.94 58.6 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.23 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 112' ' ' SER . 74.1 mmt-85 68.81 26.83 5.9 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 120.907 0.384 . . . . 0.0 111.105 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -108.92 -21.9 12.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.774 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.418 ' HB2' ' HB3' ' A' ' 109' ' ' ALA . . . -56.81 -22.62 37.64 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.365 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.549 ' HG2' HG23 ' A' ' 118' ' ' THR . 2.2 ttt180 68.49 81.83 0.2 Allowed Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.835 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . 0.482 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 68.7 Cg_exo -51.85 89.42 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.654 2.236 . . . . 0.0 112.489 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.549 HG23 ' HG2' ' A' ' 116' ' ' ARG . 71.5 p -117.9 -36.64 3.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.889 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 12.0 t80 -176.3 -49.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.126 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -55.02 -52.14 64.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.215 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.727 ' HA ' HD11 ' A' ' 110' ' ' ILE . 70.5 p -59.58 -45.21 92.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.629 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.94 -55.48 30.18 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 121.662 0.744 . . . . 0.0 109.627 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' MET . . . . . 0.467 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -57.58 -32.75 67.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.784 178.492 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.68 ' CD1' HD13 ' A' ' 106' ' ' LEU . 0.1 OUTLIER -67.82 -41.98 82.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.079 178.724 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.466 ' HA ' HD12 ' A' ' 128' ' ' LEU . 84.8 mm-40 -52.66 -44.53 66.25 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.329 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ASN . . . . . 0.432 ' OD1' ' HA ' ' A' ' 123' ' ' MET . 0.9 OUTLIER -81.08 -27.73 35.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.66 179.465 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.467 HD13 ' CE ' ' A' ' 123' ' ' MET . 1.0 OUTLIER -64.82 -19.26 65.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.851 0.358 . . . . 0.0 110.344 178.958 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.466 HD12 ' HA ' ' A' ' 125' ' ' GLN . 17.8 mt . . . . . 0 C--N 1.333 -0.144 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.241 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.833 0.349 . . . . 0.0 111.003 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.84 153.36 17.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.023 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.437 ' HG2' ' CZ ' ' A' ' 119' ' ' TYR . 13.5 mp0 -122.1 102.94 8.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.888 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.503 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -108.99 136.99 47.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.007 0.432 . . . . 0.0 110.833 -179.822 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.508 ' CD1' ' N ' ' A' ' 14' ' ' PHE . 0.4 OUTLIER -119.55 138.87 52.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.189 -179.701 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.826 ' HB2' HD13 ' A' ' 80' ' ' LEU . 5.5 m-85 -142.3 152.15 42.69 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.463 0.649 . . . . 0.0 112.685 -178.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.493 ' HA ' ' O ' ' A' ' 37' ' ' TRP . 8.2 ttp180 -149.59 147.41 28.11 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 114.836 -1.074 . . . . 0.0 109.59 179.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.671 HD13 HD23 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -153.4 129.53 5.35 Favored Pre-proline 0 C--N 1.331 -0.235 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.455 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 52.8 Cg_endo -91.88 117.57 0.45 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 123.23 2.62 . . . . 0.0 111.621 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -135.76 160.03 39.81 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.12 0.486 . . . . 0.0 111.558 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.605 HG12 ' HD3' ' A' ' 34' ' ' LYS . 1.9 mt -102.18 147.24 9.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.186 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.9 mtp180 -75.25 141.51 74.03 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.118 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.476 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 11.5 Cg_endo -55.13 -52.36 8.07 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.584 2.189 . . . . 0.0 112.702 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.568 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -53.46 -58.83 5.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.377 -179.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.559 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 20.2 m-20 -67.09 -30.7 70.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.109 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.59 -56.54 14.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.469 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.568 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.3 p90 -91.39 -16.85 26.74 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.659 -179.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.559 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 0.6 OUTLIER -59.51 -45.16 92.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.794 0.331 . . . . 0.0 110.784 179.668 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -168.11 133.18 1.51 Allowed Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.267 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -67.43 -13.49 39.38 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.57 2.18 . . . . 0.0 112.271 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -98.1 -34.29 10.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.383 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -98.54 26.63 5.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.823 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.464 ' HB3' HG21 ' A' ' 20' ' ' ILE . 40.9 mttt -57.98 -67.18 0.37 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.457 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.1 mmmm 60.06 116.4 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.925 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.605 ' HD3' HG12 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -108.38 143.49 37.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.002 0.429 . . . . 0.0 110.964 179.788 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -95.45 139.01 14.27 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.21 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.483 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 12.8 m-90 -97.68 111.08 23.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.112 0.482 . . . . 0.0 110.495 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.575 ' HZ3' HD11 ' A' ' 80' ' ' LEU . 12.1 t90 -95.7 117.5 30.63 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.551 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.805 ' CE1' HD12 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -117.86 144.8 45.08 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.153 179.001 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.692 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.32 124.5 0.72 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.122 0.487 . . . . 0.0 111.696 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.503 ' HB3' ' HG3' ' A' ' 48' ' ' ARG . 8.8 t-160 -92.64 104.34 16.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.341 178.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.645 ' CE2' HG21 ' A' ' 78' ' ' THR . 3.5 m-85 -86.86 153.02 21.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.179 0.514 . . . . 0.0 111.658 -178.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.453 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 28.1 p-10 -123.19 114.06 19.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.073 178.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 59.23 -135.49 51.61 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 119.892 -1.147 . . . . 0.0 111.151 -178.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.402 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 7.6 Cg_exo -72.7 -17.61 25.92 Favored 'Trans proline' 0 N--CA 1.464 -0.227 0 C-N-CA 122.506 2.137 . . . . 0.0 112.469 179.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' TRP . . . . . 0.421 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.7 OUTLIER -116.02 -165.91 1.09 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.514 -178.584 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.82 HD11 ' O ' ' A' ' 48' ' ' ARG . 2.4 tt -128.1 151.87 35.47 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-O 121.122 0.487 . . . . 0.0 111.927 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -103.03 -40.78 6.34 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.531 -0.758 . . . . 0.0 111.816 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.82 ' O ' HD11 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -144.85 154.28 42.49 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 120.7 -0.4 . . . . 0.0 111.396 -179.535 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.412 ' OE1' ' CZ2' ' A' ' 37' ' ' TRP . 7.9 tt0 -141.13 141.73 34.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.362 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.418 ' SD ' HD11 ' A' ' 52' ' ' LEU . 5.3 ttm -135.99 111.64 9.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.178 179.412 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.489 ' HB3' ' HB ' ' A' ' 59' ' ' ILE . 4.5 tt0 -102.82 137.41 41.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.892 0.377 . . . . 0.0 111.523 -179.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.805 HD12 ' CE1' ' A' ' 38' ' ' TYR . 3.2 mt -133.79 124.78 27.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.8 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.421 ' CD2' ' HG2' ' A' ' 51' ' ' GLU . 25.6 m-70 -139.33 134.61 16.61 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.537 -0.302 . . . . 0.0 111.1 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -50.64 -25.71 15.45 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.54 2.16 . . . . 0.0 112.245 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -99.53 -27.37 13.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.006 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -114.47 118.99 40.8 Favored Pre-proline 0 C--O 1.234 0.262 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.826 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -49.7 177.37 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.565 2.177 . . . . 0.0 112.559 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -58.67 85.74 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.699 2.266 . . . . 0.0 112.216 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.489 ' HB ' ' HB3' ' A' ' 51' ' ' GLU . 44.4 mt -71.34 101.28 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.77 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.496 HD21 ' N ' ' A' ' 102' ' ' GLY . 1.1 mp -78.66 144.66 35.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.096 -179.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.804 HD13 ' HA ' ' A' ' 70' ' ' MET . 84.5 mt -146.21 151.17 37.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.966 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.5 p -156.48 149.88 10.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.987 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.69 140.47 58.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.209 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.56 -49.46 1.46 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.332 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.492 ' HD2' ' HB2' ' A' ' 109' ' ' ALA . 0.1 OUTLIER -88.08 -63.03 1.36 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.885 0.374 . . . . 0.0 110.727 179.809 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.779 ' HB3' HD22 ' A' ' 61' ' ' LEU . 18.6 m-20 -101.24 55.01 0.83 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.8 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.06 -27.26 63.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.971 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 50.0 mtp -84.77 -28.9 25.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.991 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -87.49 -42.08 13.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.09 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.804 ' HA ' HD13 ' A' ' 61' ' ' LEU . 4.8 ptm -57.25 -166.92 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.074 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.574 ' SG ' HG22 ' A' ' 78' ' ' THR . 17.0 t -81.52 104.5 11.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.087 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -73.77 -17.96 61.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.935 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -78.84 177.12 8.96 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.018 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.526 ' O ' HG23 ' A' ' 78' ' ' THR . 9.4 m120 -105.37 -173.59 2.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.857 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.696 HD11 HG21 ' A' ' 81' ' ' THR . 0.7 OUTLIER -54.72 -53.08 59.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.744 -179.462 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -71.58 -54.36 10.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.871 0.367 . . . . 0.0 111.787 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.03 -38.2 36.57 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.645 HG21 ' CE2' ' A' ' 41' ' ' PHE . 2.0 p -48.12 -61.56 1.92 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.777 0.322 . . . . 0.0 111.543 -179.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 125.15 -28.68 5.04 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.703 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.826 HD13 ' HB2' ' A' ' 15' ' ' PHE . 1.1 mt -49.05 -45.55 43.07 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.998 0.428 . . . . 0.0 110.737 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.696 HG21 HD11 ' A' ' 75' ' ' LEU . 0.6 OUTLIER -74.89 -32.26 61.8 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.46 179.695 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 5.9 mmm180 -61.74 -32.07 72.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.493 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.686 ' HD2' ' HB2' ' A' ' 86' ' ' ALA . 0.1 OUTLIER -86.3 -174.65 5.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.631 179.82 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 8.4 mpt_? -102.47 119.48 38.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.946 0.403 . . . . 0.0 111.123 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 60.65 85.25 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.749 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.686 ' HB2' ' HD2' ' A' ' 83' ' ' LYS . . . -130.92 19.79 5.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.639 0.257 . . . . 0.0 111.244 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.48 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 30.5 mt-10 -99.83 160.0 14.64 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.959 0.409 . . . . 0.0 111.239 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.468 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 0.8 OUTLIER -138.16 174.51 10.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.042 179.916 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.479 HD12 ' H ' ' A' ' 92' ' ' GLN . 0.4 OUTLIER -98.06 147.99 33.85 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.545 179.584 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -66.97 -22.98 47.43 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.483 2.122 . . . . 0.0 112.7 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -54.79 40.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.786 0.327 . . . . 0.0 111.082 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.479 ' H ' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -70.51 -34.84 72.78 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.03 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.472 ' CE1' ' HD3' ' A' ' 48' ' ' ARG . 21.8 t80 -62.64 -53.23 57.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.482 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.81 -22.05 63.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.548 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.11 -50.82 71.67 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 179.157 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.564 HG21 HD11 ' A' ' 52' ' ' LEU . 17.5 mm -71.53 -35.93 58.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.259 178.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.436 ' CZ3' ' HG ' ' A' ' 60' ' ' LEU . 18.4 t-105 -53.45 -40.49 65.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.029 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -85.72 -23.93 27.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.816 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.427 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 7.4 mtt-85 -56.85 -54.1 50.28 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.053 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 43.1 t -81.51 -81.32 0.14 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.037 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -173.98 39.64 0.13 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.553 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.496 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -61.33 -55.23 30.36 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.634 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.453 HD12 HD22 ' A' ' 127' ' ' LEU . 10.1 mm -57.18 -42.95 80.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.769 0.318 . . . . 0.0 111.173 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -65.25 -49.28 70.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.681 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -60.57 -40.07 90.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.514 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.795 HD12 HD11 ' A' ' 110' ' ' ILE . 0.2 OUTLIER -70.38 -45.93 65.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.87 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.561 ' NE2' HD11 ' A' ' 128' ' ' LEU . 1.7 mm-40 -61.88 -29.95 70.54 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.988 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 54.6 p -72.55 -50.32 26.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.805 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.492 ' HB2' ' HD2' ' A' ' 65' ' ' LYS . . . -68.93 -35.9 77.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.579 0.704 . . . . 0.0 109.161 178.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.795 HD11 HD12 ' A' ' 106' ' ' LEU . 13.6 mt -58.59 -44.3 89.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.912 178.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.96 -43.13 83.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.535 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 5.9 m -72.58 -10.09 59.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.246 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . 0.435 ' HB2' ' O ' ' A' ' 112' ' ' SER . 16.3 mmt180 75.39 27.28 1.07 Allowed 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.909 0.385 . . . . 0.0 110.987 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -92.31 -28.67 16.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.384 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.511 ' HB1' ' CG2' ' A' ' 121' ' ' THR . . . -82.95 94.66 7.78 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.749 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.8 ptt180 -53.29 118.37 14.1 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.218 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -52.96 88.53 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.519 2.146 . . . . 0.0 112.124 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 5.2 t -110.2 -46.29 3.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.052 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.437 ' CZ ' ' HG2' ' A' ' 12' ' ' GLN . 9.8 t80 -177.36 -54.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.187 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.468 ' O ' ' HG3' ' A' ' 123' ' ' MET . . . -53.82 -40.31 66.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.863 0.363 . . . . 0.0 111.177 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.527 HG22 ' CD1' ' A' ' 106' ' ' LEU . 62.6 p -69.27 -43.74 73.29 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.481 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.57 -58.12 9.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.172 0.511 . . . . 0.0 110.239 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' MET . . . . . 0.612 ' HE2' ' N ' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -55.36 -29.93 59.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.046 179.119 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.612 ' N ' ' HE2' ' A' ' 123' ' ' MET . 0.1 OUTLIER -67.17 -48.94 66.46 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 121.022 0.439 . . . . 0.0 109.852 178.805 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.513 ' HA ' HD12 ' A' ' 128' ' ' LEU . 75.7 mm-40 -50.01 -39.62 41.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.796 179.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -80.09 -35.16 37.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.059 178.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.453 HD22 HD12 ' A' ' 103' ' ' ILE . 0.6 OUTLIER -57.81 -20.29 34.63 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.652 179.046 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.561 HD11 ' NE2' ' A' ' 107' ' ' GLN . 9.6 mt . . . . . 0 C--N 1.332 -0.181 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.141 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.784 0.326 . . . . 0.0 111.012 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -93.04 125.25 37.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.986 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.447 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 7.9 mp0 -111.96 102.8 11.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.974 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.538 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 2.9 mtt180 -113.92 126.8 55.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.977 0.418 . . . . 0.0 110.953 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.493 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 2.2 m-85 -109.0 134.99 50.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.884 179.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.819 ' CB ' HD22 ' A' ' 80' ' ' LEU . 2.6 m-85 -131.25 152.65 50.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.29 0.567 . . . . 0.0 112.335 -178.374 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.523 ' CB ' HG21 ' A' ' 88' ' ' ILE . 41.3 ttp85 -149.28 148.06 29.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.92 179.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.616 HG23 ' HB1' ' A' ' 86' ' ' ALA . 0.3 OUTLIER -152.08 121.73 3.45 Favored Pre-proline 0 C--N 1.329 -0.286 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.646 179.905 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -86.15 88.41 0.78 Allowed 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.93 2.42 . . . . 0.0 112.32 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.7 p90 -116.0 139.66 50.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.931 0.396 . . . . 0.0 111.02 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.735 HG23 ' O ' ' A' ' 33' ' ' LYS . 13.2 mt -86.85 142.58 12.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.927 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.8 110.22 2.35 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.118 179.369 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.499 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 76.4 Cg_exo -39.76 -51.84 2.83 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.795 2.33 . . . . 0.0 112.863 -179.393 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.545 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -50.07 -58.76 4.83 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.871 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.555 ' HA ' ' HG2' ' A' ' 27' ' ' LYS . 6.1 m-20 -67.07 -33.05 74.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.24 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.421 ' HB3' ' HA ' ' A' ' 22' ' ' PRO . 0.0 OUTLIER -52.07 -43.55 63.89 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.736 -178.904 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.545 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.7 p90 -104.59 -34.93 8.02 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -178.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.555 ' HG2' ' HA ' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -61.84 -32.31 72.63 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.664 -0.415 . . . . 0.0 111.601 -178.774 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.406 ' CB ' ' HB2' ' A' ' 31' ' ' ASN . 67.7 m-20 -150.2 120.32 3.83 Favored Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 120.844 -0.343 . . . . 0.0 111.523 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -72.67 -7.84 21.47 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.539 2.159 . . . . 0.0 112.321 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -109.81 -32.41 7.08 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.937 0.399 . . . . 0.0 110.394 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.406 ' HB2' ' CB ' ' A' ' 28' ' ' ASP . 84.2 m-20 -97.72 28.18 3.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.658 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.641 ' HB3' HG21 ' A' ' 20' ' ' ILE . 13.5 mttt -59.83 -59.05 6.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.918 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.735 ' O ' HG23 ' A' ' 20' ' ' ILE . 17.8 mmtt 70.54 113.78 0.05 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.599 -179.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.409 ' HD2' HG12 ' A' ' 20' ' ' ILE . 0.3 OUTLIER -83.01 110.86 18.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.489 -179.938 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.45 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -91.34 117.59 5.22 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.833 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 10.1 m-90 -97.84 126.24 43.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.853 0.359 . . . . 0.0 110.431 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.541 ' CZ3' HD11 ' A' ' 80' ' ' LEU . 11.2 t90 -113.65 119.87 38.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.614 -179.192 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.799 ' CE1' HD12 ' A' ' 52' ' ' LEU . 4.1 m-85 -115.96 150.46 37.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.941 178.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.535 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -170.45 123.75 0.68 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.161 0.505 . . . . 0.0 111.61 179.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.493 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 18.0 t-160 -93.17 98.28 11.19 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.451 178.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.669 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 20.4 m-85 -85.93 127.31 34.58 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.426 -179.146 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.551 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 25.0 p-10 -93.7 110.99 22.59 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 178.53 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 58.93 -134.53 52.44 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.053 -1.07 . . . . 0.0 111.122 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo -71.66 -19.64 27.62 Favored 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 122.489 2.126 . . . . 0.0 112.204 179.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' TRP . . . . . 0.423 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.6 OUTLIER -112.82 -170.11 1.61 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.274 -178.851 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.686 HD13 ' SG ' ' A' ' 71' ' ' CYS . 3.2 tt -127.35 151.69 34.49 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-O 121.263 0.554 . . . . 0.0 112.114 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -111.6 -32.64 6.61 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.917 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.47 ' CZ ' ' CE2' ' A' ' 93' ' ' PHE . 4.2 ptm180 -157.19 154.97 30.11 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.46 -179.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.679 ' HB3' HD11 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -161.55 159.02 27.26 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.242 179.801 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.467 ' HE1' ' HB ' ' A' ' 96' ' ' ILE . 11.3 ttp -134.46 154.84 51.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.852 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.464 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.2 OUTLIER -129.49 117.67 20.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.897 179.694 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.799 HD12 ' CE1' ' A' ' 38' ' ' TYR . 1.3 mt -120.35 106.18 11.62 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.876 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.45 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 6.8 m170 -127.54 134.12 25.84 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.698 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -51.94 -23.44 16.58 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.342 2.028 . . . . 0.0 112.262 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -100.34 -26.95 13.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.113 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.443 ' HB2' ' HB2' ' A' ' 53' ' ' HIS . 7.9 mttt -117.84 126.02 27.61 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.977 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -54.9 173.46 0.27 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.767 2.312 . . . . 0.0 112.463 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -60.25 88.02 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.714 2.276 . . . . 0.0 112.383 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.701 HG22 ' CD2' ' A' ' 61' ' ' LEU . 75.0 mt -70.4 100.57 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.799 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.44 ' HG ' ' CH2' ' A' ' 97' ' ' TRP . 0.3 OUTLIER -77.97 123.99 27.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.693 -179.966 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.701 ' CD2' HG22 ' A' ' 59' ' ' ILE . 2.8 mm? -121.02 139.55 53.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.25 -179.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.2 p -149.14 139.26 16.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.951 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.616 ' HB2' ' HE1' ' A' ' 70' ' ' MET . . . -59.16 155.95 13.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.988 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.416 ' HA3' ' HB2' ' A' ' 116' ' ' ARG . . . 85.76 -63.49 4.25 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.112 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.19 -67.93 0.6 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.997 0.427 . . . . 0.0 110.483 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.467 ' CB ' HD13 ' A' ' 61' ' ' LEU . 5.6 m-20 -97.11 47.16 1.04 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.404 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.463 ' HA ' ' HG2' ' A' ' 70' ' ' MET . 1.4 t0 -63.31 -25.35 68.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.438 -179.601 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -85.56 -35.73 20.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.753 0.311 . . . . 0.0 111.151 -179.696 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.536 ' CB ' HD11 ' A' ' 61' ' ' LEU . 1.1 mp0 -80.18 -36.22 35.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.256 -179.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.616 ' HE1' ' HB2' ' A' ' 63' ' ' ALA . 0.7 OUTLIER -56.0 -169.36 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.876 0.37 . . . . 0.0 111.146 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.686 ' SG ' HD13 ' A' ' 46' ' ' ILE . 3.5 m -68.19 -44.38 76.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.571 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 69.23 -64.65 0.33 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.101 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 11.0 mptt -54.3 178.91 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.113 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -94.67 -168.69 1.88 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.604 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.666 HD22 HG23 ' A' ' 81' ' ' THR . 7.8 mt -71.99 -53.38 13.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.386 -179.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -31.69 70.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.219 -179.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -80.5 -36.37 33.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.327 -179.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.642 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 1.0 OUTLIER -61.54 -80.06 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.051 -179.772 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 147.53 -16.43 1.45 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.507 -0.854 . . . . 0.0 113.038 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.819 HD22 ' CB ' ' A' ' 15' ' ' PHE . 5.3 mt -53.89 -35.24 61.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.905 0.383 . . . . 0.0 110.915 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.666 HG23 HD22 ' A' ' 75' ' ' LEU . 22.6 p -81.81 -39.92 23.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.594 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.5 mmm180 -63.97 -30.54 71.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.545 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -165.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.728 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -102.23 83.48 2.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.778 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.15 71.26 0.78 Allowed Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.336 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.616 ' HB1' HG23 ' A' ' 17' ' ' ILE . . . -98.17 34.42 1.96 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.666 0.269 . . . . 0.0 110.978 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -90.9 147.81 22.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.224 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.523 HG21 ' CB ' ' A' ' 16' ' ' ARG . 1.3 pt -139.09 179.46 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.057 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.605 HD12 ' CB ' ' A' ' 91' ' ' ARG . 0.4 OUTLIER -106.33 149.9 38.81 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.648 179.594 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -61.98 -30.7 83.67 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.506 2.137 . . . . 0.0 112.215 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.605 ' CB ' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -56.51 -54.0 50.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.351 -179.845 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -64.02 -53.84 43.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.418 -179.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.47 ' CE2' ' CZ ' ' A' ' 48' ' ' ARG . 6.2 t80 -52.65 -53.23 50.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.189 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.402 ' OE2' ' NH1' ' A' ' 48' ' ' ARG . 1.2 tt0 -66.58 -22.75 66.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.39 179.562 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.09 -50.36 73.56 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.161 0.505 . . . . 0.0 109.756 179.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.467 ' HB ' ' HE1' ' A' ' 50' ' ' MET . 17.0 mm -71.48 -34.5 53.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.662 179.362 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.467 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 25.5 t-105 -54.33 -38.14 65.67 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.031 179.27 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.644 ' HG3' HD13 ' A' ' 103' ' ' ILE . 1.4 tt0 -85.55 -27.85 25.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.659 179.335 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.3 mtp85 -56.82 -50.65 71.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.13 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 76.6 m -84.97 -80.79 0.2 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.153 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -178.99 37.55 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.614 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.467 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -59.66 -59.59 10.27 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.492 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.923 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.8 mp -52.8 -30.39 15.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.808 0.337 . . . . 0.0 111.477 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.83 -45.34 74.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.003 0.43 . . . . 0.0 110.578 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -68.23 -39.44 82.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.42 179.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.889 ' CD1' HD13 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -69.68 -50.97 38.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.03 -179.852 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -29.59 69.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.87 0.366 . . . . 0.0 110.789 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 6.1 m -69.01 -50.12 51.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.653 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.64 -32.73 68.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.507 0.67 . . . . 0.0 109.854 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.633 HD11 ' HA ' ' A' ' 121' ' ' THR . 9.3 mt -58.97 -48.48 86.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 114.869 -1.059 . . . . 0.0 110.584 179.428 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -70.57 -35.78 73.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.578 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.5 -15.39 62.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.055 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 9.5 mmm180 74.97 35.27 0.62 Allowed 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.876 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -108.67 -27.35 9.87 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.792 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.14 -172.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.149 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.416 ' HB2' ' HA3' ' A' ' 64' ' ' GLY . 3.2 ttt180 -129.66 93.7 34.11 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.906 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -50.41 89.47 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.532 2.155 . . . . 0.0 112.323 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 6.5 p -129.07 -51.97 1.21 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.878 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.447 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 13.4 t80 -165.56 -55.49 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.265 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.436 ' O ' ' HG3' ' A' ' 123' ' ' MET . . . -53.96 -42.61 69.1 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.273 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.633 ' HA ' HD11 ' A' ' 110' ' ' ILE . 10.2 p -66.6 -38.74 87.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.686 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -67.73 -58.41 4.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.145 0.498 . . . . 0.0 110.688 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' MET . . . . . 0.436 ' HG3' ' O ' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -53.04 -29.6 30.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.414 179.521 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.923 HD11 ' HA ' ' A' ' 103' ' ' ILE . 0.4 OUTLIER -66.39 -52.74 43.62 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.02 0.438 . . . . 0.0 109.944 178.961 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -49.87 -37.04 29.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.012 179.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -80.99 -34.19 33.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.227 179.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.06 -18.85 60.08 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.398 179.082 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.9 mt . . . . . 0 C--N 1.332 -0.158 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.88 179.974 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.527 0.093 0 CA-C-O 120.732 0.301 . . . . 0.0 110.93 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -82.42 158.14 23.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.015 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.445 ' HG2' ' CZ ' ' A' ' 119' ' ' TYR . 8.2 mp0 -122.02 103.45 8.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.907 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.514 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -110.79 130.0 55.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.948 0.404 . . . . 0.0 110.893 179.829 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.518 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 0.9 OUTLIER -115.27 135.15 54.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.307 -179.946 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.6 ' CE1' HD11 ' A' ' 75' ' ' LEU . 0.3 OUTLIER -140.4 153.57 46.38 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.365 0.602 . . . . 0.0 112.219 -179.713 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.675 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.58 143.0 25.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.393 179.112 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.55 HG23 ' HB1' ' A' ' 86' ' ' ALA . 0.3 OUTLIER -141.05 135.63 15.42 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 120.857 0.36 . . . . 0.0 111.919 -179.376 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.492 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 61.7 Cg_endo -92.07 103.28 0.21 Allowed 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 123.301 2.667 . . . . 0.0 112.296 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 15.1 p90 -123.31 148.79 45.6 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.937 0.398 . . . . 0.0 110.934 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.459 HG21 ' HB2' ' A' ' 32' ' ' LYS . 3.8 mt -94.3 149.25 4.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.016 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -71.86 131.13 86.01 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.678 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.575 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 77.6 Cg_exo -40.21 -60.16 0.62 Allowed 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.974 2.449 . . . . 0.0 113.138 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.635 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -45.85 -53.8 9.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.866 -179.596 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.466 ' HB3' ' HA ' ' A' ' 32' ' ' LYS . 4.3 m-20 -62.96 -34.49 77.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.257 -178.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.575 ' HG3' ' HA ' ' A' ' 22' ' ' PRO . 1.1 mt-30 -58.12 -57.49 12.59 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.703 0.287 . . . . 0.0 111.631 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.635 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.6 p90 -84.71 -7.5 59.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.641 -179.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.542 ' HD2' ' HB1' ' A' ' 23' ' ' ALA . 4.0 mtpp -74.1 -42.93 59.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.843 0.354 . . . . 0.0 110.56 179.409 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -173.07 139.0 0.85 Allowed Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.037 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.81 -21.54 33.11 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.6 2.2 . . . . 0.0 112.366 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -97.97 -31.72 12.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.715 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -100.25 42.63 1.1 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.778 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.466 ' HA ' ' HB3' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -102.26 60.44 0.84 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.508 179.703 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.411 ' HB3' ' HG2' ' A' ' 54' ' ' PRO . 13.9 mmtp -36.92 115.82 0.4 Allowed 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.679 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -85.22 134.04 34.16 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.207 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.452 ' HA2' ' HD3' ' A' ' 54' ' ' PRO . . . -120.93 138.58 12.76 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.648 -0.786 . . . . 0.0 112.531 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.492 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 29.3 m-90 -97.91 148.05 23.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.905 0.383 . . . . 0.0 110.82 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.441 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 86.4 t90 -130.93 117.36 19.14 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.909 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.891 ' CE1' HD12 ' A' ' 52' ' ' LEU . 2.2 m-85 -112.67 152.81 28.56 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.847 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.677 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.77 124.74 0.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.302 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.518 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 12.1 t-160 -93.92 101.74 13.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.151 179.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.758 ' CZ ' HG21 ' A' ' 78' ' ' THR . 11.0 m-85 -85.86 126.19 33.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.513 -179.51 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.469 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 4.2 m-20 -100.09 116.92 33.24 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 178.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 59.63 -140.09 48.18 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 119.986 -1.102 . . . . 0.0 111.014 -178.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -72.1 -12.68 28.25 Favored 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.489 2.126 . . . . 0.0 112.208 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' TRP . . . . . . . . . . . . . 1.2 m95 -118.22 -168.25 1.49 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.936 0.398 . . . . 0.0 111.95 -178.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.677 ' CD1' ' HB1' ' A' ' 39' ' ' ALA . 4.3 tt -134.73 156.12 39.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.576 -179.429 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.703 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -132.45 -28.32 1.67 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.123 -179.472 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.472 ' CB ' ' HB3' ' A' ' 40' ' ' HIS . 6.5 ttm180 -115.57 133.53 55.94 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.828 0.347 . . . . 0.0 111.107 -179.559 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.467 ' HB3' ' HB3' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -137.63 134.14 35.15 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.853 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 3.1 ttm -141.16 111.77 6.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.724 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.644 ' HB3' HD12 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -96.76 135.76 38.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.997 -179.74 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.891 HD12 ' CE1' ' A' ' 38' ' ' TYR . 38.3 mt -131.13 102.14 5.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.744 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -121.66 138.4 28.4 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.918 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.452 ' HD3' ' HA2' ' A' ' 35' ' ' GLY . 50.3 Cg_exo -54.44 -29.4 58.87 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.45 2.1 . . . . 0.0 112.388 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 37.2 p30 -95.75 -20.71 18.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.193 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.8 mttt -124.2 115.16 27.5 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.834 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -47.17 173.34 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.512 2.141 . . . . 0.0 112.451 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -54.53 88.5 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.489 2.126 . . . . 0.0 112.356 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.644 HD12 ' HB3' ' A' ' 51' ' ' GLU . 5.4 mt -65.77 104.6 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.906 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.629 ' HG ' ' HA2' ' A' ' 102' ' ' GLY . 0.0 OUTLIER -76.43 133.22 39.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.804 -179.995 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.971 HD21 ' HB3' ' A' ' 69' ' ' GLU . 0.7 OUTLIER -141.32 154.43 45.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.087 -179.928 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.5 p -157.63 144.09 9.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.826 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.703 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -55.68 151.63 10.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.855 0.359 . . . . 0.0 111.198 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.404 ' HA3' ' HB2' ' A' ' 116' ' ' ARG . . . 84.08 -63.3 4.46 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.217 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.95 -31.54 63.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.939 0.399 . . . . 0.0 110.573 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.426 ' CB ' ' HG ' ' A' ' 61' ' ' LEU . 9.3 m-20 -119.56 56.72 0.93 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.664 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.05 -32.22 73.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.071 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.57 -34.33 21.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.274 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.971 ' HB3' HD21 ' A' ' 61' ' ' LEU . 11.9 mp0 -81.15 -51.65 8.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.123 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.433 ' CE ' ' N ' ' A' ' 63' ' ' ALA . 28.0 tpp -38.36 152.1 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.415 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.42 ' O ' ' CB ' ' A' ' 72' ' ' GLU . 0.5 OUTLIER -42.04 -60.15 1.52 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.221 179.97 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.42 ' CB ' ' O ' ' A' ' 71' ' ' CYS . 0.0 OUTLIER 83.51 -21.79 0.26 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.934 179.647 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.5 ' O ' HG23 ' A' ' 78' ' ' THR . 0.7 OUTLIER -94.74 122.48 37.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.644 0.259 . . . . 0.0 110.834 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.411 ' N ' ' CG ' ' A' ' 77' ' ' GLU . 7.2 m120 -50.83 176.09 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.886 0.374 . . . . 0.0 111.053 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.89 HD12 HG23 ' A' ' 81' ' ' THR . 0.6 OUTLIER -50.65 -46.71 58.52 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.2 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.92 -56.31 12.4 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.537 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.422 ' HG3' ' CA ' ' A' ' 73' ' ' LYS . 1.1 pm0 -61.45 -18.08 57.34 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.758 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.3 OUTLIER -74.81 -63.62 1.21 Allowed 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.917 179.843 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 122.83 -12.85 8.67 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.586 -0.816 . . . . 0.0 113.101 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.9 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 3.4 mm? -54.13 -36.67 63.51 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.267 0.556 . . . . 0.0 110.387 179.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.89 HG23 HD12 ' A' ' 75' ' ' LEU . 45.9 p -83.94 -21.51 31.8 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.912 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 7.7 mtt180 -84.52 -11.89 55.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.592 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.624 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 0.3 OUTLIER -93.34 24.7 3.75 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.958 0.409 . . . . 0.0 111.34 -179.849 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.5 mmt85 37.73 93.94 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 77.64 46.53 9.66 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.764 -0.732 . . . . 0.0 113.585 178.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.9 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -101.82 16.6 25.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.79 0.295 . . . . 0.0 111.011 179.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.555 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -89.27 167.08 13.36 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.898 0.38 . . . . 0.0 111.353 -179.673 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.675 HG21 ' HB3' ' A' ' 16' ' ' ARG . 0.9 OUTLIER -143.45 -179.95 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.999 179.843 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.596 HD12 ' HB2' ' A' ' 91' ' ' ARG . 0.2 OUTLIER -101.76 155.77 36.01 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.743 179.742 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.29 -22.87 24.85 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.499 2.132 . . . . 0.0 112.404 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.596 ' HB2' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -57.91 -54.04 51.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.116 -179.847 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -66.4 -38.28 87.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.903 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.452 ' CE1' ' HD2' ' A' ' 48' ' ' ARG . 15.3 t80 -58.28 -53.15 61.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.919 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.411 ' OE1' ' NH1' ' A' ' 48' ' ' ARG . 0.2 OUTLIER -70.13 -23.56 63.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.782 179.852 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.27 -50.95 72.03 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 179.04 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.4 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 20.5 mm -74.8 -30.79 24.89 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.954 178.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.436 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 24.2 t-105 -57.6 -36.4 71.7 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.737 178.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -85.41 -29.4 24.42 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.289 179.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.4 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 7.7 mtm180 -56.66 -52.97 62.87 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.108 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 42.6 t -83.5 -82.02 0.16 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.3 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -177.02 37.47 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.525 -0.845 . . . . 0.0 112.791 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.629 ' HA2' ' HG ' ' A' ' 60' ' ' LEU . . . -56.08 -64.39 4.43 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.416 179.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.935 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.7 mp -52.94 -33.54 19.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.974 0.416 . . . . 0.0 111.181 179.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -68.17 -45.42 73.53 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.514 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -68.03 -41.69 81.75 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.424 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.927 ' CD1' HD13 ' A' ' 124' ' ' LEU . 0.3 OUTLIER -66.91 -51.13 59.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.83 179.86 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.425 ' HA ' ' HB ' ' A' ' 110' ' ' ILE . 0.0 OUTLIER -60.39 -29.23 68.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.846 179.919 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . 0.404 ' N ' ' HG3' ' A' ' 107' ' ' GLN . 12.3 t -68.23 -50.69 52.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.735 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.99 -33.94 70.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.5 0.667 . . . . 0.0 109.35 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.495 HD12 HD22 ' A' ' 124' ' ' LEU . 10.3 mt -56.61 -46.11 82.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.009 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -68.63 -37.7 79.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.147 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.446 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 5.2 t -72.27 -10.51 59.88 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.9 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 112' ' ' SER . 3.6 mpp_? 69.65 32.51 3.29 Favored 'General case' 0 C--O 1.23 0.079 0 CA-C-O 121.015 0.436 . . . . 0.0 111.097 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.5 mt-30 -106.3 -25.92 11.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.398 179.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -75.99 90.57 3.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.078 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.404 ' HB2' ' HA3' ' A' ' 64' ' ' GLY . 12.2 mtt180 -48.86 105.57 0.52 Allowed Pre-proline 0 C--N 1.331 -0.198 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.833 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . 0.411 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 50.0 Cg_exo -53.44 98.84 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.392 2.061 . . . . 0.0 112.566 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.438 HG21 ' HB2' ' A' ' 47' ' ' ALA . 79.5 m -112.63 -43.86 3.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.609 179.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.445 ' CZ ' ' HG2' ' A' ' 12' ' ' GLN . 14.8 t80 -178.23 -47.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.951 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.461 ' O ' ' HG3' ' A' ' 123' ' ' MET . . . -56.31 -39.21 72.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.265 -179.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.65 HG22 HD22 ' A' ' 106' ' ' LEU . 37.7 p -68.98 -37.26 78.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.506 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.96 -58.35 8.93 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.214 0.53 . . . . 0.0 110.332 179.406 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' MET . . . . . 0.564 ' HE1' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -58.17 -29.4 65.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.167 178.934 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.935 HD11 ' HA ' ' A' ' 103' ' ' ILE . 0.3 OUTLIER -70.28 -46.93 63.35 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.145 0.498 . . . . 0.0 109.875 178.982 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 17.8 mm-40 -50.73 -40.98 55.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.652 -0.703 . . . . 0.0 109.807 179.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 28.4 m-20 -76.1 -34.35 59.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.857 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.634 HD22 HG12 ' A' ' 103' ' ' ILE . 0.1 OUTLIER -60.14 -20.0 56.36 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.374 178.893 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.476 ' O ' HD12 ' A' ' 128' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--O 1.233 0.204 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.938 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.873 0.368 . . . . 0.0 110.997 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -81.59 137.28 35.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.995 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.445 ' HG3' ' CE2' ' A' ' 119' ' ' TYR . 33.7 mm-40 -100.72 102.74 13.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.751 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.572 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -110.27 124.75 52.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.031 -179.45 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.502 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 1.1 m-85 -110.77 152.91 26.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.473 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.777 ' HB2' HD22 ' A' ' 80' ' ' LEU . 4.4 m-85 -152.2 152.73 32.61 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.367 0.603 . . . . 0.0 112.178 -179.559 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.721 ' NH1' HD12 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -148.96 139.43 22.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.394 179.217 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.506 HG23 ' HB1' ' A' ' 86' ' ' ALA . 0.1 OUTLIER -142.25 125.72 9.6 Favored Pre-proline 0 C--N 1.329 -0.295 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.731 -179.319 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.501 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 67.9 Cg_endo -89.86 101.71 0.32 Allowed 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 123.065 2.51 . . . . 0.0 112.155 179.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.1 p90 -120.02 145.42 46.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.856 0.36 . . . . 0.0 110.912 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.481 HG12 ' HG3' ' A' ' 34' ' ' LYS . 3.0 mt -89.63 150.34 3.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.925 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.402 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 0.5 OUTLIER -72.15 126.65 91.1 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.719 179.963 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.596 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 70.3 Cg_exo -39.83 -60.33 0.57 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.043 2.495 . . . . 0.0 113.097 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.672 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -44.87 -52.71 8.33 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.837 -179.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.516 ' HB3' ' HA ' ' A' ' 32' ' ' LYS . 2.1 m-20 -65.62 -37.06 85.52 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.508 -178.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.596 ' HG3' ' HA ' ' A' ' 22' ' ' PRO . 1.0 OUTLIER -54.91 -57.53 11.27 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -178.866 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.672 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.0 p90 -83.75 -16.75 43.6 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.706 -179.22 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.436 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -60.98 -47.1 88.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.755 0.312 . . . . 0.0 110.286 179.564 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 177.08 141.28 0.24 Allowed Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.124 179.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.42 -19.01 66.08 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.621 2.214 . . . . 0.0 112.289 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -86.34 -39.43 16.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.589 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -105.87 57.83 0.66 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.69 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.516 ' HA ' ' HB3' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -111.7 54.76 0.68 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.607 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.455 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.2 OUTLIER -41.58 138.46 1.35 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.549 -179.844 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.481 ' HG3' HG12 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -107.93 144.03 35.75 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.046 0.451 . . . . 0.0 111.862 -179.42 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -121.28 129.44 7.76 Favored Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.807 179.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.501 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 28.9 m-90 -98.08 133.99 41.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.013 0.435 . . . . 0.0 111.146 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.649 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 15.6 t90 -113.48 117.27 31.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.965 -179.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.686 ' CE1' HD12 ' A' ' 52' ' ' LEU . 10.9 m-85 -110.38 147.57 33.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.219 179.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.843 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -170.13 124.71 0.75 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.059 0.457 . . . . 0.0 111.992 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.504 ' HB3' ' CB ' ' A' ' 48' ' ' ARG . 12.7 t-160 -97.68 98.04 9.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.375 178.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.777 ' CZ ' HG21 ' A' ' 78' ' ' THR . 11.8 m-85 -85.32 119.34 25.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.715 -178.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.463 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 3.3 p-10 -91.21 114.8 27.43 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 178.451 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 57.69 -135.95 51.23 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 119.908 -1.139 . . . . 0.0 111.153 -178.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -72.62 -17.31 26.44 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 122.536 2.158 . . . . 0.0 112.444 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -115.36 -172.67 2.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.946 0.403 . . . . 0.0 111.8 -178.595 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.771 HD11 ' O ' ' A' ' 48' ' ' ARG . 2.8 tt -131.98 153.67 38.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.726 -179.567 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.409 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -127.24 -26.77 3.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.646 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.771 ' O ' HD11 ' A' ' 46' ' ' ILE . 2.1 ttp180 -117.5 136.77 53.0 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-O 120.817 0.341 . . . . 0.0 111.295 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.843 ' NE2' ' HB2' ' A' ' 39' ' ' ALA . 0.7 OUTLIER -145.12 132.48 20.65 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.887 179.967 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 2.5 ttm -143.48 129.45 19.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.677 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.482 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -114.11 140.71 48.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.165 -179.61 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.686 HD12 ' CE1' ' A' ' 38' ' ' TYR . 31.1 mt -135.29 108.53 7.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.811 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 -135.85 138.2 27.29 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.858 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.406 ' HG2' ' HB3' ' A' ' 33' ' ' LYS . 9.9 Cg_endo -52.8 -23.88 22.03 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.602 2.201 . . . . 0.0 112.254 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -96.18 -28.71 14.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.999 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 1.8 mtpp -118.3 122.14 30.51 Favored Pre-proline 0 C--O 1.233 0.229 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.844 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.36 -179.99 0.07 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.582 2.188 . . . . 0.0 112.237 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.417 ' O ' HD13 ' A' ' 60' ' ' LEU . 42.4 Cg_exo -56.75 85.08 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.545 2.163 . . . . 0.0 112.332 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.57 HG22 ' HG ' ' A' ' 61' ' ' LEU . 91.1 mt -65.42 98.06 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.8 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.469 HD21 ' N ' ' A' ' 102' ' ' GLY . 0.4 OUTLIER -82.2 112.83 19.58 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.703 -179.975 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.57 ' HG ' HG22 ' A' ' 59' ' ' ILE . 71.9 mt -123.6 148.24 46.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.071 0.462 . . . . 0.0 111.324 -179.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.641 HG12 ' HE2' ' A' ' 105' ' ' TYR . 13.4 p -149.43 150.66 13.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.787 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.417 ' HB1' ' HD3' ' A' ' 116' ' ' ARG . . . -58.38 145.81 36.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.846 0.355 . . . . 0.0 111.305 -179.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.409 ' HA3' ' HB2' ' A' ' 116' ' ' ARG . . . 87.92 -61.41 4.05 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.159 -179.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.542 ' NZ ' ' HB2' ' A' ' 109' ' ' ALA . 0.8 OUTLIER -72.23 -68.38 0.47 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.896 0.379 . . . . 0.0 110.603 179.735 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.427 ' HB3' HD22 ' A' ' 61' ' ' LEU . 0.7 OUTLIER -98.91 36.56 1.66 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.607 179.753 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.5 -21.28 36.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.284 -179.746 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 3.6 mpp? -82.13 -31.92 30.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.848 0.356 . . . . 0.0 110.659 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.449 ' HB3' HD13 ' A' ' 61' ' ' LEU . 1.9 mm-40 -84.69 -43.91 13.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.718 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.523 ' HE2' ' HB2' ' A' ' 49' ' ' GLN . 47.5 ttm -55.55 163.47 1.29 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.608 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.735 ' SG ' HG22 ' A' ' 78' ' ' THR . 0.5 OUTLIER -55.72 120.53 7.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.819 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -88.15 8.14 28.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.384 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.467 ' O ' HG23 ' A' ' 78' ' ' THR . 0.0 OUTLIER -117.4 144.71 44.69 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.901 179.884 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.456 ' O ' HG23 ' A' ' 78' ' ' THR . 8.7 m120 -65.59 -176.63 0.36 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.666 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.642 HD11 ' CZ ' ' A' ' 15' ' ' PHE . 28.1 tp -64.98 -43.83 91.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.407 -179.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.46 -31.87 69.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.066 -179.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -86.95 -26.03 24.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.666 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.777 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.7 OUTLIER -58.84 -76.44 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.771 0.32 . . . . 0.0 111.101 -179.762 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 140.27 -22.32 2.75 Favored Glycine 0 N--CA 1.453 -0.18 0 C-N-CA 120.51 -0.853 . . . . 0.0 113.005 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.777 HD22 ' HB2' ' A' ' 15' ' ' PHE . 1.0 OUTLIER -49.01 -42.8 39.26 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.89 0.376 . . . . 0.0 110.914 -179.908 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 45.7 p -71.75 -34.5 69.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.714 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -59.1 -33.47 70.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.6 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.96 179.69 0.5 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.915 179.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.9 mpp_? -93.91 73.34 4.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.572 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 78.63 66.62 1.7 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.232 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.591 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -93.31 24.94 3.59 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.689 0.281 . . . . 0.0 111.524 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.424 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 47.1 mt-10 -80.61 167.81 19.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.793 0.33 . . . . 0.0 110.889 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.721 HD12 ' NH1' ' A' ' 16' ' ' ARG . 2.4 tt -148.41 159.65 6.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.106 0.479 . . . . 0.0 110.86 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.472 ' N ' ' CG1' ' A' ' 88' ' ' ILE . 5.1 mp -78.54 145.15 66.86 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.877 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.76 -23.75 25.86 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.604 2.202 . . . . 0.0 112.441 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.15 -40.47 74.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.045 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -69.0 -45.88 69.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.911 0.386 . . . . 0.0 110.844 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.438 ' CE2' ' HB3' ' A' ' 38' ' ' TYR . 7.6 t80 -56.09 -53.13 60.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.609 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.411 ' OE2' ' NH1' ' A' ' 48' ' ' ARG . 0.0 OUTLIER -68.2 -23.34 64.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.675 179.689 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.21 -50.2 74.59 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 121.246 0.546 . . . . 0.0 109.55 179.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.452 HG21 HD11 ' A' ' 52' ' ' LEU . 17.5 mm -74.41 -35.26 38.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.384 179.114 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.44 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 9.7 t-105 -53.12 -40.14 63.97 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.953 179.246 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.645 ' HG3' HD13 ' A' ' 103' ' ' ILE . 10.2 tt0 -85.69 -26.97 25.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.748 179.225 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.84 -45.75 82.18 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.131 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 40.6 t -91.24 -79.22 0.37 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.039 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 179.18 36.95 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.686 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.469 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -59.9 -57.81 17.43 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.344 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.846 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.7 mp -53.03 -34.9 21.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.797 0.332 . . . . 0.0 111.233 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.04 -43.36 82.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.022 0.439 . . . . 0.0 110.29 179.492 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.641 ' HE2' HG12 ' A' ' 62' ' ' VAL . 92.7 t80 -67.97 -38.89 83.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.493 179.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.904 ' CD1' HD13 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -70.63 -50.85 32.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.856 179.96 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.419 ' HA ' ' HB ' ' A' ' 110' ' ' ILE . 0.0 OUTLIER -59.97 -29.48 68.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.811 -179.941 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . 0.409 ' N ' ' HG3' ' A' ' 107' ' ' GLN . 37.1 p -69.86 -50.49 42.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.554 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.542 ' HB2' ' NZ ' ' A' ' 65' ' ' LYS . . . -71.54 -30.24 65.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.534 0.683 . . . . 0.0 109.516 178.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.744 HD11 HD22 ' A' ' 106' ' ' LEU . 15.9 mt -61.21 -49.33 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.229 179.075 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -66.07 -37.96 87.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.43 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 63.8 m -82.17 -4.94 58.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.959 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? 63.91 64.05 0.79 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.071 0.462 . . . . 0.0 111.07 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -151.59 25.09 0.68 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.52 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -104.89 -9.87 17.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.506 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.417 ' HD3' ' HB1' ' A' ' 63' ' ' ALA . 22.5 ttt180 65.13 86.33 0.14 Allowed Pre-proline 0 C--N 1.332 -0.167 0 CA-C-O 120.799 0.333 . . . . 0.0 110.919 -179.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -50.35 99.53 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.568 2.178 . . . . 0.0 112.164 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.41 -45.22 1.22 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.957 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.445 ' CE2' ' HG3' ' A' ' 12' ' ' GLN . 16.3 t80 -177.66 -52.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.952 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.539 ' HB1' HD11 ' A' ' 106' ' ' LEU . . . -53.94 -39.51 65.96 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.243 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.619 HG22 ' CD2' ' A' ' 106' ' ' LEU . 40.2 p -67.05 -40.89 87.24 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.857 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -66.33 -57.87 6.55 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.096 0.474 . . . . 0.0 110.684 179.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' MET . . . . . 0.583 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -53.1 -29.65 31.84 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.209 179.455 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.904 HD13 ' CD1' ' A' ' 106' ' ' LEU . 0.3 OUTLIER -69.66 -48.69 58.92 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 121.129 0.49 . . . . 0.0 110.03 178.821 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.443 ' HA ' HD12 ' A' ' 128' ' ' LEU . 36.5 mm-40 -50.32 -36.27 31.23 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.065 179.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -83.21 -32.67 26.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.975 178.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.583 HD13 ' CE ' ' A' ' 123' ' ' MET . 0.2 OUTLIER -62.69 -17.56 60.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.453 179.138 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.443 HD12 ' HA ' ' A' ' 125' ' ' GLN . 12.1 mt . . . . . 0 C--N 1.333 -0.139 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.226 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.781 0.324 . . . . 0.0 110.895 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.1 mm100 -80.64 154.38 27.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.077 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.441 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 9.3 mp0 -113.48 107.61 16.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.789 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.501 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -108.15 127.62 53.98 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.902 0.382 . . . . 0.0 111.039 -179.642 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.507 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 1.4 m-85 -114.09 151.14 32.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.389 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.889 ' HB2' HD22 ' A' ' 80' ' ' LEU . 9.0 m-85 -150.24 157.72 43.39 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.185 0.517 . . . . 0.0 112.062 -179.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.643 ' CB ' HG21 ' A' ' 88' ' ' ILE . 34.3 ttp180 -149.21 149.66 31.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.835 179.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.525 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -151.47 115.77 3.1 Favored Pre-proline 0 C--N 1.33 -0.272 0 C-N-CA 121.066 -0.254 . . . . 0.0 111.284 -179.858 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.416 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 89.8 Cg_endo -82.85 85.24 1.62 Allowed 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.725 2.284 . . . . 0.0 112.301 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.444 ' CE2' ' HB2' ' A' ' 37' ' ' TRP . 9.0 p90 -103.91 140.47 37.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.998 0.427 . . . . 0.0 110.729 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.629 HG21 ' HB2' ' A' ' 32' ' ' LYS . 17.4 mt -91.47 141.5 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.2 -179.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.7 135.91 86.52 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.586 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.477 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 51.4 Cg_exo -54.52 -55.68 3.12 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.388 2.059 . . . . 0.0 112.949 -179.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.566 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -51.13 -54.96 20.37 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.71 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.538 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 40.7 m-20 -70.88 -31.04 67.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.158 -179.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -52.33 -57.11 10.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.65 -179.474 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.566 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.3 p90 -88.55 -19.14 26.75 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.594 -179.397 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.538 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 1.7 mtpp -56.04 -54.98 38.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.915 0.388 . . . . 0.0 110.801 179.744 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.8 p30 -167.27 144.79 3.92 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.327 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.404 ' HA ' ' HD2' ' A' ' 32' ' ' LYS . 70.6 Cg_endo -73.35 -4.42 15.39 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.709 2.272 . . . . 0.0 112.764 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -98.3 -40.58 8.26 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.856 0.36 . . . . 0.0 110.928 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -109.07 34.3 3.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.803 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.629 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -66.31 -33.22 75.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.08 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.56 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.9 OUTLIER 59.68 108.33 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.78 -179.795 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.418 ' N ' ' HG2' ' A' ' 54' ' ' PRO . 0.2 OUTLIER -88.82 112.93 23.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.565 -179.933 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.438 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -92.67 122.02 6.73 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.621 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.416 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 15.5 m-90 -98.62 121.0 40.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.871 0.367 . . . . 0.0 110.677 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.701 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 21.9 t90 -108.44 117.5 34.32 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.326 -179.429 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.92 ' CE1' HD12 ' A' ' 52' ' ' LEU . 14.2 m-85 -110.98 153.3 25.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.259 179.422 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.625 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -165.79 124.07 1.56 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.131 0.491 . . . . 0.0 111.681 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.507 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 11.7 t-160 -97.65 94.71 7.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.671 179.086 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.755 ' HZ ' HG21 ' A' ' 78' ' ' THR . 13.6 m-85 -78.03 149.19 34.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.472 -179.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.471 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 88.0 m-20 -122.64 110.83 16.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.14 178.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.47 -132.58 50.04 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.051 -1.071 . . . . 0.0 111.152 -178.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.408 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 5.7 Cg_exo -73.64 -18.19 22.62 Favored 'Trans proline' 0 N--CA 1.464 -0.261 0 C-N-CA 122.557 2.171 . . . . 0.0 112.505 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' TRP . . . . . 0.429 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.5 OUTLIER -117.51 -164.76 1.02 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.87 0.366 . . . . 0.0 111.769 -178.492 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.803 HD11 ' O ' ' A' ' 48' ' ' ARG . 3.3 tt -136.66 152.98 29.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.183 -179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.698 ' HB2' HG21 ' A' ' 118' ' ' THR . . . -125.28 -18.9 5.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.071 -179.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.803 ' O ' HD11 ' A' ' 46' ' ' ILE . 8.5 mtt180 -132.79 136.63 46.41 Favored 'General case' 0 N--CA 1.458 -0.07 0 CA-C-O 120.854 0.359 . . . . 0.0 111.406 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.449 ' HB3' ' HB3' ' A' ' 61' ' ' LEU . 0.8 OUTLIER -146.74 118.73 8.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.827 179.824 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.543 ' HE1' ' HB ' ' A' ' 96' ' ' ILE . 16.1 ttp -112.83 118.05 33.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.714 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.426 ' O ' ' HA ' ' A' ' 58' ' ' PRO . 8.8 mt-10 -101.52 118.39 36.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.381 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.92 HD12 ' CE1' ' A' ' 38' ' ' TYR . 13.8 mt -119.27 116.53 26.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.627 179.697 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.443 ' HB2' ' HB2' ' A' ' 56' ' ' LYS . 7.9 m-70 -129.94 130.94 23.2 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.63 0.253 . . . . 0.0 111.004 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.418 ' HG2' ' N ' ' A' ' 34' ' ' LYS . 58.8 Cg_exo -51.65 -24.62 17.98 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.399 2.066 . . . . 0.0 112.391 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.6 p-10 -104.15 -22.94 13.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.205 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.443 ' HB2' ' HB2' ' A' ' 53' ' ' HIS . 0.3 OUTLIER -119.66 127.87 26.19 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.63 -0.259 . . . . 0.0 110.946 179.828 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo -49.71 171.65 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.664 2.243 . . . . 0.0 112.451 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.426 ' HA ' ' O ' ' A' ' 51' ' ' GLU . 27.6 Cg_endo -62.68 77.61 0.11 Allowed 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.605 2.203 . . . . 0.0 112.354 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.403 ' HB ' ' HB2' ' A' ' 51' ' ' GLU . 6.7 mt -56.92 100.37 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 121.088 0.471 . . . . 0.0 110.765 179.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.519 HD21 ' HA2' ' A' ' 102' ' ' GLY . 0.4 OUTLIER -76.43 131.84 39.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.062 -179.694 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.688 HD21 ' HB3' ' A' ' 69' ' ' GLU . 0.3 OUTLIER -132.19 146.66 52.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.72 179.93 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.748 HG21 HD21 ' A' ' 106' ' ' LEU . 13.6 p -150.75 137.16 12.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.224 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.04 167.68 2.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.273 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.25 -66.52 0.72 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.521 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.46 ' HG3' ' HB1' ' A' ' 109' ' ' ALA . 0.1 OUTLIER -70.1 -66.49 0.59 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.925 0.393 . . . . 0.0 110.949 -179.929 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.507 ' HB3' HD13 ' A' ' 61' ' ' LEU . 16.4 t0 -101.59 56.4 0.83 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.945 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.18 -17.43 62.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.592 -179.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 2.4 mtm -77.09 -30.9 55.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.895 0.379 . . . . 0.0 110.748 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.688 ' HB3' HD21 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -98.6 -21.44 16.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.196 179.984 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.3 -176.48 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.169 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.677 ' SG ' HD13 ' A' ' 46' ' ' ILE . 8.1 m -63.61 -47.25 82.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.795 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 70.29 25.35 4.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.112 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.41 ' HB2' HG23 ' A' ' 78' ' ' THR . 0.0 OUTLIER -148.64 154.41 39.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.705 179.833 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -79.54 -170.97 2.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.397 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.866 HD11 ' CZ ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -59.21 -53.1 62.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.252 -179.713 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.75 -44.75 66.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.175 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -54.78 -33.0 60.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.58 -179.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.755 HG21 ' HZ ' ' A' ' 41' ' ' PHE . 0.8 OUTLIER -71.35 -69.3 0.39 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.065 -179.646 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 133.48 -19.65 4.24 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.863 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.889 HD22 ' HB2' ' A' ' 15' ' ' PHE . 1.3 mp -51.85 -34.32 40.14 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.85 0.357 . . . . 0.0 111.025 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.778 ' CG2' HD12 ' A' ' 75' ' ' LEU . 0.2 OUTLIER -77.14 -43.07 35.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.654 179.733 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.409 ' HB3' ' NH1' ' A' ' 82' ' ' ARG . 0.1 OUTLIER -60.06 -29.74 68.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.716 179.786 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -168.16 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.889 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.0 77.37 1.24 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.801 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 72.05 68.06 1.7 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.402 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.572 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -96.55 21.16 9.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.691 0.282 . . . . 0.0 111.267 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -86.1 150.18 24.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.924 0.392 . . . . 0.0 111.1 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.643 HG21 ' CB ' ' A' ' 16' ' ' ARG . 1.3 pt -133.67 -179.66 3.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.004 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.921 HD12 ' HB3' ' A' ' 91' ' ' ARG . 0.8 OUTLIER -96.32 141.5 23.22 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.707 179.753 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -66.12 -13.86 41.77 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.577 2.184 . . . . 0.0 112.688 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.921 ' HB3' HD12 ' A' ' 89' ' ' LEU . 2.7 tpm_? -73.39 -49.89 24.77 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.43 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.428 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 0.2 OUTLIER -65.26 -42.93 92.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.968 0.413 . . . . 0.0 110.675 179.824 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -56.54 -53.39 58.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.555 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.27 -19.74 62.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.464 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.428 ' HB2' ' HA ' ' A' ' 92' ' ' GLN . 0.5 OUTLIER -61.25 -50.42 73.14 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.162 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.569 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 19.0 mm -73.72 -33.84 39.27 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.445 179.033 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.446 ' CH2' ' HG ' ' A' ' 60' ' ' LEU . 10.0 t-105 -53.03 -39.45 63.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.242 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -85.89 -30.54 22.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.609 179.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.569 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -58.13 -52.12 66.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.23 -179.882 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 32.4 m -78.29 -71.1 0.45 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.089 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 163.38 40.5 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.638 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.519 ' HA2' HD21 ' A' ' 60' ' ' LEU . . . -60.35 -47.86 89.01 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.37 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.681 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.7 mp -56.55 -34.63 42.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.847 0.356 . . . . 0.0 111.426 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -67.84 -48.69 65.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.836 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -67.73 -41.14 83.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.715 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.789 HD12 HD11 ' A' ' 110' ' ' ILE . 0.2 OUTLIER -67.84 -50.63 55.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.945 179.954 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.41 ' HG3' ' N ' ' A' ' 108' ' ' SER . 0.0 OUTLIER -60.78 -29.54 69.5 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.78 179.801 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . 0.41 ' N ' ' HG3' ' A' ' 107' ' ' GLN . 4.1 m -67.99 -50.81 53.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.604 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.516 ' HB1' ' HB2' ' A' ' 114' ' ' GLN . . . -71.43 -32.33 68.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.413 0.625 . . . . 0.0 109.732 179.021 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.789 HD11 HD12 ' A' ' 106' ' ' LEU . 5.0 mt -56.76 -49.16 79.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.406 179.073 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -69.42 -36.61 76.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.51 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 51.9 m -74.83 -9.29 58.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.282 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 70.86 39.81 1.01 Allowed 'General case' 0 N--CA 1.461 0.079 0 CA-C-O 120.901 0.381 . . . . 0.0 111.033 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . 0.516 ' HB2' ' HB1' ' A' ' 109' ' ' ALA . 13.6 mt-30 -111.74 -28.99 7.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.835 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.452 ' HB1' ' CG2' ' A' ' 121' ' ' THR . . . -58.01 -166.81 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.144 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.593 ' O ' HG22 ' A' ' 118' ' ' THR . 5.1 ttt180 -132.56 93.64 24.25 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.03 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -52.8 89.06 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.61 2.207 . . . . 0.0 112.116 179.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.698 HG21 ' HB2' ' A' ' 47' ' ' ALA . 4.6 t -132.88 -49.67 0.88 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.237 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.441 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 12.1 t80 -163.21 -62.28 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.889 0.376 . . . . 0.0 111.163 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.572 ' HB1' ' NE ' ' A' ' 48' ' ' ARG . . . -53.85 -38.47 64.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.445 -179.59 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.51 HG22 ' CG1' ' A' ' 110' ' ' ILE . 0.9 OUTLIER -67.38 -44.64 78.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.693 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.56 -58.11 8.72 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.156 0.503 . . . . 0.0 110.696 179.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' MET . . . . . 0.759 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -53.56 -29.98 39.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.485 179.512 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.681 HD11 ' HA ' ' A' ' 103' ' ' ILE . 0.2 OUTLIER -66.54 -50.59 62.64 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.037 0.446 . . . . 0.0 109.922 178.863 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -49.77 -37.52 30.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.74 179.19 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -82.73 -31.46 28.45 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.014 178.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.759 HD13 ' CE ' ' A' ' 123' ' ' MET . 0.4 OUTLIER -61.4 -18.81 60.54 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.514 179.21 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.689 ' O ' HD12 ' A' ' 128' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--N 1.333 -0.15 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.066 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.816 0.341 . . . . 0.0 111.069 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -78.97 117.06 19.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.868 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 94.8 mm-40 -84.94 102.66 13.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.899 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.536 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 1.5 mmp_? -119.82 144.0 47.57 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.849 0.357 . . . . 0.0 110.645 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.527 ' CD1' ' N ' ' A' ' 14' ' ' PHE . 0.9 OUTLIER -123.98 134.85 53.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.346 -179.653 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.889 ' HB2' HD22 ' A' ' 80' ' ' LEU . 7.7 m-85 -135.36 152.59 51.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.337 0.589 . . . . 0.0 111.971 -179.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.539 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.4 142.62 25.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.691 179.15 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -145.88 127.27 7.53 Favored Pre-proline 0 C--N 1.328 -0.36 0 C-N-CA 120.709 -0.396 . . . . 0.0 111.983 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.415 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 60.7 Cg_endo -89.64 91.19 0.35 Allowed 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 123.176 2.584 . . . . 0.0 111.97 179.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.407 ' CD1' ' O ' ' A' ' 19' ' ' PHE . 27.1 p90 -111.27 133.96 53.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.983 0.421 . . . . 0.0 111.238 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.683 HG23 ' O ' ' A' ' 33' ' ' LYS . 17.2 mt -89.94 142.78 12.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.763 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 mtt180 -60.08 130.11 88.83 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.215 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.455 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 9.3 Cg_endo -52.75 -50.93 12.35 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.46 2.107 . . . . 0.0 112.497 -179.567 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.54 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -53.98 -58.33 7.7 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.334 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.59 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 10.3 m-20 -66.0 -33.49 75.92 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.97 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -50.66 -54.63 21.48 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.469 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.54 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.4 p90 -95.8 -12.38 25.41 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.841 -179.529 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.59 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 1.6 mtpp -62.17 -48.61 79.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.93 0.395 . . . . 0.0 110.566 179.704 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -160.95 140.91 8.19 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.155 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -73.19 -5.74 17.7 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.621 2.214 . . . . 0.0 112.592 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -108.17 -33.92 7.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.897 0.38 . . . . 0.0 110.605 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -97.82 30.17 3.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.763 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 15.6 mttt -65.43 -59.98 3.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.976 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.683 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.0 OUTLIER 62.83 121.44 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.519 -179.519 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.98 131.46 45.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.045 -179.315 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -103.88 121.64 7.11 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.187 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.432 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 8.0 m-90 -97.81 119.62 36.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.903 0.382 . . . . 0.0 110.758 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.597 ' HZ3' HD11 ' A' ' 80' ' ' LEU . 21.6 t90 -108.68 117.5 34.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.07 -179.633 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.873 ' CE1' HD12 ' A' ' 52' ' ' LEU . 4.5 m-85 -110.76 154.34 24.05 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.266 179.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.826 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.38 123.83 0.69 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.123 0.487 . . . . 0.0 111.554 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.507 ' CG ' ' CE2' ' A' ' 14' ' ' PHE . 9.0 t-160 -95.57 96.05 8.79 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 178.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.803 ' HZ ' HG21 ' A' ' 78' ' ' THR . 7.4 m-85 -75.12 159.49 31.59 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.255 0.55 . . . . 0.0 111.433 -178.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.54 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.6 OUTLIER -133.09 120.35 21.16 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.113 179.003 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 58.39 -137.43 50.09 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 119.881 -1.152 . . . . 0.0 110.96 -178.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.401 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.2 Cg_exo -73.34 -16.23 24.83 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.456 2.104 . . . . 0.0 112.21 179.331 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' TRP . . . . . 0.418 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.8 OUTLIER -119.24 -158.85 0.75 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.344 -178.56 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.826 ' CD1' ' HB1' ' A' ' 39' ' ' ALA . 5.6 tt -130.82 154.84 41.3 Favored 'Isoleucine or valine' 0 C--O 1.231 0.108 0 CA-C-O 121.059 0.457 . . . . 0.0 112.089 -179.439 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -112.29 -35.44 5.6 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.457 -179.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.568 ' O ' HD11 ' A' ' 46' ' ' ILE . 0.0 OUTLIER -150.85 158.25 43.91 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 120.255 -0.578 . . . . 0.0 111.781 -179.392 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.504 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 21.8 pt20 -161.17 159.25 28.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.407 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.479 ' HE3' ' N ' ' A' ' 97' ' ' TRP . 0.0 OUTLIER -134.24 122.7 23.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.436 179.46 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.463 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 2.1 mt-10 -90.09 115.71 27.56 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.838 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.873 HD12 ' CE1' ' A' ' 38' ' ' TYR . 33.1 mt -119.09 101.86 8.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.937 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.418 ' CD2' ' N ' ' A' ' 53' ' ' HIS . 3.2 m-70 -135.11 136.26 24.44 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.565 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.431 ' HG2' ' HB3' ' A' ' 33' ' ' LYS . 10.0 Cg_endo -51.08 -28.65 25.61 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.713 2.276 . . . . 0.0 112.215 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 15.2 p30 -96.41 -26.37 15.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.816 179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -113.1 112.6 49.73 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.77 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -50.01 175.05 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.468 2.112 . . . . 0.0 112.433 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -60.95 79.38 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.616 2.21 . . . . 0.0 112.357 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.463 ' HB ' ' HB2' ' A' ' 51' ' ' GLU . 7.6 mt -77.49 93.32 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.022 0.439 . . . . 0.0 110.502 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.66 HD13 ' HA2' ' A' ' 102' ' ' GLY . 2.8 mt -75.49 107.44 7.63 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.977 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.881 HD13 ' HA ' ' A' ' 70' ' ' MET . 3.8 mt -98.32 153.41 18.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.912 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.689 HG21 HD21 ' A' ' 106' ' ' LEU . 13.7 p -154.78 142.07 12.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.952 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.67 164.66 1.95 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.397 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 66.68 -76.5 0.15 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.417 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.88 -61.79 2.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.977 0.418 . . . . 0.0 110.808 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.483 ' CB ' HD23 ' A' ' 61' ' ' LEU . 7.5 m-20 -108.14 42.83 1.3 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.672 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.61 -17.4 64.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.434 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -76.81 -28.05 55.42 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.803 0.335 . . . . 0.0 110.669 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.857 ' CG ' HD21 ' A' ' 61' ' ' LEU . 4.2 pm0 -109.19 -23.84 11.42 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.249 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.881 ' HA ' HD13 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -50.4 176.55 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.868 0.366 . . . . 0.0 110.981 179.723 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.507 ' HB3' HG21 ' A' ' 46' ' ' ILE . 7.0 t -52.33 -66.7 0.34 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.802 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 72.37 7.12 5.63 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.516 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.47 157.9 18.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.962 0.41 . . . . 0.0 111.045 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -83.04 168.3 17.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.222 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.464 HD11 ' CE2' ' A' ' 15' ' ' PHE . 4.2 mm? -53.91 -53.58 50.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.747 0.308 . . . . 0.0 111.601 -179.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.56 -31.63 68.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.685 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -70.34 -40.8 73.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.462 -179.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.803 HG21 ' HZ ' ' A' ' 41' ' ' PHE . 0.2 OUTLIER -54.8 -76.58 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.306 -179.584 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 143.27 -24.21 2.21 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.508 -0.853 . . . . 0.0 113.007 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.889 HD22 ' HB2' ' A' ' 15' ' ' PHE . 1.0 OUTLIER -53.94 -48.58 70.09 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.06 0.457 . . . . 0.0 110.538 179.875 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.53 -48.32 82.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.614 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.76 -30.11 68.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.635 179.605 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.34 177.35 0.5 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.811 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -87.96 78.28 8.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.826 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 69.27 68.51 1.62 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.372 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -90.84 16.31 9.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.465 0.174 . . . . 0.0 111.463 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -84.03 155.15 22.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.953 0.406 . . . . 0.0 111.186 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.539 HG21 ' HB3' ' A' ' 16' ' ' ARG . 0.8 OUTLIER -136.95 179.04 4.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.964 179.748 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.578 ' H ' HD12 ' A' ' 89' ' ' LEU . 1.8 mp -94.07 137.93 22.79 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.607 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.72 -21.18 62.06 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.437 2.092 . . . . 0.0 112.334 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.12 -39.43 72.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.997 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -70.12 -50.44 40.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.009 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.45 ' CZ ' ' HG2' ' A' ' 50' ' ' MET . 16.7 t80 -54.91 -49.42 71.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.767 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.14 -21.93 61.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.748 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.9 -50.44 72.18 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.2 0.524 . . . . 0.0 109.614 179.131 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.438 ' HB ' ' HE3' ' A' ' 50' ' ' MET . 20.8 mm -77.47 -34.11 20.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.671 179.336 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.508 ' CZ3' HD23 ' A' ' 60' ' ' LEU . 53.0 t-105 -52.96 -40.55 63.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.919 179.353 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.15 -30.16 22.7 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.453 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -56.78 -54.15 49.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.221 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 95.3 m -75.8 -82.06 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.003 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -178.62 35.99 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.515 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.66 ' HA2' HD13 ' A' ' 60' ' ' LEU . . . -67.69 -37.66 89.22 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.607 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.655 ' CD1' HD22 ' A' ' 127' ' ' LEU . 30.9 mm -70.21 -39.41 76.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.855 0.359 . . . . 0.0 111.162 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.7 -42.92 97.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.974 0.416 . . . . 0.0 110.425 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -67.53 -42.99 81.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.717 179.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.856 HD12 HD11 ' A' ' 110' ' ' ILE . 0.2 OUTLIER -66.49 -50.25 63.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.056 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.422 ' HA ' ' HB ' ' A' ' 110' ' ' ILE . 0.0 OUTLIER -60.9 -29.56 69.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.024 -179.962 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . 0.401 ' N ' ' HG3' ' A' ' 107' ' ' GLN . 8.5 t -68.87 -50.49 49.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.76 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.09 -31.1 65.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.351 0.596 . . . . 0.0 109.505 178.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.856 HD11 HD12 ' A' ' 106' ' ' LEU . 10.7 mt -56.96 -48.8 80.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.127 179.136 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -69.53 -39.35 77.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.577 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.39 -12.03 61.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.191 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 73.2 35.83 0.89 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.842 0.353 . . . . 0.0 110.908 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -106.8 -28.91 9.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.661 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.99 -170.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.025 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -140.16 96.21 8.15 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.951 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -45.88 107.09 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.509 2.14 . . . . 0.0 112.276 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.7 p -144.69 -45.82 0.24 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.171 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -174.37 -49.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.916 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.436 ' O ' ' HB2' ' A' ' 124' ' ' LEU . . . -58.14 -39.06 77.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.232 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.473 HG22 ' CD1' ' A' ' 106' ' ' LEU . 40.3 p -68.64 -44.76 73.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.746 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.21 -58.26 9.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.089 0.471 . . . . 0.0 110.427 179.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' MET . . . . . 0.54 ' HE2' ' N ' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -56.19 -29.59 61.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.18 179.22 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.54 ' N ' ' HE2' ' A' ' 123' ' ' MET . 0.0 OUTLIER -67.65 -51.36 50.84 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.003 0.43 . . . . 0.0 109.943 178.956 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 46.6 mm-40 -49.75 -38.39 33.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.067 179.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 -79.63 -34.23 40.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.227 179.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.655 HD22 ' CD1' ' A' ' 103' ' ' ILE . 0.3 OUTLIER -61.49 -18.68 60.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.387 179.065 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.626 ' O ' HD12 ' A' ' 128' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--N 1.333 -0.122 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.873 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.819 0.343 . . . . 0.0 111.004 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 87.8 mm-40 -70.23 146.93 50.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.593 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.9 mp0 -112.82 113.73 25.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.918 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.473 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.7 OUTLIER -126.0 124.09 39.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.051 179.842 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.501 ' CD1' ' N ' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -113.67 134.66 54.6 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.699 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.912 ' HB2' HD22 ' A' ' 80' ' ' LEU . 1.9 m-85 -133.5 160.65 36.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.28 0.562 . . . . 0.0 112.179 -178.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.647 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.4 OUTLIER -149.11 144.09 26.42 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.827 179.625 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.462 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -153.22 117.5 2.81 Favored Pre-proline 0 C--N 1.33 -0.269 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.96 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.489 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 1.2 Cg_endo -83.67 89.27 1.05 Allowed 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 123.057 2.504 . . . . 0.0 111.781 179.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.421 ' CD1' ' O ' ' A' ' 19' ' ' PHE . 20.8 p90 -103.1 136.58 42.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.944 0.402 . . . . 0.0 110.997 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.558 HG12 ' HG3' ' A' ' 34' ' ' LYS . 10.6 mt -84.81 139.67 17.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.072 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.7 mtp180 -60.66 139.06 93.08 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.261 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.461 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 19.5 Cg_endo -58.29 -50.55 9.51 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.409 2.073 . . . . 0.0 112.301 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.531 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -53.84 -58.34 7.6 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.077 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.541 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 45.4 m-20 -66.38 -32.69 74.23 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.983 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.429 ' HB3' ' O ' ' A' ' 22' ' ' PRO . 0.0 OUTLIER -50.37 -52.45 37.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.347 -179.653 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.531 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.9 p90 -98.17 -15.75 19.77 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.972 -179.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.541 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 0.7 OUTLIER -60.92 -46.51 90.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.937 0.398 . . . . 0.0 110.729 179.861 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -161.86 138.44 6.15 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.021 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.29 -7.08 20.57 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.515 2.143 . . . . 0.0 112.729 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -111.26 -29.75 7.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.854 0.359 . . . . 0.0 110.897 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.3 m120 -97.95 29.05 3.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.121 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.437 ' HB3' HG21 ' A' ' 20' ' ' ILE . 17.5 mttt -64.7 -62.32 1.65 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.115 0.484 . . . . 0.0 110.525 179.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.9 mmmt 67.77 100.98 0.05 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.505 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.558 ' HG3' HG12 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -81.87 139.17 34.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.457 -179.467 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.441 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -110.49 130.18 9.71 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.05 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.489 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 22.9 m-90 -97.49 112.85 24.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.054 0.454 . . . . 0.0 110.875 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.732 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 26.9 t90 -101.92 117.47 34.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.01 -179.509 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.89 ' CE1' HD12 ' A' ' 52' ' ' LEU . 1.2 m-85 -114.45 156.04 25.26 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.414 179.319 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.94 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -163.53 123.78 2.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.331 0.586 . . . . 0.0 111.852 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.507 ' HB3' ' CB ' ' A' ' 48' ' ' ARG . 2.4 t-160 -90.71 84.51 5.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.208 -0.906 . . . . 0.0 108.841 178.603 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.703 ' CD2' HD12 ' A' ' 75' ' ' LEU . 13.7 m-85 -71.83 149.83 44.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.836 -178.518 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.432 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.5 OUTLIER -133.03 119.13 19.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.432 -0.804 . . . . 0.0 108.898 178.968 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 62.71 -140.52 46.0 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 119.966 -1.111 . . . . 0.0 110.929 -178.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.406 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 2.6 Cg_exo -75.89 -1.17 11.07 Favored 'Trans proline' 0 CA--C 1.531 0.33 0 C-N-CA 122.691 2.261 . . . . 0.0 112.421 179.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' TRP . . . . . 0.406 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 1.5 m95 -135.5 -158.44 0.87 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.582 -178.374 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.94 ' CD1' ' HB1' ' A' ' 39' ' ' ALA . 4.2 tt -139.31 155.21 25.87 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.099 0 CA-C-O 121.119 0.485 . . . . 0.0 111.861 -179.231 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.447 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -123.85 -24.29 4.48 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.594 -0.73 . . . . 0.0 112.12 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.857 ' O ' HD11 ' A' ' 46' ' ' ILE . 3.2 mtt180 -126.47 133.65 51.14 Favored 'General case' 0 C--O 1.227 -0.099 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.536 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.413 ' NE2' ' HA ' ' A' ' 70' ' ' MET . 0.5 OUTLIER -144.16 137.48 27.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.913 0.387 . . . . 0.0 111.423 -179.943 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.628 ' HE1' ' HB ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -133.62 115.51 14.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.524 179.729 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.414 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.1 OUTLIER -95.46 115.67 27.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.104 -179.73 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.89 HD12 ' CE1' ' A' ' 38' ' ' TYR . 15.1 mt -115.22 101.87 9.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.649 179.684 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.441 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 2.0 m-70 -123.8 133.6 24.74 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.041 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -52.66 -27.33 32.92 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.268 1.979 . . . . 0.0 112.118 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -94.75 -26.92 16.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.936 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.5 mptt -121.2 118.93 29.86 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.999 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.431 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 88.1 Cg_exo -46.09 170.13 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.536 2.157 . . . . 0.0 112.238 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.595 ' O ' HD13 ' A' ' 60' ' ' LEU . 18.0 Cg_endo -58.2 82.22 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.446 2.098 . . . . 0.0 112.3 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.414 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 76.2 mt -61.03 105.36 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.735 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.771 HD11 ' SG ' ' A' ' 100' ' ' CYS . 3.0 mp -81.43 121.38 26.18 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.987 -179.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.605 HD22 ' HB3' ' A' ' 66' ' ' ASP . 73.9 mt -129.4 154.17 47.19 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.076 -179.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.543 ' HB ' HD21 ' A' ' 106' ' ' LEU . 10.6 p -153.51 143.15 14.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.028 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.492 ' N ' ' HE1' ' A' ' 70' ' ' MET . . . -54.44 147.62 13.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.151 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.72 -50.51 2.3 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.568 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.74 -75.68 0.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.833 0.349 . . . . 0.0 110.888 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.605 ' HB3' HD22 ' A' ' 61' ' ' LEU . 0.4 OUTLIER -85.93 56.14 3.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.916 -179.87 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -68.18 -28.7 67.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.204 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.96 -20.71 34.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.235 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -94.78 -50.07 5.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.287 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.492 ' HE1' ' N ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -58.35 -163.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.153 -179.915 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.696 ' SG ' HD13 ' A' ' 46' ' ' ILE . 1.8 m -73.65 114.36 11.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.595 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -103.14 37.76 1.91 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.886 0.374 . . . . 0.0 110.764 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.415 ' HB2' ' HG3' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -147.09 -179.18 6.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.819 179.954 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -94.67 164.21 13.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.683 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.703 HD12 ' CD2' ' A' ' 41' ' ' PHE . 0.6 OUTLIER -54.92 -32.32 61.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.659 -179.573 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.57 -56.06 7.41 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -179.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.415 ' HG3' ' HB2' ' A' ' 73' ' ' LYS . 5.5 pt-20 -77.91 -3.91 44.12 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.689 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -65.34 -53.56 41.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.755 0.312 . . . . 0.0 110.758 179.911 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 117.79 -25.13 8.62 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.7 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.912 HD22 ' HB2' ' A' ' 15' ' ' PHE . 1.2 mt -56.92 -32.24 65.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.747 0.308 . . . . 0.0 111.005 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 5.1 p -80.04 -34.03 38.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.927 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -67.01 -30.5 70.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.876 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.58 -173.96 0.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.808 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.03 74.46 4.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.976 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 69.25 65.57 2.55 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.602 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.495 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -72.58 -10.26 59.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.637 0.256 . . . . 0.0 111.387 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -52.28 148.07 7.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.898 0.38 . . . . 0.0 111.388 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.647 HG21 ' HB3' ' A' ' 16' ' ' ARG . 1.0 OUTLIER -139.8 179.29 2.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.105 179.897 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.476 HD12 ' CB ' ' A' ' 91' ' ' ARG . 0.4 OUTLIER -98.41 150.19 36.48 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.578 179.664 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.51 -29.94 71.14 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.489 2.126 . . . . 0.0 112.349 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.476 ' CB ' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -57.0 -49.69 74.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.472 -179.723 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.516 ' HA ' ' HG2' ' A' ' 95' ' ' GLU . 4.8 mm-40 -64.37 -46.23 84.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.937 0.399 . . . . 0.0 111.637 -179.366 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.467 ' CZ ' ' HG2' ' A' ' 50' ' ' MET . 15.2 t80 -64.72 -43.93 91.84 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.365 -179.547 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -79.6 -30.02 41.34 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -179.053 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.516 ' HG2' ' HA ' ' A' ' 92' ' ' GLN . 11.8 pt-20 -63.91 -46.43 84.83 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 120.129 -0.628 . . . . 0.0 109.799 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.628 ' HB ' ' HE1' ' A' ' 50' ' ' MET . 38.0 mm -71.21 -37.84 67.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 CA-C-O 121.142 0.496 . . . . 0.0 110.018 178.61 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.461 ' CE2' ' HA3' ' A' ' 102' ' ' GLY . 47.5 t-105 -52.48 -39.64 61.41 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.228 179.399 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -85.51 -24.57 27.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.729 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.61 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -56.77 -45.7 81.92 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.291 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' CYS . . . . . 0.771 ' SG ' HD11 ' A' ' 60' ' ' LEU . 2.2 p -88.66 -54.63 4.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.606 -179.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.408 ' O ' ' HG2' ' A' ' 104' ' ' GLN . . . 148.96 45.88 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.584 -0.817 . . . . 0.0 112.556 -179.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.489 ' HA2' HD23 ' A' ' 60' ' ' LEU . . . -71.09 -38.98 63.5 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.932 -0.652 . . . . 0.0 112.387 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.596 HD12 HD22 ' A' ' 127' ' ' LEU . 20.6 mm -62.44 -55.08 26.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.725 0.297 . . . . 0.0 110.951 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 101' ' ' GLY . 0.0 OUTLIER -56.19 -45.06 79.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.561 179.826 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -59.9 -49.36 77.99 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.342 179.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.589 HD12 HD11 ' A' ' 110' ' ' ILE . 0.3 OUTLIER -60.01 -46.19 90.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.798 179.816 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.464 ' HG2' HD23 ' A' ' 124' ' ' LEU . 1.1 mm100 -59.41 -29.63 67.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.032 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.84 -50.67 40.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.933 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.13 -31.29 65.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.456 0.646 . . . . 0.0 109.607 178.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.589 HD11 HD12 ' A' ' 106' ' ' LEU . 12.3 mt -58.69 -48.96 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.363 179.139 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -66.38 -42.44 87.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.321 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.74 -15.72 63.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.011 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 75.54 32.53 0.7 Allowed 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 120.921 0.391 . . . . 0.0 110.977 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -100.32 -26.73 13.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.792 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.585 ' HB1' HG21 ' A' ' 121' ' ' THR . . . -59.11 -162.88 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.041 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.471 ' O ' HG22 ' A' ' 118' ' ' THR . 0.0 OUTLIER -138.31 93.38 11.46 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.219 -179.88 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -51.06 89.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.602 2.201 . . . . 0.0 112.035 179.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.471 HG22 ' O ' ' A' ' 116' ' ' ARG . 9.0 t -138.23 -47.66 0.53 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.414 -179.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.453 ' CE1' ' CE1' ' A' ' 40' ' ' HIS . 14.4 t80 -167.23 -47.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.629 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.451 ' HB1' ' HG3' ' A' ' 48' ' ' ARG . . . -59.97 -52.4 65.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.664 -179.34 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.585 HG21 ' HB1' ' A' ' 115' ' ' ALA . 69.1 p -65.32 -49.12 70.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.718 -179.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.86 -48.39 75.62 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.414 0.626 . . . . 0.0 109.799 179.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' MET . . . . . 0.832 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -58.01 -31.45 66.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.245 -0.888 . . . . 0.0 109.875 178.762 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.493 HD22 HD12 ' A' ' 110' ' ' ILE . 0.1 OUTLIER -66.39 -49.41 66.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.891 178.837 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 63.7 mm-40 -49.99 -40.65 44.97 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.966 179.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -77.95 -32.82 51.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.129 178.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.832 HD13 ' CE ' ' A' ' 123' ' ' MET . 0.2 OUTLIER -63.03 -17.53 62.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.53 179.027 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.476 HD21 HD23 ' A' ' 124' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.15 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.038 -179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.842 0.353 . . . . 0.0 110.804 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -97.67 167.98 10.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.865 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.47 ' HG2' ' CZ ' ' A' ' 119' ' ' TYR . 10.5 mp0 -119.38 108.3 14.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.902 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.54 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -117.58 120.56 38.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.019 -179.739 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.489 ' CD2' ' CG ' ' A' ' 40' ' ' HIS . 0.1 OUTLIER -113.8 148.94 35.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.515 179.897 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.84 ' HB2' HD22 ' A' ' 80' ' ' LEU . 0.2 OUTLIER -152.39 162.8 40.66 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.296 0.569 . . . . 0.0 111.857 179.944 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.695 ' HB3' HG21 ' A' ' 88' ' ' ILE . 7.0 ttp180 -149.26 148.04 29.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.896 179.36 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.492 HG21 ' CD ' ' A' ' 83' ' ' LYS . 0.2 OUTLIER -149.61 124.48 4.8 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 120.72 0.295 . . . . 0.0 111.688 -179.751 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.468 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 67.1 Cg_endo -91.66 97.91 0.21 Allowed 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 123.007 2.471 . . . . 0.0 112.284 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -113.21 143.27 44.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.814 0.34 . . . . 0.0 110.834 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.43 HG12 ' HG2' ' A' ' 34' ' ' LYS . 5.7 mt -85.66 153.02 3.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.372 -179.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -80.25 140.57 52.92 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.671 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.485 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 51.8 Cg_exo -55.34 -47.92 23.43 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.558 2.172 . . . . 0.0 112.844 -179.576 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.54 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -54.94 -58.98 5.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.35 -179.383 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.484 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 1.8 m-20 -67.99 -31.18 70.7 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.552 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.42 -50.39 59.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.573 -179.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.54 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.3 p90 -102.21 -5.29 24.53 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 -179.268 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.484 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 6.0 mtpp -74.41 -39.11 62.85 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.835 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -174.44 140.79 0.74 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.417 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.469 ' HA ' ' HG2' ' A' ' 32' ' ' LYS . 61.4 Cg_endo -72.3 -22.28 22.14 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.671 2.248 . . . . 0.0 112.288 179.627 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -84.63 -36.95 21.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.169 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -94.47 41.6 1.09 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.821 179.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.469 ' HG2' ' HA ' ' A' ' 29' ' ' PRO . 18.2 mmtm -78.08 61.17 2.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.698 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.7 mmtt -46.2 95.5 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.338 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.43 ' HG2' HG12 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -83.89 131.99 34.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.783 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.435 ' HA3' ' CD2' ' A' ' 53' ' ' HIS . . . -115.99 142.51 17.59 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.849 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.468 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 22.0 m-90 -105.82 138.35 42.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.757 0.313 . . . . 0.0 110.732 179.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.621 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 41.7 t90 -123.98 116.83 23.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.791 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.858 ' CE1' HD12 ' A' ' 52' ' ' LEU . 3.1 m-85 -109.73 154.53 22.77 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.413 179.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.582 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -170.21 125.46 0.77 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.154 0.502 . . . . 0.0 112.041 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.489 ' CG ' ' CD2' ' A' ' 14' ' ' PHE . 16.8 t-160 -96.89 96.61 8.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.757 179.016 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.771 ' CZ ' HG21 ' A' ' 78' ' ' THR . 19.5 m-85 -83.91 122.54 28.87 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.579 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.513 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.6 OUTLIER -91.75 111.06 22.43 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 178.289 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.19 -135.6 50.09 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.018 -1.087 . . . . 0.0 110.928 -178.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.404 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 8.1 Cg_exo -72.5 -16.68 27.23 Favored 'Trans proline' 0 N--CA 1.463 -0.278 0 C-N-CA 122.444 2.096 . . . . 0.0 112.317 179.424 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' TRP . . . . . 0.404 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 0.8 OUTLIER -115.08 -170.3 1.73 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.597 -178.696 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.589 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 3.5 tt -133.07 153.65 38.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 121.172 0.51 . . . . 0.0 111.998 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.579 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -129.73 -22.21 2.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.492 -0.777 . . . . 0.0 111.959 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.699 ' NE ' ' HB1' ' A' ' 120' ' ' ALA . 3.5 mtt180 -130.22 142.3 50.57 Favored 'General case' 0 N--CA 1.46 0.04 0 CA-C-O 120.77 0.319 . . . . 0.0 111.167 -179.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.494 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 0.1 OUTLIER -155.88 129.86 8.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.991 0.424 . . . . 0.0 111.175 179.942 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.642 ' SD ' HD11 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -125.47 120.53 31.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.695 179.891 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.491 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -98.53 132.85 43.63 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.071 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.858 HD12 ' CE1' ' A' ' 38' ' ' TYR . 14.1 mt -135.06 101.98 5.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.846 179.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.435 ' CD2' ' HA3' ' A' ' 35' ' ' GLY . 61.3 m170 -126.26 138.26 31.92 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.931 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.407 ' HD3' ' HA2' ' A' ' 35' ' ' GLY . 53.3 Cg_exo -52.26 -23.64 18.62 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.439 2.092 . . . . 0.0 112.341 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -98.58 -27.45 14.01 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.233 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 1.9 mttm -118.49 125.41 27.84 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.053 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.53 177.05 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.522 2.148 . . . . 0.0 112.27 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -59.68 84.97 0.07 OUTLIER 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.642 2.228 . . . . 0.0 112.498 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.693 HG22 HD23 ' A' ' 61' ' ' LEU . 67.1 mt -66.21 98.12 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.003 0.43 . . . . 0.0 110.634 179.64 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.557 HD21 ' C ' ' A' ' 101' ' ' GLY . 0.2 OUTLIER -72.92 107.82 5.51 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.933 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.907 HD11 ' CB ' ' A' ' 69' ' ' GLU . 1.1 mm? -110.15 147.46 33.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.959 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.9 p -156.53 140.51 7.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.936 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.579 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -56.08 170.7 0.3 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.025 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.28 -72.28 0.32 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.325 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.405 ' HG2' ' HB3' ' A' ' 114' ' ' GLN . 0.5 OUTLIER -64.28 -54.0 40.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.824 0.345 . . . . 0.0 110.694 179.839 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.428 ' CB ' HD13 ' A' ' 61' ' ' LEU . 59.7 m-20 -114.19 57.46 0.7 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.867 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -20.19 63.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.212 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -85.58 -43.3 13.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.049 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.907 ' CB ' HD11 ' A' ' 61' ' ' LEU . 3.2 mm-40 -68.41 -39.58 81.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.02 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -48.26 167.66 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.905 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.529 ' SG ' HG22 ' A' ' 78' ' ' THR . 0.9 OUTLIER -56.09 -30.66 62.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.864 0.364 . . . . 0.0 111.083 -179.798 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 75.97 -61.07 0.47 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.059 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.2 mptt -53.45 161.49 0.98 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.189 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.55 ' O ' HG23 ' A' ' 78' ' ' THR . 11.1 m120 -77.59 -172.89 2.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.555 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.542 HD11 ' CZ ' ' A' ' 15' ' ' PHE . 28.0 tp -64.47 -51.97 60.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.558 -179.542 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.16 -31.37 68.82 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.837 0.351 . . . . 0.0 111.383 -179.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -66.95 -37.9 85.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.611 -179.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.771 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 21.0 p -59.41 -74.13 0.07 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.785 0.326 . . . . 0.0 111.122 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 143.03 -17.76 2.34 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.807 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.84 HD22 ' HB2' ' A' ' 15' ' ' PHE . 0.6 OUTLIER -50.49 -41.1 52.84 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.979 0.418 . . . . 0.0 110.756 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -73.94 -26.84 60.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.725 179.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.98 -26.91 57.22 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.975 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.492 ' CD ' HG21 ' A' ' 17' ' ' ILE . 0.3 OUTLIER -70.86 -171.08 0.49 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.115 -179.853 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.6 90.93 4.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.951 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 62.5 68.97 1.44 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.559 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -88.14 -22.0 24.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.779 0.323 . . . . 0.0 111.077 179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -53.92 143.26 21.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.307 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.695 HG21 ' HB3' ' A' ' 16' ' ' ARG . 1.6 pt -130.16 169.66 20.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.127 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.6 ' H ' HD23 ' A' ' 89' ' ' LEU . 0.8 OUTLIER -84.59 147.56 49.65 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.67 179.845 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -66.02 -26.06 51.17 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.558 2.172 . . . . 0.0 112.353 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.6 ' HB2' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -61.16 -54.37 45.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.104 -179.897 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -50.91 71.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.12 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -54.22 -53.07 58.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.713 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.57 -20.8 62.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.502 179.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.15 -50.34 74.05 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.013 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.437 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 20.0 mm -75.4 -33.67 28.23 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.303 178.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.475 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 14.1 t-105 -52.75 -41.07 63.68 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.972 179.281 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.06 -29.0 23.74 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.381 179.188 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.437 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -61.35 -45.92 92.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.207 -179.813 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 44.3 t -88.02 -83.45 0.21 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.976 -179.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.557 ' C ' HD21 ' A' ' 60' ' ' LEU . . . -176.09 34.38 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.63 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.518 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -58.26 -54.89 33.99 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.603 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.869 ' HA ' HD11 ' A' ' 124' ' ' LEU . 1.8 mt -58.33 -34.69 50.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.796 0.331 . . . . 0.0 111.108 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.75 -49.16 74.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.604 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -64.18 -42.52 96.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.432 179.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.939 ' CD1' HD13 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -64.0 -46.31 85.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.693 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.44 ' HG2' HD21 ' A' ' 124' ' ' LEU . 8.1 mm100 -61.49 -29.72 70.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.77 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 37.7 m -68.33 -50.31 54.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.749 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.27 -33.37 69.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.362 0.601 . . . . 0.0 109.518 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.641 HD11 HD22 ' A' ' 106' ' ' LEU . 8.6 mt -56.91 -48.92 80.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.368 179.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -67.86 -38.33 82.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.413 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 1.1 m -78.07 -4.88 49.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.235 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.8 mmt85 65.27 35.88 7.38 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.964 0.411 . . . . 0.0 110.922 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . 0.405 ' HB3' ' HG2' ' A' ' 65' ' ' LYS . 0.0 OUTLIER -111.15 -25.2 9.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.873 179.86 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.482 ' HB1' ' CG2' ' A' ' 121' ' ' THR . . . -56.45 -29.93 62.26 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.161 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 72.05 97.65 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.345 179.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_exo -52.3 87.85 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.746 2.297 . . . . 0.0 111.932 179.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.429 HG21 ' HB1' ' A' ' 47' ' ' ALA . 9.0 t -112.22 -43.48 3.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.106 -179.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.47 ' CZ ' ' HG2' ' A' ' 12' ' ' GLN . 23.0 t80 -178.89 -63.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.035 179.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.699 ' HB1' ' NE ' ' A' ' 48' ' ' ARG . . . -53.67 -36.12 61.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.995 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.502 HG22 ' CG1' ' A' ' 110' ' ' ILE . 0.8 OUTLIER -60.83 -47.09 87.96 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.06 179.467 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -65.79 -46.4 78.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.389 0.614 . . . . 0.0 109.695 178.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' MET . . . . . 0.606 ' HE3' HD12 ' A' ' 127' ' ' LEU . 1.9 tmm? -58.11 -35.81 72.0 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.251 179.087 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.939 HD13 ' CD1' ' A' ' 106' ' ' LEU . 0.6 OUTLIER -67.69 -45.97 73.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.74 178.996 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.747 ' HA ' HD12 ' A' ' 128' ' ' LEU . 60.7 mm-40 -50.52 -38.4 44.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.968 179.092 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -76.77 -34.95 58.0 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.065 179.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.606 HD12 ' HE3' ' A' ' 123' ' ' MET . 1.2 mt -59.3 -21.13 59.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.084 178.659 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.747 HD12 ' HA ' ' A' ' 125' ' ' GLN . 1.8 mt . . . . . 0 C--N 1.332 -0.169 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.93 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 51.5 mtt-85 . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.92 0.39 . . . . 0.0 110.877 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.71 138.16 31.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.874 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.456 ' HG2' ' CZ ' ' A' ' 119' ' ' TYR . 5.7 mp0 -108.08 102.82 11.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.889 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.483 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 2.5 mtp180 -111.92 133.84 53.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.019 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.505 ' CE2' ' CG ' ' A' ' 40' ' ' HIS . 1.2 m-85 -117.7 134.96 54.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.145 179.799 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.809 ' CE1' HD21 ' A' ' 75' ' ' LEU . 1.4 m-85 -136.31 157.23 47.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.251 0.548 . . . . 0.0 112.003 -179.037 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.707 ' HB3' HG21 ' A' ' 88' ' ' ILE . 16.4 ttp180 -149.38 145.89 27.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.785 179.428 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.685 HG21 ' CE ' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -140.84 125.01 10.48 Favored Pre-proline 0 C--N 1.328 -0.327 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.447 -179.72 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -88.19 96.75 0.4 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.009 2.473 . . . . 0.0 112.186 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.407 ' CD1' ' O ' ' A' ' 19' ' ' PHE . 10.9 p90 -120.39 142.61 49.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.912 0.387 . . . . 0.0 111.107 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.524 HG23 ' O ' ' A' ' 33' ' ' LYS . 17.0 mt -87.9 145.41 7.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.935 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.14 129.26 93.92 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.485 179.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.474 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 75.8 Cg_exo -50.04 -48.96 17.59 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.431 2.087 . . . . 0.0 112.659 -179.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.543 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -54.37 -58.24 8.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.439 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.554 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 36.9 m-20 -67.38 -31.77 72.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.913 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -51.61 -55.44 19.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.493 -179.574 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.543 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.0 p90 -93.89 -14.28 26.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.728 -179.43 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.554 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 3.0 mtpp -60.97 -47.25 87.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.952 0.406 . . . . 0.0 110.6 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -164.87 142.35 5.13 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.094 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -70.66 -22.42 27.96 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.735 2.29 . . . . 0.0 112.666 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -95.09 -32.83 12.92 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.789 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 30.5 m120 -101.37 48.14 0.9 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.728 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.01 59.53 0.67 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.795 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.524 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -44.25 146.14 0.7 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.259 179.938 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.26 117.49 34.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.013 -179.486 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -92.17 126.33 8.46 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.228 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 8.6 m-90 -102.16 135.21 44.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.902 0.382 . . . . 0.0 111.01 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.73 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 33.7 t90 -117.01 117.21 29.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.048 -179.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.868 ' CE1' HD12 ' A' ' 52' ' ' LEU . 12.0 m-85 -111.87 150.91 29.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.122 179.434 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.85 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -169.55 125.05 0.84 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.146 0.498 . . . . 0.0 112.042 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.505 ' CG ' ' CE2' ' A' ' 14' ' ' PHE . 14.4 t-160 -91.92 99.56 12.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.649 178.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.74 ' CZ ' HG21 ' A' ' 78' ' ' THR . 36.9 m-85 -85.23 118.87 25.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.776 -179.085 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.493 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.7 OUTLIER -91.59 115.17 27.82 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.28 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 57.78 -135.82 51.38 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 119.967 -1.111 . . . . 0.0 111.107 -178.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -72.38 -18.77 26.05 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.436 2.091 . . . . 0.0 112.353 179.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' TRP . . . . . 0.418 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.6 OUTLIER -114.24 -171.56 1.94 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.969 0.414 . . . . 0.0 111.692 -178.752 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.85 ' CD1' ' HB1' ' A' ' 39' ' ' ALA . 1.7 tt -131.03 148.5 33.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.509 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.613 ' CB ' HG21 ' A' ' 118' ' ' THR . . . -122.92 -20.58 5.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.839 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.749 ' O ' HD11 ' A' ' 46' ' ' ILE . 2.3 mtt180 -129.94 138.38 50.85 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.84 0.352 . . . . 0.0 111.333 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.475 ' HB3' ' HB3' ' A' ' 61' ' ' LEU . 7.2 tt0 -147.96 121.06 8.86 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.908 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 7.3 ttm -121.01 112.76 19.14 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.708 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -94.23 129.76 40.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.14 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.868 HD12 ' CE1' ' A' ' 38' ' ' TYR . 8.5 mt -129.05 112.1 13.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.854 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.8 m-70 -128.52 129.97 23.54 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.774 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.408 ' HB2' ' HG2' ' A' ' 33' ' ' LYS . 86.4 Cg_exo -46.68 -27.11 5.05 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.515 2.143 . . . . 0.0 112.543 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -95.08 -33.97 12.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.946 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.1 mtpt -111.95 120.44 42.03 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.954 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -47.56 174.05 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.598 2.199 . . . . 0.0 112.579 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.463 ' HA ' HD23 ' A' ' 52' ' ' LEU . 48.9 Cg_exo -55.95 85.38 0.04 OUTLIER 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.7 2.266 . . . . 0.0 112.341 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 84.5 mt -64.47 92.14 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.097 0.475 . . . . 0.0 110.737 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.591 HD21 ' N ' ' A' ' 102' ' ' GLY . 0.3 OUTLIER -64.68 132.78 50.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.719 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.96 HD11 ' HB3' ' A' ' 69' ' ' GLU . 0.2 OUTLIER -140.88 150.03 42.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.163 -179.52 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.526 HG12 ' HE2' ' A' ' 105' ' ' TYR . 13.3 p -153.36 148.96 13.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.121 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.558 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -60.26 166.92 2.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.974 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.18 -73.39 0.29 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.393 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -58.95 -57.6 12.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.845 0.355 . . . . 0.0 110.8 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.411 ' HB3' HD21 ' A' ' 61' ' ' LEU . 81.5 m-20 -108.96 48.51 0.86 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.639 179.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.22 -17.88 65.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.422 -179.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 17.9 mmt -82.14 -32.63 29.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.848 0.356 . . . . 0.0 110.563 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.96 ' HB3' HD11 ' A' ' 61' ' ' LEU . 1.2 mp0 -89.24 -40.81 12.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.799 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.434 ' CA ' HD22 ' A' ' 61' ' ' LEU . 32.1 ttm -53.34 162.51 0.74 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.142 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.502 ' SG ' HG22 ' A' ' 78' ' ' THR . 1.7 t -50.08 118.1 2.73 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.941 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -82.98 0.84 42.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.772 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.28 164.56 16.8 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.79 0.329 . . . . 0.0 110.997 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.555 ' O ' HG23 ' A' ' 78' ' ' THR . 7.2 m120 -83.31 -179.84 7.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.974 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.809 HD21 ' CE1' ' A' ' 15' ' ' PHE . 4.3 mt -65.78 -34.24 77.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.444 -179.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.5 -42.11 71.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.087 -178.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -93.87 -3.75 51.25 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.303 0.482 . . . . 0.0 112.303 -178.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.74 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.2 OUTLIER -67.08 -64.11 0.92 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.795 0.331 . . . . 0.0 110.813 179.945 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . 0.405 ' CA ' ' NH1' ' A' ' 82' ' ' ARG . . . 129.82 -15.83 5.63 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.763 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.809 HD22 ' HB2' ' A' ' 15' ' ' PHE . 1.1 mp -68.25 -45.07 74.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.892 0.377 . . . . 0.0 110.892 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.755 HG23 HD22 ' A' ' 75' ' ' LEU . 52.9 p -65.44 -52.16 55.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.174 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.405 ' NH1' ' CA ' ' A' ' 79' ' ' GLY . 0.0 OUTLIER -62.01 -27.59 68.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.961 -179.833 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.685 ' CE ' HG21 ' A' ' 17' ' ' ILE . 0.4 OUTLIER -59.48 -167.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.861 179.83 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.18 73.67 7.17 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.005 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 59.71 65.35 3.47 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.651 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.99 -14.03 62.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.8 0.333 . . . . 0.0 111.492 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.69 143.18 21.13 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.273 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.707 HG21 ' HB3' ' A' ' 16' ' ' ARG . 2.1 pt -127.16 -179.88 3.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.193 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 8.9 mt -81.85 137.96 46.87 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.838 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.5 -51.25 5.43 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.428 2.085 . . . . 0.0 111.986 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.87 -38.26 69.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.19 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -62.33 -52.38 63.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.935 0.398 . . . . 0.0 110.981 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.53 ' HB2' HD11 ' A' ' 88' ' ' ILE . 43.2 t80 -54.27 -53.0 59.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.57 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.404 ' OE2' ' NH1' ' A' ' 48' ' ' ARG . 0.1 OUTLIER -68.8 -21.23 64.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.515 179.436 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.52 -50.64 72.75 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 179.041 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.438 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 17.4 mm -71.96 -32.9 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.351 179.157 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.469 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 19.4 t-105 -55.72 -37.22 68.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.995 179.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.68 -27.92 25.03 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.642 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.438 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.2 OUTLIER -56.58 -54.3 47.51 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.348 -179.541 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 40.9 t -83.54 -80.18 0.19 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.025 -179.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.566 ' C ' HD21 ' A' ' 60' ' ' LEU . . . 178.85 36.48 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.579 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.591 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -54.29 -55.23 27.6 Favored Glycine 0 N--CA 1.453 -0.188 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.418 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.821 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.6 mp -56.69 -40.49 70.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.768 0.318 . . . . 0.0 111.292 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -59.7 -49.03 79.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.571 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.526 ' HE2' HG12 ' A' ' 62' ' ' VAL . 82.9 t80 -61.26 -42.16 98.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.401 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 1.065 HD13 HD13 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -64.92 -41.56 95.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.63 179.705 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -63.11 -32.72 74.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.727 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -67.97 -50.18 57.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.514 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.4 -35.84 78.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.437 0.636 . . . . 0.0 109.456 178.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.637 HD12 HD22 ' A' ' 124' ' ' LEU . 3.8 mt -59.62 -48.87 85.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.357 179.012 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.405 ' HG3' ' N ' ' A' ' 112' ' ' SER . 7.5 pt-20 -67.03 -30.93 71.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.725 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . 0.405 ' N ' ' HG3' ' A' ' 111' ' ' GLU . 23.4 m -86.23 -7.03 58.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.206 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 22.6 mmt85 70.27 29.01 3.75 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.898 0.38 . . . . 0.0 110.88 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 84.1 mm-40 -99.44 -25.18 14.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.587 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.04 -164.93 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.933 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . 0.492 ' O ' HG22 ' A' ' 118' ' ' THR . 5.7 ttt180 -140.48 89.94 10.31 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.102 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . 0.405 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 77.9 Cg_exo -51.31 87.91 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.705 2.27 . . . . 0.0 112.349 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.613 HG21 ' CB ' ' A' ' 47' ' ' ALA . 5.7 t -127.35 -45.03 1.53 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.868 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.456 ' CZ ' ' HG2' ' A' ' 12' ' ' GLN . 27.9 t80 -168.56 -61.66 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.886 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.458 ' O ' ' HG3' ' A' ' 123' ' ' MET . . . -54.09 -37.33 64.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.317 -179.73 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.605 HG22 ' CG1' ' A' ' 110' ' ' ILE . 0.2 OUTLIER -68.33 -41.06 81.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.557 179.961 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -65.53 -56.25 13.39 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.523 179.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' MET . . . . . 0.568 ' HE1' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -55.38 -29.12 57.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.315 179.293 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 1.065 HD13 HD13 ' A' ' 106' ' ' LEU . 0.3 OUTLIER -64.51 -52.4 58.0 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.079 0.466 . . . . 0.0 110.043 179.055 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . 0.753 ' HA ' HD12 ' A' ' 128' ' ' LEU . 34.6 mm-40 -53.09 -42.69 66.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.717 179.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -78.63 -30.63 46.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.666 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.568 HD13 ' HE1' ' A' ' 123' ' ' MET . 1.3 tt -76.02 -7.81 55.53 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.523 179.269 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.753 HD12 ' HA ' ' A' ' 125' ' ' GLN . 7.0 mt . . . . . 0 C--N 1.332 -0.19 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.24 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.876 0.369 . . . . 0.0 111.034 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.8 mm-40 -61.48 152.72 29.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.786 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.402 ' OE1' ' CE1' ' A' ' 40' ' ' HIS . 93.1 mm-40 -123.89 102.71 7.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.907 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.475 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -112.58 123.64 50.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.023 179.977 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.46 ' CD1' ' N ' ' A' ' 14' ' ' PHE . 2.5 m-85 -108.91 134.89 50.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.012 179.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.919 ' HB2' HD22 ' A' ' 80' ' ' LEU . 15.1 m-85 -132.79 148.84 52.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.234 0.54 . . . . 0.0 112.12 -178.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.92 ' HD3' HD12 ' A' ' 88' ' ' ILE . 0.3 OUTLIER -147.2 138.93 24.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.605 179.597 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.668 HG21 ' HG2' ' A' ' 83' ' ' LYS . 0.2 OUTLIER -149.33 123.27 4.63 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-O 120.725 0.298 . . . . 0.0 111.613 -179.582 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.449 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 91.0 Cg_endo -89.16 119.59 0.97 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.016 2.478 . . . . 0.0 111.964 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.432 ' O ' ' N ' ' A' ' 35' ' ' GLY . 11.4 p90 -139.31 154.84 47.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.883 0.373 . . . . 0.0 111.068 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 58.5 mt -105.06 142.19 18.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.769 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -58.76 136.99 86.87 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.47 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.457 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 15.9 Cg_endo -57.46 -46.56 26.79 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.516 2.144 . . . . 0.0 112.585 -179.624 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.523 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -55.44 -58.87 5.97 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.316 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.521 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 2.7 m-20 -66.52 -32.71 74.24 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.684 179.768 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.403 ' HA ' ' HE3' ' A' ' 32' ' ' LYS . 0.4 OUTLIER -50.62 -51.23 50.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.48 -179.696 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.523 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.8 p90 -103.32 -1.64 28.4 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.119 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.521 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 16.0 mtpp -77.89 -40.07 41.13 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.919 -0.313 . . . . 0.0 110.949 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -172.78 143.57 1.18 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.44 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.482 ' HA ' ' HG2' ' A' ' 32' ' ' LYS . 67.8 Cg_endo -73.03 -22.7 19.2 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.807 2.338 . . . . 0.0 112.295 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -83.97 -36.2 23.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.111 179.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -94.38 41.79 1.09 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.995 179.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.482 ' HG2' ' HA ' ' A' ' 29' ' ' PRO . 13.9 mmtm -80.74 59.93 3.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.779 -179.589 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.1 94.6 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.964 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.17 -170.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.979 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 19' ' ' PHE . . . -170.11 108.52 0.29 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.23 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.482 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 18.0 m-90 -97.58 131.57 44.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.846 0.355 . . . . 0.0 110.682 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.727 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 18.3 t90 -121.02 117.5 27.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.22 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.526 ' HE2' HD22 ' A' ' 52' ' ' LEU . 1.8 m-85 -120.2 148.02 44.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.201 179.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.706 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.47 124.64 0.71 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.215 0.531 . . . . 0.0 111.69 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.479 ' HB3' ' CG ' ' A' ' 48' ' ' ARG . 10.9 t-160 -93.22 105.77 17.81 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 178.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.719 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 3.0 m-85 -85.45 134.09 34.07 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.62 -178.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.498 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 4.5 t70 -97.25 120.93 38.51 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 178.501 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 57.31 -138.65 47.62 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 119.767 -1.206 . . . . 0.0 110.889 -178.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.413 ' O ' ' ND2' ' A' ' 74' ' ' ASN . 7.4 Cg_exo -72.26 -18.67 26.55 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.351 2.034 . . . . 0.0 112.089 179.212 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' TRP . . . . . 0.405 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -113.95 -169.34 1.5 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.292 -178.921 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.719 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 8.4 tt -118.34 156.58 20.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 N-CA-C 112.643 0.608 . . . . 0.0 112.643 -179.155 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.436 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -119.78 -36.46 3.3 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.763 -179.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.62 ' O ' HD11 ' A' ' 46' ' ' ILE . 6.4 ptp180 -140.07 153.44 46.76 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 120.501 -0.48 . . . . 0.0 111.406 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.472 ' HG3' ' HB2' ' A' ' 39' ' ' ALA . 30.8 tt0 -146.41 153.62 40.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.289 -179.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.489 ' HB3' ' HE2' ' A' ' 50' ' ' MET . 20.0 ttp -142.16 111.96 6.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.566 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -95.34 126.45 40.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.957 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.526 HD22 ' HE2' ' A' ' 38' ' ' TYR . 1.4 mp -123.41 113.77 19.25 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.775 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.446 ' HB2' ' HB2' ' A' ' 56' ' ' LYS . 0.7 OUTLIER -134.49 135.53 23.93 Favored Pre-proline 0 C--N 1.332 -0.194 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.974 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.56 -28.11 35.34 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.51 2.14 . . . . 0.0 112.319 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -102.31 -19.72 14.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.149 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.446 ' HB2' ' HB2' ' A' ' 53' ' ' HIS . 5.3 mmmt -117.82 122.32 30.76 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.727 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -52.89 164.92 1.38 Allowed 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.531 2.154 . . . . 0.0 112.237 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -57.11 88.57 0.04 OUTLIER 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.641 2.227 . . . . 0.0 112.381 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.2 mt -69.59 94.54 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.147 0.498 . . . . 0.0 110.496 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.594 HD23 ' CZ3' ' A' ' 97' ' ' TRP . 0.8 OUTLIER -84.42 107.36 16.64 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.978 -179.626 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 29.0 mt -107.68 161.0 15.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.94 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.522 HG21 HD21 ' A' ' 106' ' ' LEU . 12.9 p -153.31 139.84 12.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.085 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.53 137.4 48.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.165 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 100.98 -40.46 2.41 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.438 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.441 ' HG3' ' HB1' ' A' ' 109' ' ' ALA . 0.1 OUTLIER -102.87 -32.2 9.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.781 0.324 . . . . 0.0 110.853 -179.909 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -132.0 44.28 2.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.886 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -59.47 -30.56 68.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.911 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 2.4 mtp -84.91 -29.8 24.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.092 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -78.3 -55.74 5.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.962 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.6 ptm -59.81 -178.12 0.07 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.032 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.507 ' SG ' HG22 ' A' ' 78' ' ' THR . 2.2 t -62.29 118.25 7.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.759 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -98.91 6.41 46.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.459 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -102.74 -175.04 2.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.916 0.389 . . . . 0.0 111.114 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . 0.413 ' ND2' ' O ' ' A' ' 44' ' ' PRO . 21.0 t-20 -109.42 160.41 16.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.25 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.823 HD23 HG21 ' A' ' 81' ' ' THR . 0.2 OUTLIER -43.87 -37.4 2.81 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.506 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -70.77 -56.1 7.12 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.838 0.351 . . . . 0.0 111.73 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -71.37 -16.3 62.41 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.6 HG21 ' CE2' ' A' ' 41' ' ' PHE . 0.4 OUTLIER -64.82 -62.15 1.74 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.79 0.329 . . . . 0.0 111.092 -179.524 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 122.0 -26.5 6.44 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.256 -179.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.919 HD22 ' HB2' ' A' ' 15' ' ' PHE . 0.7 OUTLIER -48.92 -42.67 37.96 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.993 0.425 . . . . 0.0 110.649 179.683 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.823 HG21 HD23 ' A' ' 75' ' ' LEU . 39.0 p -70.41 -28.32 64.97 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.372 179.228 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 8.0 mmm-85 -96.25 6.43 48.81 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.019 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.743 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 0.4 OUTLIER -93.81 31.25 1.63 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.695 0.284 . . . . 0.0 111.277 -179.754 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 55.02 72.84 0.45 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.974 0.416 . . . . 0.0 111.263 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.72 65.42 3.56 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.888 -0.673 . . . . 0.0 113.115 179.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.743 ' HB2' ' HB3' ' A' ' 83' ' ' LYS . . . -93.85 32.15 1.5 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.84 0.352 . . . . 0.0 111.009 179.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -86.87 147.36 25.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.975 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.92 HD12 ' HD3' ' A' ' 16' ' ' ARG . 1.5 tt -130.01 159.44 42.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.802 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.733 HD12 ' HB2' ' A' ' 91' ' ' ARG . 0.4 OUTLIER -82.0 146.4 55.39 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.018 -179.908 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -62.51 -26.5 76.25 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.526 2.151 . . . . 0.0 112.508 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.733 ' HB2' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -60.7 -50.5 73.22 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.918 -179.968 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . 0.416 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 12.8 mm-40 -66.4 -41.52 89.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.943 0.401 . . . . 0.0 110.943 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -57.93 -53.75 54.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.739 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.37 -20.86 62.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.48 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.416 ' HB2' ' HA ' ' A' ' 92' ' ' GLN . 1.7 tm-20 -60.14 -50.29 74.27 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 178.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 18.5 mm -73.02 -33.28 42.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.307 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.594 ' CZ3' HD23 ' A' ' 60' ' ' LEU . 4.2 t-105 -54.79 -36.56 65.05 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.881 178.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.679 ' OE1' HD11 ' A' ' 103' ' ' ILE . 1.9 mp0 -85.41 -31.16 23.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.584 179.342 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -56.78 -54.61 44.38 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.584 -179.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' CYS . . . . . 0.464 ' SG ' HD11 ' A' ' 60' ' ' LEU . 42.3 t -82.37 -79.14 0.19 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.032 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 170.34 38.25 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.557 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.516 ' CA ' HD22 ' A' ' 60' ' ' LEU . . . -58.97 -50.77 64.21 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.575 -0.822 . . . . 0.0 112.182 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.818 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.3 mp -56.37 -53.07 44.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.842 0.354 . . . . 0.0 111.092 179.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -56.37 -39.84 73.57 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.994 0.426 . . . . 0.0 110.336 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -65.19 -45.36 85.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.062 179.172 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.906 HD22 HD11 ' A' ' 110' ' ' ILE . 0.4 OUTLIER -62.05 -43.31 99.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.261 179.488 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.513 ' HG2' HD23 ' A' ' 124' ' ' LEU . 1.4 mm-40 -63.31 -29.83 71.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.722 179.679 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 40.4 t -67.64 -50.53 57.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.705 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.441 ' HB1' ' HG3' ' A' ' 65' ' ' LYS . . . -72.81 -35.03 67.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.487 0.66 . . . . 0.0 109.503 178.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.906 HD11 HD22 ' A' ' 106' ' ' LEU . 13.4 mt -57.57 -49.49 80.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.456 179.285 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -72.34 -37.93 68.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.6 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 3.1 m -68.88 -13.39 62.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.073 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 77.26 30.81 0.51 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.902 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -100.75 -29.43 12.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.561 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . 0.61 ' HB1' ' CG2' ' A' ' 121' ' ' THR . . . -80.88 143.05 33.0 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.927 179.863 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -99.51 118.63 61.85 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.795 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.62 88.68 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.529 2.153 . . . . 0.0 112.504 -179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 97.6 m -110.56 -70.3 0.82 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.557 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -147.7 -53.54 0.21 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.745 179.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.453 ' HB2' ' HE ' ' A' ' 48' ' ' ARG . . . -62.78 -44.66 95.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.875 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.61 ' CG2' ' HB1' ' A' ' 115' ' ' ALA . 0.7 OUTLIER -60.72 -49.1 78.85 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.466 179.702 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.8 -48.03 82.48 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.367 0.603 . . . . 0.0 110.153 179.142 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' MET . . . . . 0.596 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -55.57 -38.52 69.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.527 179.309 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.906 HD13 ' CD1' ' A' ' 106' ' ' LEU . 0.2 OUTLIER -65.67 -44.29 86.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.988 179.163 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -50.9 -39.59 54.62 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.924 179.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -81.44 -32.55 32.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.113 179.012 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.596 HD13 ' CE ' ' A' ' 123' ' ' MET . 1.7 tp -60.01 -19.74 54.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.489 179.131 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.4 mt . . . . . 0 C--N 1.332 -0.176 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.032 179.972 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.782 0.325 . . . . 0.0 110.878 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -70.24 130.34 41.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.072 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.462 ' HG3' ' CZ ' ' A' ' 119' ' ' TYR . 69.8 mm-40 -111.79 108.52 17.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.883 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.503 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 13.1 mtp180 -109.8 130.52 55.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.905 0.384 . . . . 0.0 110.915 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . 0.515 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 0.8 OUTLIER -115.67 134.85 54.63 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.996 179.879 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.616 ' HE2' HD21 ' A' ' 75' ' ' LEU . 5.9 m-85 -139.58 155.62 47.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.404 0.621 . . . . 0.0 112.313 -178.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.581 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.4 OUTLIER -149.26 144.86 26.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.519 179.122 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.72 HD11 HD13 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -136.13 125.58 15.94 Favored Pre-proline 0 C--N 1.327 -0.408 0 C-N-CA 120.893 -0.323 . . . . 0.0 111.834 -179.345 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.423 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 73.8 Cg_endo -89.2 96.92 0.34 Allowed 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.928 2.419 . . . . 0.0 111.664 179.337 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -119.17 153.81 34.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.973 0.416 . . . . 0.0 111.269 -179.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.618 HG21 ' HB2' ' A' ' 32' ' ' LYS . 11.2 mt -101.95 140.02 21.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.065 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.9 mtp180 -59.9 133.92 89.75 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.417 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.476 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 50.2 Cg_exo -53.59 -52.05 9.46 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.533 2.155 . . . . 0.0 113.0 -179.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.561 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -53.64 -58.78 5.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.522 -179.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.543 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 3.4 m-20 -67.71 -28.71 67.9 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.88 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.407 ' HB3' ' O ' ' A' ' 22' ' ' PRO . 0.1 OUTLIER -53.09 -57.34 10.73 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.599 -179.405 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.561 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.9 p90 -87.28 -17.19 33.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.562 -179.432 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.543 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -58.53 -53.23 60.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.899 0.381 . . . . 0.0 110.813 179.684 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -159.75 143.75 10.78 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.17 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -73.2 -7.96 21.31 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.604 2.203 . . . . 0.0 112.724 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -110.48 -36.59 5.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.901 0.382 . . . . 0.0 110.873 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -99.59 32.07 2.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.854 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.618 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -74.33 -30.04 61.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.935 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 42.6 mmtt 58.21 100.9 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.979 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.433 ' HG2' HG12 ' A' ' 20' ' ' ILE . 0.2 OUTLIER -85.0 119.79 25.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.917 179.966 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.422 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -105.85 143.79 15.75 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.907 -179.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.423 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 7.3 m-90 -108.99 137.44 46.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.811 0.338 . . . . 0.0 110.907 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.557 ' HZ3' HD21 ' A' ' 80' ' ' LEU . 31.9 t90 -118.79 117.22 28.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.5 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.858 ' CE1' HD12 ' A' ' 52' ' ' LEU . 22.1 m-85 -111.61 149.29 31.69 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.778 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.443 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.37 124.85 0.73 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.088 0.471 . . . . 0.0 111.294 179.815 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.515 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 9.7 t-160 -95.27 103.78 15.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.673 179.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.686 ' CE2' HG21 ' A' ' 78' ' ' THR . 4.4 m-85 -89.58 128.84 36.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.164 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.427 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 7.7 p-10 -96.65 114.43 26.07 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 178.623 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 58.23 -137.34 50.09 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.015 -1.088 . . . . 0.0 111.107 -178.505 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo -71.71 -16.46 29.95 Favored 'Trans proline' 0 CA--C 1.529 0.261 0 C-N-CA 122.503 2.135 . . . . 0.0 112.434 179.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' TRP . . . . . 0.408 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -114.73 -171.76 1.99 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.891 0.377 . . . . 0.0 111.804 -178.574 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.602 ' HB ' ' CD2' ' A' ' 41' ' ' PHE . 6.7 tt -131.24 153.86 39.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.875 -179.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.727 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -132.28 -20.59 2.39 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.811 -0.631 . . . . 0.0 112.317 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.745 ' NE ' ' HB2' ' A' ' 120' ' ' ALA . 4.6 mtm180 -129.03 136.26 50.06 Favored 'General case' 0 C--N 1.334 -0.079 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.052 -179.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.433 ' HB3' ' HB2' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -140.97 122.92 15.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.087 -179.958 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.557 ' SD ' HD11 ' A' ' 52' ' ' LEU . 5.2 ttm -125.07 112.59 16.69 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.7 179.732 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.506 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -95.27 133.29 39.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.099 -179.774 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.858 HD12 ' CE1' ' A' ' 38' ' ' TYR . 30.3 mt -135.13 108.77 7.96 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.735 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.422 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 1.7 m-70 -128.39 135.78 28.08 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 120.699 0.285 . . . . 0.0 111.057 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -54.21 -23.46 29.83 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.534 2.156 . . . . 0.0 112.161 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -104.5 -21.42 13.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.04 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.417 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 1.2 mmmm -119.12 125.17 27.78 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.754 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 56' ' ' LYS . 9.4 Cg_endo -52.75 167.58 0.6 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.49 2.126 . . . . 0.0 112.357 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.469 ' HA ' ' O ' ' A' ' 51' ' ' GLU . 20.0 Cg_endo -60.61 88.4 0.08 OUTLIER 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.718 2.279 . . . . 0.0 112.358 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.506 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 58.3 mt -64.97 105.83 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.814 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.678 HD21 ' N ' ' A' ' 102' ' ' GLY . 0.2 OUTLIER -82.11 122.74 28.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.02 -179.905 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.484 HD13 ' HB3' ' A' ' 69' ' ' GLU . 91.1 mt -134.83 151.25 50.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.93 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.8 p -154.2 148.16 13.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.071 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.727 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -60.39 140.17 57.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.957 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.97 -46.78 1.56 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.381 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.568 ' HG3' ' HB2' ' A' ' 109' ' ' ALA . 0.1 OUTLIER -92.32 -55.91 3.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.876 0.369 . . . . 0.0 110.69 179.835 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.45 ' HB3' HD22 ' A' ' 61' ' ' LEU . 1.6 m-20 -109.74 37.63 2.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.775 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -54.14 -28.71 41.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.048 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -83.42 -28.91 28.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.84 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.484 ' HB3' HD13 ' A' ' 61' ' ' LEU . 1.6 mm-40 -77.45 -51.12 11.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.922 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.52 ' HE1' ' N ' ' A' ' 63' ' ' ALA . 4.1 ptp -50.18 175.87 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.832 0.349 . . . . 0.0 111.179 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.7 ' SG ' HG22 ' A' ' 78' ' ' THR . 0.9 OUTLIER -55.64 -49.21 73.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.049 -179.86 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.423 ' CB ' ' O ' ' A' ' 71' ' ' CYS . 20.1 tt0 83.47 -40.58 0.09 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.345 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.614 ' HB2' HG23 ' A' ' 78' ' ' THR . 4.2 mmtt -56.28 -168.74 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.007 0.432 . . . . 0.0 111.13 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -109.78 -174.99 2.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.969 179.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.616 HD21 ' HE2' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -60.1 -53.96 51.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.708 0.289 . . . . 0.0 111.643 -179.406 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -71.03 -53.39 14.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.812 0.339 . . . . 0.0 111.846 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -49.08 -36.8 19.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.186 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' THR . . . . . 0.7 HG22 ' SG ' ' A' ' 71' ' ' CYS . 0.9 OUTLIER -62.26 -65.86 0.63 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.755 0.312 . . . . 0.0 111.22 -179.569 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 130.43 -5.47 5.92 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.901 -179.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.72 HD13 HD11 ' A' ' 17' ' ' ILE . 3.8 mm? -53.26 -40.32 64.55 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.142 0.496 . . . . 0.0 110.23 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' THR . . . . . 0.452 HG23 HD12 ' A' ' 75' ' ' LEU . 11.4 p -81.05 -33.09 33.74 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.599 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -56.06 -32.26 63.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.558 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.423 ' CD ' ' CG2' ' A' ' 17' ' ' ILE . 1.9 tttp -72.27 179.81 3.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.732 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -96.73 75.25 2.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.893 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 80.42 67.47 1.55 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.631 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.596 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -97.93 20.15 12.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.771 0.32 . . . . 0.0 111.217 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -89.18 151.14 22.34 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.157 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.581 HG21 ' HB3' ' A' ' 16' ' ' ARG . 1.5 pt -133.83 159.44 42.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.11 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.626 ' H ' HD23 ' A' ' 89' ' ' LEU . 0.7 OUTLIER -72.69 151.71 91.32 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.861 179.912 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -72.5 -24.72 18.7 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.765 2.31 . . . . 0.0 112.815 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.549 ' HB3' HD12 ' A' ' 89' ' ' LEU . 0.1 OUTLIER -64.72 -46.78 80.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.75 -179.809 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -67.68 -38.45 83.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.768 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -57.98 -53.23 60.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.817 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -72.28 -21.86 61.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.644 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.26 -50.49 73.82 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.061 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.41 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 17.2 mm -73.0 -33.73 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.168 178.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' TRP . . . . . 0.464 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 10.3 t-105 -53.78 -39.28 65.29 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.097 179.071 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -85.92 -27.2 25.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.8 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.41 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 5.8 mtm180 -56.59 -43.97 80.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.098 -179.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 42.5 t -93.89 -79.61 0.41 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.871 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.528 ' C ' HD21 ' A' ' 60' ' ' LEU . . . 176.12 36.77 0.05 OUTLIER Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.569 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.678 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -59.33 -50.73 64.6 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.391 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.809 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.3 mp -57.66 -50.01 78.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 120.761 0.315 . . . . 0.0 111.13 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -56.29 -44.41 79.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.933 0.397 . . . . 0.0 110.51 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -62.13 -46.29 89.68 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.14 179.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' LEU . . . . . 0.952 HD13 HD13 ' A' ' 124' ' ' LEU . 0.5 OUTLIER -62.02 -40.48 95.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.338 179.486 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.485 ' HG2' HD23 ' A' ' 124' ' ' LEU . 0.1 OUTLIER -64.05 -29.75 70.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.687 179.545 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 35.7 t -69.28 -50.31 48.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.658 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.568 ' HB2' ' HG3' ' A' ' 65' ' ' LYS . . . -72.54 -35.33 68.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.452 0.644 . . . . 0.0 109.567 178.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.824 HD11 HD22 ' A' ' 106' ' ' LEU . 13.1 mt -58.26 -49.4 81.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.426 179.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -72.56 -38.6 67.91 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.597 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 1.7 m -66.6 -15.67 63.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.184 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 77.16 34.97 0.37 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.972 0.415 . . . . 0.0 110.89 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 49.6 mm-40 -107.16 -28.19 10.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.626 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.67 151.25 39.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.029 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -107.38 108.98 62.49 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.95 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' PRO . . . . . 0.433 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 81.8 Cg_exo -46.29 92.18 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.68 2.253 . . . . 0.0 112.699 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.701 HG21 ' HB2' ' A' ' 47' ' ' ALA . 14.2 m -112.72 -55.69 2.49 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.742 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' TYR . . . . . 0.462 ' CZ ' ' HG3' ' A' ' 12' ' ' GLN . 51.0 t80 -166.55 -57.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.909 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.745 ' HB2' ' NE ' ' A' ' 48' ' ' ARG . . . -54.51 -43.08 71.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.054 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . 0.468 HG22 ' CD2' ' A' ' 106' ' ' LEU . 9.2 p -58.41 -49.0 78.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.425 179.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.98 -49.95 75.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.38 0.61 . . . . 0.0 109.6 178.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' MET . . . . . 0.709 ' HE1' HD13 ' A' ' 127' ' ' LEU . 2.2 tmm? -55.95 -30.85 62.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.069 178.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.952 HD13 HD13 ' A' ' 106' ' ' LEU . 0.2 OUTLIER -70.02 -46.52 64.91 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.852 178.979 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 59.6 mm-40 -51.45 -38.65 54.79 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.027 179.142 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -77.82 -36.03 50.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.05 179.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.709 HD13 ' HE1' ' A' ' 123' ' ' MET . 0.4 OUTLIER -61.34 -18.2 57.51 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.408 178.937 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.603 ' O ' HD12 ' A' ' 128' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.162 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.953 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.842 0.353 . . . . 0.0 111.092 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.862 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -54.22 -56.91 13.7 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.703 179.813 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.16 -36.77 78.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.052 179.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.421 ' HA ' ' NE2' ' A' ' 4' ' ' GLN . 5.4 tp60 -56.31 -33.84 65.96 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.334 179.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.1 -57.15 4.15 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.059 179.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.872 HG12 ' HB2' ' A' ' 122' ' ' ALA . 3.6 mp -56.49 -62.27 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.942 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 24.1 t0 48.15 93.53 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.217 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 2.0 mtm -78.78 65.39 3.99 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.61 0.719 . . . . 0.0 110.676 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.5 mttm -146.45 36.88 1.0 Allowed 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.777 -1.101 . . . . 0.0 110.955 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.47 -175.78 3.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.792 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.49 138.43 35.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.784 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.462 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 7.7 mp0 -124.5 115.76 21.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.994 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.473 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 8.1 mmt85 -134.58 130.79 37.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.002 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.519 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 0.2 OUTLIER -121.58 137.61 54.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.133 179.792 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.636 ' CZ ' HD11 ' A' ' 75' ' ' LEU . 0.1 OUTLIER -144.09 167.01 23.39 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.292 0.567 . . . . 0.0 112.007 -179.824 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.452 ' CD ' HG21 ' A' ' 88' ' ' ILE . 7.2 ptm180 -149.09 153.47 37.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.525 178.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -153.47 113.39 2.62 Favored Pre-proline 0 C--N 1.328 -0.365 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.612 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.429 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 75.5 Cg_endo -87.65 98.97 0.45 Allowed 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 123.026 2.484 . . . . 0.0 112.214 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -118.53 141.83 48.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.96 0.409 . . . . 0.0 111.076 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.547 HG21 ' HB2' ' A' ' 32' ' ' LYS . 14.6 mt -87.1 147.41 5.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.217 -179.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.428 ' HD2' ' CE1' ' A' ' 53' ' ' HIS . 5.4 mtt180 -69.17 133.47 89.64 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.985 179.259 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.502 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 12.0 Cg_endo -55.76 -49.27 16.31 Favored 'Trans proline' 0 N--CA 1.464 -0.215 0 C-N-CA 122.524 2.15 . . . . 0.0 112.462 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.553 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -51.17 -58.69 5.48 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.307 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.51 ' HA ' ' CG ' ' A' ' 27' ' ' LYS . 1.2 m-20 -69.68 -30.29 67.91 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.094 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.439 ' HB3' ' HA ' ' A' ' 22' ' ' PRO . 0.0 OUTLIER -53.17 -46.15 68.81 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.668 -179.065 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.553 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.3 p90 -98.85 -36.45 9.78 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -177.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.511 ' HG2' ' O ' ' A' ' 23' ' ' ALA . 6.5 ptmt -60.95 -32.23 71.77 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.537 -0.465 . . . . 0.0 111.303 -178.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.432 ' CB ' ' HB2' ' A' ' 31' ' ' ASN . 43.4 m-20 -155.56 117.13 2.32 Favored Pre-proline 0 C--N 1.329 -0.316 0 C-N-CA 121.014 -0.274 . . . . 0.0 111.426 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -66.69 -24.4 47.76 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.418 2.078 . . . . 0.0 112.187 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.1 mp0 -94.58 -43.17 8.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.636 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.432 ' HB2' ' CB ' ' A' ' 28' ' ' ASP . 27.3 m-80 -88.16 53.96 2.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.439 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.547 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -119.62 70.19 0.85 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.253 -179.563 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.9 mmpt? -40.9 133.27 2.17 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.246 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.52 124.21 41.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.719 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -99.68 129.35 9.87 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.586 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.481 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 21.3 m-90 -102.03 124.79 48.25 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.955 0.407 . . . . 0.0 110.728 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.534 ' HZ3' HD22 ' A' ' 80' ' ' LEU . 82.6 t90 -114.69 117.01 29.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.149 -179.41 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.701 ' CE1' HD12 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -117.84 148.89 41.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.087 179.216 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.653 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -157.31 124.68 5.23 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.126 0.489 . . . . 0.0 111.723 -179.104 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.519 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 9.5 t-160 -97.64 93.38 6.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.066 178.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.641 ' CZ ' HG21 ' A' ' 78' ' ' THR . 21.7 m-85 -77.53 149.36 34.92 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.535 -179.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.485 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 86.8 m-20 -122.83 110.81 15.91 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.08 178.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.535 ' O ' HD23 ' A' ' 75' ' ' LEU . . . 61.9 -134.01 46.54 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 119.921 -1.133 . . . . 0.0 111.074 -178.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.407 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.4 Cg_exo -73.68 -14.65 24.51 Favored 'Trans proline' 0 CA--C 1.53 0.294 0 C-N-CA 122.448 2.099 . . . . 0.0 112.644 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' TRP . . . . . 0.414 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.6 OUTLIER -121.93 -162.89 1.02 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.665 -178.413 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.798 HD11 ' O ' ' A' ' 48' ' ' ARG . 2.2 tt -135.21 154.45 35.85 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.129 0 CA-C-O 121.028 0.442 . . . . 0.0 111.688 -179.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.423 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -126.55 -19.14 4.65 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.267 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.798 ' O ' HD11 ' A' ' 46' ' ' ILE . 7.2 mtm180 -128.73 133.56 48.17 Favored 'General case' 0 C--O 1.23 0.055 0 CA-C-O 120.951 0.405 . . . . 0.0 111.084 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.509 ' HG2' HD12 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -142.08 137.53 31.08 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.924 -179.924 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.488 ' HG3' ' HB2' ' A' ' 38' ' ' TYR . 0.6 OUTLIER -146.82 128.5 15.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.614 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.401 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 2.5 mt-10 -117.36 138.76 51.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.196 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.701 HD12 ' CE1' ' A' ' 38' ' ' TYR . 4.7 mt -135.12 120.77 19.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.055 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.428 ' CE1' ' HD2' ' A' ' 21' ' ' ARG . 0.3 OUTLIER -133.61 131.62 21.37 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.5 179.701 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -48.21 -27.05 8.93 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.639 2.226 . . . . 0.0 112.697 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -106.66 -13.87 15.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.27 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.62 120.97 30.25 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.797 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -49.83 168.21 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.585 2.19 . . . . 0.0 112.506 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -60.32 96.96 0.11 Allowed 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.552 2.168 . . . . 0.0 112.405 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.401 ' HB ' ' HB2' ' A' ' 51' ' ' GLU . 7.8 mt -79.1 96.04 2.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.079 0.466 . . . . 0.0 110.755 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.544 HD23 ' CZ3' ' A' ' 97' ' ' TRP . 1.0 OUTLIER -86.83 116.37 24.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.797 -179.903 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.565 HD13 ' HB3' ' A' ' 69' ' ' GLU . 20.1 mt -119.76 151.89 38.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.952 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.885 HG22 ' CE2' ' A' ' 105' ' ' TYR . 16.1 m -143.42 158.5 17.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.114 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.47 148.22 52.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.126 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.51 -55.6 4.18 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.526 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.476 ' HE2' ' HB2' ' A' ' 109' ' ' ALA . 3.4 mttm -80.28 -67.02 0.81 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.864 0.364 . . . . 0.0 110.871 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -97.24 39.82 1.17 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.819 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.85 -28.63 61.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.016 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -82.88 -27.18 30.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.901 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.565 ' HB3' HD13 ' A' ' 61' ' ' LEU . 0.4 OUTLIER -82.45 -54.39 5.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.102 -179.829 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.0 ptp -56.59 174.32 0.15 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.096 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.83 128.12 35.47 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.989 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.17 43.18 1.41 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.798 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.31 131.45 16.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.801 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -53.96 167.82 0.25 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.017 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.636 HD11 ' CZ ' ' A' ' 15' ' ' PHE . 2.6 mm? -44.04 -53.57 6.2 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.155 -179.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -70.38 -32.03 69.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.966 -179.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -80.09 -11.17 59.79 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.82 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.714 ' CG2' HD21 ' A' ' 80' ' ' LEU . 0.1 OUTLIER -74.41 -67.19 0.65 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.88 0.372 . . . . 0.0 111.054 -179.947 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 124.84 -27.94 5.3 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.287 -179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.714 HD21 ' CG2' ' A' ' 78' ' ' THR . 0.0 OUTLIER -59.55 -35.0 73.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.999 0.428 . . . . 0.0 110.382 179.684 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.439 ' CG2' HD12 ' A' ' 75' ' ' LEU . 0.6 OUTLIER -66.47 -40.97 89.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.56 179.595 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 13.8 mtt180 -67.35 -28.86 68.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.857 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.7 mtpt -55.28 -176.41 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.972 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.44 76.74 5.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.206 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 72.56 66.83 1.97 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.968 179.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -83.83 -17.62 40.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.764 0.316 . . . . 0.0 110.954 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.446 ' HA ' ' O ' ' A' ' 14' ' ' PHE . 0.6 OUTLIER -52.27 160.16 0.84 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 120.932 0.396 . . . . 0.0 111.645 -179.708 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.656 HD12 ' O ' ' A' ' 89' ' ' LEU . 1.5 pp -149.73 -179.72 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.899 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.656 ' O ' HD12 ' A' ' 88' ' ' ILE . 1.2 mp -98.69 148.18 34.2 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.668 179.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -65.64 -22.0 58.4 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.62 2.213 . . . . 0.0 112.443 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.33 -40.32 93.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.046 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -69.85 -45.57 67.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.905 0.383 . . . . 0.0 110.936 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.431 ' CZ ' ' HB3' ' A' ' 48' ' ' ARG . 14.0 t80 -57.38 -51.59 68.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.746 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.03 -22.83 63.06 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.78 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.11 -50.45 71.85 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.123 0.487 . . . . 0.0 109.793 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.467 HG21 HD11 ' A' ' 52' ' ' LEU . 20.6 mm -76.98 -33.97 21.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.757 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.544 ' CZ3' HD23 ' A' ' 60' ' ' LEU . 3.4 t-105 -52.42 -41.13 62.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.997 179.464 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -86.33 -30.55 22.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.633 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.423 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -56.83 -29.88 63.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.341 -179.694 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 16.2 m -107.23 -77.9 0.59 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.201 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 172.85 33.57 0.03 OUTLIER Glycine 0 C--N 1.33 0.243 0 C-N-CA 120.621 -0.799 . . . . 0.0 112.743 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.478 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -60.08 -48.54 85.61 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.636 -0.792 . . . . 0.0 112.311 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.942 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.6 mp -52.86 -42.53 43.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.816 0.341 . . . . 0.0 111.102 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.91 -44.86 96.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.018 0.437 . . . . 0.0 110.282 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.885 ' CE2' HG22 ' A' ' 62' ' ' VAL . 10.6 t80 -62.58 -43.12 99.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.359 179.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.884 ' CD1' HD13 ' A' ' 124' ' ' LEU . 0.5 OUTLIER -66.0 -44.6 84.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.89 179.883 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.57 ' NE2' HD11 ' A' ' 128' ' ' LEU . 1.7 mt-30 -61.11 -29.92 70.05 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.987 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.61 -50.44 30.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.894 -179.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.617 ' HB3' ' HB2' ' A' ' 115' ' ' ALA . . . -72.41 -31.66 65.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.443 0.64 . . . . 0.0 109.746 179.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.754 HD11 HD22 ' A' ' 106' ' ' LEU . 9.3 mt -57.91 -49.01 82.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 CA-C-N 115.063 -0.972 . . . . 0.0 110.448 179.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -70.61 -36.71 73.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.605 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 6.4 p -77.45 -6.61 54.08 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.214 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 27.6 mmt85 67.89 31.54 5.65 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.864 0.364 . . . . 0.0 110.9 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -107.94 -28.85 9.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.665 179.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.617 ' HB2' ' HB3' ' A' ' 109' ' ' ALA . . . -59.12 -21.54 59.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.329 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 65.35 82.09 0.21 Allowed Pre-proline 0 C--N 1.332 -0.171 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.851 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.432 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 1.1 Cg_endo -45.36 97.48 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.854 2.37 . . . . 0.0 112.46 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 19.3 m -117.34 -55.81 2.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.91 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.503 ' HA ' HG23 ' A' ' 6' ' ' ILE . 8.2 t80 -160.32 -52.26 0.05 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.189 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.613 ' HB2' ' HE ' ' A' ' 48' ' ' ARG . . . -56.87 -41.88 78.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.313 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.697 HG22 ' CD2' ' A' ' 106' ' ' LEU . 80.6 p -57.93 -49.25 77.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.559 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.872 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -61.24 -49.02 78.8 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.353 0.597 . . . . 0.0 109.56 178.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -57.49 -32.56 67.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.855 178.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.942 HD11 ' HA ' ' A' ' 103' ' ' ILE . 0.4 OUTLIER -68.6 -46.1 70.22 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.026 179.035 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.696 ' HA ' HD12 ' A' ' 128' ' ' LEU . 82.0 mm-40 -51.47 -39.54 57.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.804 -0.634 . . . . 0.0 109.974 179.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 43.2 m-20 -78.94 -32.1 45.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.292 179.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.2 tp -74.14 -7.34 52.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.925 179.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.696 HD12 ' HA ' ' A' ' 125' ' ' GLN . 38.6 mt -75.34 -25.13 57.52 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.098 -179.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.158 -0.925 . . . . 0.0 111.007 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.774 ' HB1' ' HB2' ' A' ' 4' ' ' GLN . . . . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.883 0.373 . . . . 0.0 110.953 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.928 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -61.3 -64.27 1.0 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.679 179.78 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 3.0 tp60 -53.38 -41.49 65.95 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.727 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.774 ' HB2' ' HB1' ' A' ' 1' ' ' ALA . 3.8 mm-40 -59.76 -32.07 70.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.588 179.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.459 ' HG3' ' HB2' ' A' ' 117' ' ' PRO . 1.5 tp10 -76.41 -50.75 13.35 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.837 179.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.928 HD12 ' O ' ' A' ' 2' ' ' ARG . 3.0 mp -58.67 -63.06 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.407 0.622 . . . . 0.0 109.987 178.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.6 t70 46.75 91.12 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.503 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.449 ' HG2' ' CD2' ' A' ' 119' ' ' TYR . 0.0 OUTLIER -67.02 -80.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.787 179.921 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.2 mmtp 48.11 43.67 18.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.274 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 84.8 mtt-85 -151.34 162.87 40.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.996 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.2 tp60 -76.44 163.67 26.73 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.818 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.5 mp0 -121.43 103.0 8.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.041 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.486 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -116.99 122.09 43.25 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.613 -179.88 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.506 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 2.2 m-85 -108.51 148.71 29.84 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.677 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.571 ' HB2' HD22 ' A' ' 80' ' ' LEU . 1.8 m-85 -146.74 149.57 33.65 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.38 0.609 . . . . 0.0 112.186 -179.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.445 ' HG3' ' CE2' ' A' ' 38' ' ' TYR . 0.1 OUTLIER -148.69 136.67 20.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.132 -0.94 . . . . 0.0 109.229 179.198 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.649 HG23 ' HB1' ' A' ' 86' ' ' ALA . 0.5 OUTLIER -141.67 131.91 12.86 Favored Pre-proline 0 C--N 1.329 -0.305 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -179.252 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -90.52 115.52 0.52 Allowed 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 123.183 2.589 . . . . 0.0 111.722 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.438 ' CD1' ' N ' ' A' ' 19' ' ' PHE . 2.1 p90 -134.08 149.56 51.13 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.89 0.376 . . . . 0.0 110.908 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.581 HG21 ' HB2' ' A' ' 32' ' ' LYS . 12.3 mt -98.77 140.59 18.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.122 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.5 mtp180 -65.01 124.53 86.96 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.296 179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.487 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 86.2 Cg_exo -46.43 -50.36 10.41 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.523 2.149 . . . . 0.0 112.853 -179.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.565 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -50.24 -58.46 5.56 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.118 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.529 ' HA ' ' CG ' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -68.66 -31.37 70.45 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.161 179.838 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.455 ' HB3' ' HA ' ' A' ' 22' ' ' PRO . 0.0 OUTLIER -53.07 -45.48 68.14 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.404 -0.816 . . . . 0.0 112.757 -178.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.565 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.2 p90 -98.08 -36.6 10.04 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -177.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.529 ' CG ' ' HA ' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -59.88 -31.88 70.2 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.353 -179.068 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.443 ' CB ' ' HB2' ' A' ' 31' ' ' ASN . 28.0 m-20 -153.59 125.67 3.84 Favored Pre-proline 0 C--N 1.329 -0.297 0 C-N-CA 120.835 -0.346 . . . . 0.0 111.475 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -72.97 -28.73 12.77 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.487 2.125 . . . . 0.0 112.014 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.4 mm-40 -94.02 -44.04 8.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.449 179.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.443 ' HB2' ' CB ' ' A' ' 28' ' ' ASP . 44.5 m-20 -85.67 55.14 3.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.409 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.581 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -122.33 68.77 0.95 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.089 -179.707 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.5 mmpt? -41.5 135.72 2.0 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.123 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.15 109.84 22.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.856 -179.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.407 ' O ' ' CD1' ' A' ' 19' ' ' PHE . . . -83.76 123.63 6.26 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.332 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 8.1 m-90 -98.13 132.57 43.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.796 0.331 . . . . 0.0 110.784 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.711 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 27.2 t90 -114.06 117.86 32.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.259 -179.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.908 ' CE1' HD12 ' A' ' 52' ' ' LEU . 3.3 m-85 -110.1 149.72 29.63 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.006 179.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.615 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -170.34 124.81 0.73 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.162 0.506 . . . . 0.0 112.132 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.506 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 20.1 t-160 -96.9 99.62 11.17 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.623 178.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.731 ' CZ ' HG21 ' A' ' 78' ' ' THR . 18.3 m-85 -85.65 119.95 26.54 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.497 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.448 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 12.1 p-10 -88.18 110.86 21.03 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.38 -136.29 49.48 Favored Glycine 0 N--CA 1.448 -0.509 0 C-N-CA 119.954 -1.117 . . . . 0.0 110.842 -178.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_exo -72.09 -16.46 28.69 Favored 'Trans proline' 0 CA--C 1.531 0.33 0 C-N-CA 122.407 2.071 . . . . 0.0 112.335 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' TRP . . . . . 0.414 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.8 OUTLIER -115.81 -173.51 2.36 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.773 0.32 . . . . 0.0 111.795 -178.491 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.615 HD12 ' HB1' ' A' ' 39' ' ' ALA . 3.6 tt -131.02 153.04 38.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-O 121.227 0.537 . . . . 0.0 112.211 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.449 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -130.33 -22.6 2.76 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.349 -0.841 . . . . 0.0 111.739 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.576 ' O ' HD11 ' A' ' 46' ' ' ILE . 5.2 ttt180 -127.88 140.3 52.1 Favored 'General case' 0 N--CA 1.461 0.084 0 CA-C-O 120.778 0.323 . . . . 0.0 111.159 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.546 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 18.0 tt0 -153.44 136.39 15.45 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.003 0.43 . . . . 0.0 111.136 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.412 ' HG2' ' CZ3' ' A' ' 97' ' ' TRP . 0.0 OUTLIER -136.61 132.65 35.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.63 179.724 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.483 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 0.3 OUTLIER -119.32 125.91 50.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.815 179.865 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.908 HD12 ' CE1' ' A' ' 38' ' ' TYR . 0.8 OUTLIER -125.54 113.53 17.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.965 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.615 ' CE1' HD12 ' A' ' 59' ' ' ILE . 14.6 m80 -122.23 133.89 24.56 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.703 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -50.69 -24.35 12.87 Favored 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.405 2.07 . . . . 0.0 112.518 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -106.38 -22.15 12.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.244 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 4.9 mmtt -115.18 125.95 28.34 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.985 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -49.49 167.55 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.425 2.083 . . . . 0.0 112.614 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.433 ' HB3' HD23 ' A' ' 52' ' ' LEU . 37.4 Cg_exo -60.89 84.07 0.08 OUTLIER 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.715 2.277 . . . . 0.0 112.418 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.615 HD12 ' CE1' ' A' ' 53' ' ' HIS . 21.5 mt -60.44 106.73 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.679 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.469 ' HG ' ' CH2' ' A' ' 97' ' ' TRP . 0.9 OUTLIER -83.86 117.31 23.22 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.949 -179.78 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.883 HD11 ' CB ' ' A' ' 69' ' ' GLU . 1.5 mm? -117.14 146.86 42.91 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.786 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.536 HG21 HD21 ' A' ' 106' ' ' LEU . 13.5 p -155.11 156.66 4.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.338 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.449 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -72.66 138.79 46.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.758 179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.4 ' CA ' ' HD3' ' A' ' 116' ' ' ARG . . . 91.21 -62.74 2.82 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.242 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.446 ' HB2' ' HA ' ' A' ' 115' ' ' ALA . 2.2 tmtp? -67.4 -35.16 78.74 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.992 0.425 . . . . 0.0 110.512 179.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.5 ' CB ' HD13 ' A' ' 61' ' ' LEU . 71.9 m-20 -134.43 58.23 1.78 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.776 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -66.91 -21.6 65.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.35 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -85.34 -38.79 18.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.838 0.352 . . . . 0.0 110.871 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.883 ' CB ' HD11 ' A' ' 61' ' ' LEU . 0.3 OUTLIER -80.13 -33.82 38.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.896 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -48.66 170.09 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.021 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.622 ' SG ' HG22 ' A' ' 78' ' ' THR . 9.3 t -64.47 -40.75 96.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.184 -179.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 77.09 -66.44 0.24 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.947 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.43 171.7 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.314 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -96.78 -169.67 1.92 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.668 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.716 ' HB3' HG21 ' A' ' 81' ' ' THR . 64.9 mt -66.28 -44.75 82.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.585 -179.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -70.06 -31.21 68.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.462 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -85.31 -24.35 27.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.613 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.731 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.7 OUTLIER -63.81 -77.04 0.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.758 0.313 . . . . 0.0 111.196 -179.781 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.402 ' HA2' ' CG ' ' A' ' 82' ' ' ARG . . . 140.49 -18.17 2.85 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.55 -0.833 . . . . 0.0 113.104 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.711 HD21 ' CZ3' ' A' ' 37' ' ' TRP . 0.6 OUTLIER -65.82 -51.21 60.86 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.929 0.395 . . . . 0.0 110.828 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.716 HG21 ' HB3' ' A' ' 75' ' ' LEU . 54.8 p -56.02 -52.69 63.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.153 -179.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.402 ' CG ' ' HA2' ' A' ' 79' ' ' GLY . 1.4 ppt_? -62.29 -27.71 69.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.67 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 10.7 tttt -59.95 -168.56 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.796 179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -90.91 77.79 6.12 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.536 179.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 55.04 69.12 1.36 Allowed Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.327 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.649 ' HB1' HG23 ' A' ' 17' ' ' ILE . . . -89.6 22.54 2.97 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.98 179.51 4.91 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.761 0.315 . . . . 0.0 110.721 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.511 HG22 ' CA ' ' A' ' 15' ' ' PHE . 3.8 tt -159.58 159.07 2.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.074 0.464 . . . . 0.0 111.103 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.572 ' H ' HD12 ' A' ' 89' ' ' LEU . 4.2 mp -73.42 146.41 86.37 Favored Pre-proline 0 C--N 1.325 -0.488 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.811 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.5 -30.8 14.62 Favored 'Trans proline' 0 C--N 1.345 0.358 0 C-N-CA 122.533 2.155 . . . . 0.0 112.309 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.71 -38.48 73.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.935 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -69.23 -48.28 62.36 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.845 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.404 ' CZ ' ' CG ' ' A' ' 50' ' ' MET . 14.2 t80 -55.23 -52.97 61.67 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.549 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.5 -22.68 64.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.478 179.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -50.37 73.97 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.172 0.511 . . . . 0.0 109.687 179.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.41 ' HB ' ' CE ' ' A' ' 50' ' ' MET . 18.2 mm -71.47 -32.96 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.323 179.24 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.469 ' CH2' ' HG ' ' A' ' 60' ' ' LEU . 16.9 t-105 -57.69 -36.74 72.35 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.752 178.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.623 ' HG3' HD11 ' A' ' 103' ' ' ILE . 1.0 OUTLIER -85.11 -25.69 27.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.227 179.136 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 25.0 ttt85 -61.56 -53.62 53.98 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.272 -179.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -81.2 -84.66 0.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.084 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -173.44 36.39 0.13 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.444 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.463 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -54.31 -61.3 7.35 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.538 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.904 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.1 mp -55.31 -46.31 78.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.695 0.283 . . . . 0.0 111.681 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -58.99 -49.26 78.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.941 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.426 ' HB3' HD23 ' A' ' 60' ' ' LEU . 54.4 t80 -60.76 -50.91 71.55 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.411 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.588 HD12 HD11 ' A' ' 110' ' ' ILE . 0.3 OUTLIER -57.65 -44.79 85.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.787 179.695 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.402 ' HG2' ' CD2' ' A' ' 124' ' ' LEU . 1.8 mm100 -61.43 -29.93 70.25 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.844 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 32.6 t -68.31 -50.67 51.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.968 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.444 ' HB1' ' HB2' ' A' ' 114' ' ' GLN . . . -75.13 -32.37 61.33 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.307 0.575 . . . . 0.0 109.784 179.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.655 HD11 ' HA ' ' A' ' 121' ' ' THR . 7.0 mt -57.71 -48.68 82.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.264 179.353 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -72.42 -36.06 68.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.72 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.5 -8.31 56.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.327 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 15.6 mmt85 72.0 46.6 0.34 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.005 0.431 . . . . 0.0 110.958 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . 0.444 ' HB2' ' HB1' ' A' ' 109' ' ' ALA . 9.2 mm-40 -122.37 -40.41 2.48 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.67 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.446 ' HA ' ' HB2' ' A' ' 65' ' ' LYS . . . -59.3 -19.88 49.9 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.413 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.4 ' HD3' ' CA ' ' A' ' 64' ' ' GLY . 26.8 mtp180 62.96 118.1 0.02 OUTLIER Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.577 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.459 ' HB2' ' HG3' ' A' ' 5' ' ' GLU . 72.3 Cg_exo -49.22 90.9 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.409 2.073 . . . . 0.0 112.625 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 10.8 t -119.35 -165.07 1.11 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.513 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.449 ' CD2' ' HG2' ' A' ' 8' ' ' MET . 13.9 t80 -64.45 -47.62 78.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.733 0.302 . . . . 0.0 110.778 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -60.06 -52.08 66.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.273 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.655 ' HA ' HD11 ' A' ' 110' ' ' ILE . 80.3 p -57.83 -49.13 77.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.594 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.563 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -57.25 -54.02 51.47 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-O 121.525 0.679 . . . . 0.0 109.721 179.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' MET . . . . . 0.64 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -56.25 -35.41 67.37 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.778 178.663 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.904 HD11 ' HA ' ' A' ' 103' ' ' ILE . 0.3 OUTLIER -65.47 -44.95 85.58 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.825 178.763 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 60.8 mm-40 -49.97 -44.21 50.61 Favored 'General case' 0 N--CA 1.456 -0.143 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.279 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -83.86 -23.71 31.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.782 179.089 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.64 HD13 ' CE ' ' A' ' 123' ' ' MET . 4.4 tp -65.73 -19.68 65.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.743 0.306 . . . . 0.0 110.502 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.582 ' O ' HD12 ' A' ' 128' ' ' LEU . 0.9 OUTLIER -126.54 75.82 1.58 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.133 -179.924 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 8.4 mmtp . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.934 179.951 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.887 ' HB1' ' HB2' ' A' ' 4' ' ' GLN . . . . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.879 0.371 . . . . 0.0 110.978 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.923 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -65.65 -67.16 0.46 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.878 179.936 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -53.68 -42.42 67.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.719 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.887 ' HB2' ' HB1' ' A' ' 1' ' ' ALA . 3.9 mm-40 -59.05 -35.6 73.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.692 179.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.03 -52.29 14.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.255 -0.429 . . . . 0.0 109.919 179.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.923 HD12 ' O ' ' A' ' 2' ' ' ARG . 2.7 mp -58.26 -63.69 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.071 178.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 8.4 t0 44.65 91.08 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.214 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.406 ' HG2' ' CD2' ' A' ' 119' ' ' TYR . 0.0 OUTLIER -56.23 -81.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.931 -179.895 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 13.9 mmtt 47.71 44.8 17.94 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.318 179.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -155.01 176.47 12.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.175 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.51 156.73 21.55 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.994 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 67.2 mm-40 -131.22 107.46 9.01 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.027 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.736 ' HD3' HD21 ' A' ' 75' ' ' LEU . 3.0 mtp180 -127.49 139.53 52.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.847 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.515 ' CE2' ' CG ' ' A' ' 40' ' ' HIS . 0.7 OUTLIER -122.47 135.03 54.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.3 -179.652 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.635 ' HB2' HD22 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -138.9 154.93 48.42 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.288 0.566 . . . . 0.0 111.926 -179.218 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.779 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.22 144.16 26.37 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.608 179.525 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.638 HG21 ' HG2' ' A' ' 83' ' ' LYS . 0.5 OUTLIER -148.97 132.17 8.22 Favored Pre-proline 0 C--N 1.329 -0.301 0 C-N-CA 120.851 -0.34 . . . . 0.0 111.784 -179.693 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.475 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 64.6 Cg_endo -91.65 111.54 0.31 Allowed 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 123.11 2.54 . . . . 0.0 112.25 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.0 p90 -131.11 140.74 50.05 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.795 0.331 . . . . 0.0 110.83 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.647 HD11 ' NZ ' ' A' ' 34' ' ' LYS . 9.3 mt -84.7 143.4 11.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.051 -179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.401 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 0.0 OUTLIER -64.77 124.73 87.2 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.5 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.636 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 72.1 Cg_exo -39.5 -55.13 1.68 Allowed 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.956 2.437 . . . . 0.0 112.938 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.681 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -44.83 -58.16 3.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.428 -0.806 . . . . 0.0 111.636 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.486 ' HA ' ' HD3' ' A' ' 27' ' ' LYS . 0.4 OUTLIER -63.73 -34.65 78.35 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.387 -0.824 . . . . 0.0 112.969 -178.907 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.636 ' HG3' ' HA ' ' A' ' 22' ' ' PRO . 0.9 OUTLIER -54.99 -51.29 66.67 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -178.393 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.681 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 0.9 OUTLIER -88.23 -40.52 13.6 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -177.862 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.53 ' HG2' ' O ' ' A' ' 23' ' ' ALA . 12.3 ptmt -58.74 -33.01 69.77 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.716 -178.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -160.52 123.31 1.85 Allowed Pre-proline 0 C--N 1.328 -0.338 0 C-N-CA 120.766 -0.373 . . . . 0.0 111.606 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -73.13 -25.67 15.72 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.571 2.18 . . . . 0.0 112.206 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -93.06 -44.34 8.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.461 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -88.0 54.44 3.09 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.443 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.534 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -123.5 64.64 1.02 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.489 -179.384 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.84 143.01 5.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.618 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.647 ' NZ ' HD11 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -97.06 157.97 15.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.085 0.469 . . . . 0.0 111.592 -179.352 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -130.07 132.23 6.91 Favored Glycine 0 N--CA 1.451 -0.326 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.966 179.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.475 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 22.1 m-90 -97.75 131.09 44.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.879 0.371 . . . . 0.0 111.228 -179.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.585 ' CZ3' HD11 ' A' ' 80' ' ' LEU . 39.2 t90 -115.35 117.65 31.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.085 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.809 ' CE1' HD12 ' A' ' 52' ' ' LEU . 1.6 m-85 -109.91 156.9 19.83 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.055 179.371 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.63 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.37 124.49 0.72 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.126 0.489 . . . . 0.0 111.906 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.515 ' CG ' ' CE2' ' A' ' 14' ' ' PHE . 11.0 t-160 -97.0 92.41 6.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.288 178.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.551 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 8.8 m-85 -74.47 155.76 37.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.077 -179.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.56 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.7 OUTLIER -125.08 110.91 14.72 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.812 -0.811 . . . . 0.0 108.812 178.957 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 59.06 -133.84 52.52 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 119.706 -1.235 . . . . 0.0 110.678 -177.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -72.53 -19.6 24.58 Favored 'Trans proline' 0 CA--C 1.532 0.394 0 C-N-CA 122.359 2.039 . . . . 0.0 112.133 179.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' TRP . . . . . 0.439 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.7 OUTLIER -113.17 -160.12 0.71 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.567 -178.756 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.838 HD11 ' O ' ' A' ' 48' ' ' ARG . 7.6 tt -140.75 155.74 22.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-O 121.084 0.469 . . . . 0.0 111.849 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.418 ' O ' ' HE1' ' A' ' 70' ' ' MET . . . -128.65 -16.08 4.33 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.712 -0.676 . . . . 0.0 112.197 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.838 ' O ' HD11 ' A' ' 46' ' ' ILE . 4.2 mtt180 -137.06 137.86 39.79 Favored 'General case' 0 C--O 1.231 0.085 0 C-N-CA 120.912 -0.315 . . . . 0.0 111.192 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.501 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 19.4 tt0 -151.56 125.7 9.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.255 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.569 ' SD ' HD11 ' A' ' 52' ' ' LEU . 0.8 OUTLIER -125.02 111.97 16.0 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.154 179.465 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.43 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 4.2 mt-10 -99.76 132.33 45.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.662 -179.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.809 HD12 ' CE1' ' A' ' 38' ' ' TYR . 3.6 mt -127.17 101.68 6.62 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.254 179.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -125.49 150.04 66.62 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 120.872 0.368 . . . . 0.0 111.332 -179.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -61.69 -31.52 86.31 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.645 2.23 . . . . 0.0 112.198 179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -94.7 -8.65 37.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.177 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.701 ' HB3' HD11 ' A' ' 59' ' ' ILE . 0.1 OUTLIER -136.25 114.45 10.65 Favored Pre-proline 0 C--N 1.331 -0.204 0 CA-C-N 116.687 -0.233 . . . . 0.0 110.785 179.974 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -50.96 -176.57 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.459 2.106 . . . . 0.0 112.311 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -59.15 85.2 0.06 OUTLIER 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 122.416 2.077 . . . . 0.0 112.398 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.701 HD11 ' HB3' ' A' ' 56' ' ' LYS . 87.7 mt -76.03 97.47 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.807 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.504 HD13 ' HA2' ' A' ' 102' ' ' GLY . 4.3 mt -83.74 100.53 10.96 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.487 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.797 HD21 ' HB3' ' A' ' 69' ' ' GLU . 0.3 OUTLIER -95.98 152.57 18.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.346 -179.461 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.556 HG21 HD21 ' A' ' 106' ' ' LEU . 11.5 p -152.56 161.64 2.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.656 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.483 ' N ' HG22 ' A' ' 62' ' ' VAL . . . -78.8 158.58 28.17 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.818 0.342 . . . . 0.0 111.502 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.416 ' HA3' ' HD2' ' A' ' 116' ' ' ARG . . . 70.17 -66.8 0.7 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.459 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.44 ' HB3' HG13 ' A' ' 62' ' ' VAL . 7.5 tptm -62.89 -41.3 99.36 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.836 0.351 . . . . 0.0 110.821 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.427 ' HB3' ' CD1' ' A' ' 61' ' ' LEU . 24.8 m-20 -132.56 56.99 1.81 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.788 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.27 -17.74 62.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.487 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 3.6 mtm -83.12 -30.45 27.91 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.713 0.292 . . . . 0.0 111.147 -179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.797 ' HB3' HD21 ' A' ' 61' ' ' LEU . 6.0 mm-40 -97.88 -23.75 15.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.242 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.418 ' HE1' ' O ' ' A' ' 47' ' ' ALA . 3.1 ttm -57.44 163.79 2.19 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.863 0.364 . . . . 0.0 111.108 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 8.8 t -46.99 -49.76 20.3 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.332 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 77.2 -57.49 0.51 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.987 -179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 8.7 mmtm -55.88 158.84 3.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.018 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -90.81 176.28 6.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.254 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.736 HD21 ' HD3' ' A' ' 13' ' ' ARG . 0.9 OUTLIER -54.75 -51.17 66.52 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.873 0.368 . . . . 0.0 111.56 -179.617 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -31.52 69.21 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.283 -179.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -81.42 -10.15 59.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.752 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.407 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 1.4 p -91.51 -73.96 0.52 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.77 0.319 . . . . 0.0 111.143 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 139.09 -20.91 3.0 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.785 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.707 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 3.8 mt -49.29 -30.04 6.8 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.991 0.424 . . . . 0.0 110.813 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.405 HG23 ' HG ' ' A' ' 75' ' ' LEU . 63.0 p -80.56 -31.92 36.78 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.362 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -94.48 7.87 44.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.046 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.638 ' HG2' HG21 ' A' ' 17' ' ' ILE . 2.2 mptt -92.69 32.05 1.29 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.726 0.298 . . . . 0.0 111.216 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 58.46 63.07 1.79 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.964 0.411 . . . . 0.0 111.053 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 62.76 60.38 7.82 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.627 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.707 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -77.32 -3.65 41.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.65 0.262 . . . . 0.0 111.576 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -51.51 168.13 0.08 Allowed 'General case' 0 CA--C 1.528 0.129 0 CA-C-O 120.839 0.352 . . . . 0.0 111.358 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.779 HG21 ' HB3' ' A' ' 16' ' ' ARG . 1.0 OUTLIER -151.23 179.94 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.151 179.872 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.523 HD12 ' HB3' ' A' ' 91' ' ' ARG . 0.2 OUTLIER -97.82 145.82 30.39 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.717 179.871 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -69.78 -10.48 28.64 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.591 2.194 . . . . 0.0 112.532 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.523 ' HB3' HD12 ' A' ' 89' ' ' LEU . 0.4 OUTLIER -72.05 -51.93 19.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.56 -179.93 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.404 ' N ' ' HG3' ' A' ' 91' ' ' ARG . 0.5 OUTLIER -67.45 -42.91 82.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.039 -179.907 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -56.98 -53.28 59.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.879 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.88 -19.34 61.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.732 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -62.37 -50.52 71.24 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 179.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.466 ' HB ' ' HE1' ' A' ' 50' ' ' MET . 19.3 mm -75.95 -33.79 25.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.59 179.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.483 ' CZ3' ' CD2' ' A' ' 60' ' ' LEU . 12.9 t-105 -52.45 -40.98 62.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.007 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -86.24 -31.56 21.62 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.584 179.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.439 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.1 OUTLIER -57.71 -52.91 63.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.385 -179.637 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 95.0 m -79.77 -82.47 0.11 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.225 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.405 ' C ' HD13 ' A' ' 60' ' ' LEU . . . -178.3 37.89 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.622 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.504 ' HA2' HD13 ' A' ' 60' ' ' LEU . . . -72.02 -41.25 55.1 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.542 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.709 ' HA ' HD11 ' A' ' 124' ' ' LEU . 29.4 mm -64.68 -46.65 91.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 120.799 0.333 . . . . 0.0 110.897 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 -60.17 -49.12 78.89 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.492 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -57.61 -49.11 77.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.286 179.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.874 HD12 HD11 ' A' ' 110' ' ' ILE . 0.2 OUTLIER -59.03 -45.02 91.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.361 179.355 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.425 ' HG2' ' CD2' ' A' ' 124' ' ' LEU . 0.9 OUTLIER -61.14 -29.75 69.97 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.997 179.615 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.36 -50.5 45.67 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.972 -179.531 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.408 ' HB1' ' HB2' ' A' ' 114' ' ' GLN . . . -74.0 -31.72 63.08 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.333 0.587 . . . . 0.0 109.716 179.033 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.874 HD11 HD12 ' A' ' 106' ' ' LEU . 11.7 mt -59.0 -49.23 83.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.517 179.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -72.39 -37.18 68.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.783 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 5.8 m -76.0 -8.33 56.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.358 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 72.11 28.59 2.46 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.806 0.336 . . . . 0.0 110.867 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . 0.413 ' CB ' ' HD3' ' A' ' 65' ' ' LYS . 74.2 mt-30 -98.55 -29.73 12.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.652 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.71 -163.92 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.886 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.416 ' HD2' ' HA3' ' A' ' 64' ' ' GLY . 1.5 tpt180 -133.76 91.74 24.56 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.195 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.516 ' HB3' HG13 ' A' ' 6' ' ' ILE . 75.1 Cg_exo -50.04 90.25 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.578 2.185 . . . . 0.0 111.849 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.479 ' C ' HG23 ' A' ' 6' ' ' ILE . 2.4 p -136.12 -50.46 0.7 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.553 -179.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.406 ' CD2' ' HG2' ' A' ' 8' ' ' MET . 10.1 t80 -162.23 -61.6 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.813 0.339 . . . . 0.0 111.576 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.482 ' O ' ' HB2' ' A' ' 124' ' ' LEU . . . -53.59 -38.59 64.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.558 -179.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.501 HG22 ' CD1' ' A' ' 106' ' ' LEU . 17.7 p -69.3 -35.64 76.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.786 0.327 . . . . 0.0 110.679 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.584 ' HB2' HG21 ' A' ' 6' ' ' ILE . . . -70.22 -55.44 9.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.279 0.562 . . . . 0.0 110.532 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' MET . . . . . 0.503 ' HE1' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -56.44 -29.22 61.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.374 179.207 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.709 HD11 ' HA ' ' A' ' 103' ' ' ILE . 0.3 OUTLIER -69.47 -44.61 70.82 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.095 0.474 . . . . 0.0 109.937 178.96 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.675 ' HA ' HD12 ' A' ' 128' ' ' LEU . 42.5 mm-40 -54.03 -44.84 71.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.584 179.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.07 -30.11 31.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.707 179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.515 ' C ' HD23 ' A' ' 127' ' ' LEU . 1.2 tt -66.61 -16.05 63.9 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.282 179.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.675 HD12 ' HA ' ' A' ' 125' ' ' GLN . 10.0 mt -74.59 -31.12 61.94 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.953 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.918 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.543 ' HB1' ' HB2' ' A' ' 4' ' ' GLN . . . . . . . . 0 N--CA 1.485 1.306 0 CA-C-O 120.844 0.354 . . . . 0.0 111.035 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.93 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -63.99 -66.14 0.58 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.673 179.949 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.33 -40.66 65.02 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.693 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.543 ' HB2' ' HB1' ' A' ' 1' ' ' ALA . 3.5 mm-40 -61.54 -32.68 72.75 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.703 179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -78.4 -50.08 12.37 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.888 179.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.93 HD12 ' O ' ' A' ' 2' ' ' ARG . 2.7 mp -58.9 -64.25 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.054 178.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.3 p30 36.73 31.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.031 -0.986 . . . . 0.0 112.327 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.63 ' H ' HG22 ' A' ' 6' ' ' ILE . 0.0 OUTLIER 46.62 94.53 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.049 0.452 . . . . 0.0 111.226 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -86.17 -77.9 0.29 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.423 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -100.16 -178.31 3.79 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.36 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -69.01 177.6 2.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.921 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.441 ' HG3' ' CZ ' ' A' ' 119' ' ' TYR . 12.5 mm100 -127.74 111.91 14.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.948 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.468 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -116.43 135.51 53.78 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.749 179.882 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.523 ' CD1' ' N ' ' A' ' 14' ' ' PHE . 0.0 OUTLIER -126.85 149.74 49.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.55 -179.524 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.789 ' HB2' HD22 ' A' ' 80' ' ' LEU . 0.2 OUTLIER -154.67 162.46 41.12 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 121.226 0.536 . . . . 0.0 111.653 179.981 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.48 ' CG ' HG21 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.29 154.08 38.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.395 -0.821 . . . . 0.0 109.627 178.843 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -151.93 127.64 5.0 Favored Pre-proline 0 C--N 1.328 -0.361 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.891 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.453 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 75.3 Cg_endo -87.43 94.73 0.46 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.953 2.435 . . . . 0.0 111.981 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.0 p90 -111.76 155.08 24.09 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.87 0.366 . . . . 0.0 110.907 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.589 HG12 ' CG ' ' A' ' 34' ' ' LYS . 1.4 mt -100.0 153.11 4.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.344 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 -82.47 134.9 47.32 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.526 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.592 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 72.9 Cg_exo -39.96 -60.25 0.59 Allowed 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.956 2.438 . . . . 0.0 113.051 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.682 ' HB1' ' HD2' ' A' ' 27' ' ' LYS . . . -46.11 -54.01 9.33 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.826 -179.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.414 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -61.02 -37.53 82.89 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.213 -178.93 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.592 ' HG3' ' HA ' ' A' ' 22' ' ' PRO . 0.9 OUTLIER -55.7 -57.35 12.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.913 0.387 . . . . 0.0 111.805 -178.965 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.627 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.6 p90 -86.47 -9.0 57.14 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.87 -179.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.682 ' HD2' ' HB1' ' A' ' 23' ' ' ALA . 2.9 mtpp -70.25 -44.49 68.4 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.948 0.404 . . . . 0.0 110.366 179.357 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -174.18 138.85 0.7 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.867 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -67.96 -23.44 40.71 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.549 2.166 . . . . 0.0 112.449 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.5 mm100 -95.76 -40.5 9.32 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.005 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -93.73 48.32 1.28 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.962 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.412 ' HD3' ' O ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -110.0 61.88 0.6 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.671 179.785 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.01 135.62 0.88 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.663 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.589 ' CG ' HG12 ' A' ' 20' ' ' ILE . 8.4 mtmt -104.82 141.15 37.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.519 -179.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -112.95 135.75 12.91 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.524 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.453 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 15.6 m-90 -100.47 111.67 23.95 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.929 0.395 . . . . 0.0 110.845 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.607 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 39.0 t90 -95.04 117.66 30.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.808 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.8 ' CE1' HD12 ' A' ' 52' ' ' LEU . 14.5 m-85 -105.58 152.43 23.09 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.372 179.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.665 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -163.43 123.46 2.19 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.267 0.556 . . . . 0.0 111.445 179.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.52 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 3.5 t-160 -99.39 86.89 3.48 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.401 -0.818 . . . . 0.0 108.796 178.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.693 ' CG ' ' HB ' ' A' ' 46' ' ' ILE . 7.6 m-85 -71.81 156.41 39.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.549 -0.751 . . . . 0.0 111.747 -178.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.536 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 4.3 t70 -130.38 118.25 20.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.317 -0.856 . . . . 0.0 108.81 178.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 58.63 -136.46 51.1 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 119.732 -1.223 . . . . 0.0 110.828 -178.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.415 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.4 Cg_exo -73.71 -15.46 24.16 Favored 'Trans proline' 0 CA--C 1.53 0.292 0 C-N-CA 122.495 2.13 . . . . 0.0 112.332 179.425 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' TRP . . . . . 0.415 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 0.8 OUTLIER -119.83 -157.68 0.71 Allowed 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.714 -178.467 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.863 HD11 ' O ' ' A' ' 48' ' ' ARG . 5.8 tt -137.81 156.54 31.96 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.104 0 CA-C-O 121.149 0.5 . . . . 0.0 112.094 -179.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.651 ' CB ' HG21 ' A' ' 118' ' ' THR . . . -129.94 -15.15 3.88 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.521 -0.763 . . . . 0.0 112.166 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.863 ' O ' HD11 ' A' ' 46' ' ' ILE . 11.2 mtt180 -136.28 138.64 41.98 Favored 'General case' 0 C--O 1.23 0.053 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.753 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.452 ' OE1' HD12 ' A' ' 61' ' ' LEU . 0.6 OUTLIER -146.43 130.81 17.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.226 -179.735 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.452 ' HE1' ' HB ' ' A' ' 96' ' ' ILE . 0.2 OUTLIER -127.46 112.81 15.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.608 179.821 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.491 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -89.93 118.94 29.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.053 -179.753 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.8 HD12 ' CE1' ' A' ' 38' ' ' TYR . 43.3 mt -120.38 102.73 8.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.806 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -130.82 136.22 28.57 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.914 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -52.25 -25.95 25.41 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.354 2.036 . . . . 0.0 112.28 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.0 p30 -94.87 -28.26 15.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.14 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.3 mttp -119.79 119.5 31.19 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.086 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.453 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 72.6 Cg_exo -48.79 171.0 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.565 2.177 . . . . 0.0 112.121 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.453 ' HD2' ' HB3' ' A' ' 57' ' ' PRO . 19.1 Cg_endo -59.02 83.42 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.462 2.108 . . . . 0.0 112.367 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.594 HG22 ' HG ' ' A' ' 61' ' ' LEU . 63.8 mt -61.39 104.87 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.776 179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.446 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.2 OUTLIER -79.92 100.8 8.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.848 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.594 ' HG ' HG22 ' A' ' 59' ' ' ILE . 84.0 mt -109.51 145.09 36.86 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.735 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.527 HG21 ' HG ' ' A' ' 106' ' ' LEU . 8.5 t -141.66 147.2 22.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.085 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.584 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -59.53 151.74 23.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.01 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.04 -58.87 4.99 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.406 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.531 ' HG3' ' HB1' ' A' ' 109' ' ' ALA . 0.0 OUTLIER -80.12 -31.64 39.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.92 0.39 . . . . 0.0 110.802 179.783 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -123.62 54.13 1.31 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.74 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.38 -30.21 71.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.891 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.24 -40.48 16.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.826 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.407 ' HB3' ' CD2' ' A' ' 61' ' ' LEU . 6.1 mm-40 -73.13 -54.94 7.22 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.902 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.424 ' HE2' ' N ' ' A' ' 49' ' ' GLN . 46.0 ttm -52.24 163.23 0.41 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.842 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 3.0 t -51.39 136.67 24.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.844 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -119.93 47.25 1.77 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.0 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.52 134.21 10.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.015 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 -55.28 164.95 0.82 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.885 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.728 HD11 ' CE1' ' A' ' 15' ' ' PHE . 1.2 tp -50.78 -45.5 59.18 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.721 -179.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.21 -31.79 69.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.602 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.26 -21.58 28.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.699 -179.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.623 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -62.47 -74.51 0.09 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.85 0.357 . . . . 0.0 111.177 -179.805 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 138.67 -25.19 2.85 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.326 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.789 HD22 ' HB2' ' A' ' 15' ' ' PHE . 0.8 OUTLIER -53.5 -36.21 61.47 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.972 0.415 . . . . 0.0 110.661 179.844 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 41.5 p -74.21 -30.64 62.29 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.66 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.3 mmm180 -72.68 -31.95 65.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.609 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.4 mptt -60.9 -168.22 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.812 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.52 73.81 2.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.994 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 72.03 66.38 2.12 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.535 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.0 -10.04 59.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.569 0.223 . . . . 0.0 111.349 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.403 ' HA ' ' O ' ' A' ' 14' ' ' PHE . 8.3 tt0 -52.55 154.7 2.47 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.896 0.379 . . . . 0.0 111.415 -179.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.48 HG21 ' CG ' ' A' ' 16' ' ' ARG . 1.2 pt -144.78 168.28 9.76 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.198 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.57 HD23 ' CD ' ' A' ' 90' ' ' PRO . 2.3 mt -78.81 144.75 64.94 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.554 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . 0.57 ' CD ' HD23 ' A' ' 89' ' ' LEU . 11.5 Cg_exo -69.02 -35.4 14.91 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.369 2.046 . . . . 0.0 111.387 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 6.9 mtm180 -55.35 -54.4 44.14 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.344 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -57.62 -45.18 85.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.279 -179.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.423 ' HD2' HD11 ' A' ' 88' ' ' ILE . 14.0 t80 -55.29 -53.09 60.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.824 -179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.64 -21.15 60.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.825 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.35 -50.77 71.56 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.261 0.553 . . . . 0.0 109.649 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.452 ' HB ' ' HE1' ' A' ' 50' ' ' MET . 16.7 mm -72.9 -34.93 47.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.246 179.032 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.45 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 11.9 t-105 -54.08 -39.08 66.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.142 179.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.519 ' HG3' HD13 ' A' ' 103' ' ' ILE . 1.5 tt0 -85.67 -25.96 26.25 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.604 179.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.445 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -56.36 -54.3 47.18 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.393 -179.759 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 8.3 t -83.68 -67.52 0.78 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.061 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 160.62 40.91 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.563 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.45 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -60.76 -52.93 49.38 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.349 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.787 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.7 mp -53.86 -42.12 51.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.72 0.295 . . . . 0.0 111.136 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.64 -43.9 97.0 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.013 0.435 . . . . 0.0 110.2 179.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -63.88 -40.97 97.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.132 179.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.608 HD13 HD13 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -68.21 -38.52 82.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.659 179.69 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.595 ' CD ' HD22 ' A' ' 128' ' ' LEU . 0.2 OUTLIER -65.58 -30.07 70.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.516 179.607 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.3 m -70.62 -50.05 41.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.342 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.531 ' HB1' ' HG3' ' A' ' 65' ' ' LYS . . . -71.76 -33.5 68.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.33 0.586 . . . . 0.0 109.747 179.051 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.643 ' CD1' HD22 ' A' ' 124' ' ' LEU . 5.1 mt -56.93 -49.18 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.48 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -72.27 -38.08 68.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.598 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 59.0 m -66.39 -15.86 63.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.124 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.0 mmm180 76.81 30.43 0.59 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.892 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 42.2 mm-40 -102.76 -28.69 11.94 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.586 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -63.86 158.09 22.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.046 179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.442 ' O ' HG22 ' A' ' 118' ' ' THR . 2.1 mtt85 -110.15 95.32 21.03 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.782 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.408 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 87.9 Cg_exo -47.91 129.64 18.26 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.72 2.28 . . . . 0.0 112.588 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.837 ' O ' HG23 ' A' ' 6' ' ' ILE . 1.1 t -161.1 -54.38 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.004 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.441 ' CZ ' ' HG3' ' A' ' 12' ' ' GLN . 68.5 t80 -159.59 -62.17 0.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.081 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.509 ' HB1' ' NE ' ' A' ' 48' ' ' ARG . . . -53.99 -44.18 70.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.276 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.449 HG22 ' CG1' ' A' ' 110' ' ' ILE . 0.5 OUTLIER -62.15 -34.89 77.24 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.912 0.387 . . . . 0.0 110.465 179.778 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.85 ' HB2' HD13 ' A' ' 6' ' ' ILE . . . -71.37 -58.7 3.28 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.675 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' MET . . . . . 0.58 ' HE1' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -58.22 -29.41 65.68 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.325 179.397 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.833 HD23 HD23 ' A' ' 128' ' ' LEU . 7.4 tt -68.23 -48.87 63.97 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.146 0.498 . . . . 0.0 109.971 179.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.493 ' HA ' HD21 ' A' ' 128' ' ' LEU . 0.6 OUTLIER -53.15 -36.39 60.78 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.159 179.33 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 18.5 m-20 -86.65 -29.28 22.63 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.536 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.58 HD13 ' HE1' ' A' ' 123' ' ' MET . 1.3 tt -72.83 -10.0 59.3 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.879 179.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.833 HD23 HD23 ' A' ' 124' ' ' LEU . 4.0 pp -111.55 25.51 11.6 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.763 0.316 . . . . 0.0 111.165 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 16.5 mmtp . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.279 -0.867 . . . . 0.0 111.01 179.992 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.798 ' HB3' ' CB ' ' A' ' 4' ' ' GLN . . . . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 120.722 0.296 . . . . 0.0 111.061 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.813 ' O ' HD12 ' A' ' 6' ' ' ILE . 2.3 ttm180 -67.18 -69.05 0.33 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.992 0.425 . . . . 0.0 110.548 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -53.26 -30.76 40.13 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.062 179.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.798 ' CB ' ' HB3' ' A' ' 1' ' ' ALA . 6.0 tp60 -67.17 -39.2 86.43 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.874 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.545 ' HG3' ' N ' ' A' ' 6' ' ' ILE . 6.4 pt-20 -75.19 -43.02 54.42 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.688 0.28 . . . . 0.0 110.764 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.813 HD12 ' O ' ' A' ' 2' ' ' ARG . 3.7 mp -70.93 -58.76 4.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.575 0.702 . . . . 0.0 109.692 178.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.7 t0 43.34 80.06 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 114.515 -1.22 . . . . 0.0 111.376 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 5.2 mtm -64.06 -81.05 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.149 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 51.97 30.45 7.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.052 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.4 mtt85 -138.26 -172.56 3.3 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.916 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.27 158.99 16.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.931 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.424 ' HG3' ' CE2' ' A' ' 119' ' ' TYR . 89.3 mm-40 -130.14 102.9 6.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.806 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.547 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -122.26 127.95 50.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.097 -179.579 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.498 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 0.4 OUTLIER -115.46 151.34 34.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.296 179.772 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.702 ' HB2' HD22 ' A' ' 80' ' ' LEU . 0.8 OUTLIER -151.51 159.09 44.3 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-O 121.289 0.566 . . . . 0.0 112.041 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.724 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.29 145.67 27.17 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.961 179.332 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.565 ' CD1' HD23 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -153.07 124.69 3.71 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.684 0.278 . . . . 0.0 111.745 -179.921 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.471 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 68.3 Cg_endo -89.27 103.61 0.38 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.063 2.509 . . . . 0.0 111.914 179.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 19.2 p90 -116.87 138.25 51.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.957 0.408 . . . . 0.0 111.076 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.489 HG12 ' HG3' ' A' ' 34' ' ' LYS . 37.4 mt -78.87 134.42 27.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.117 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.5 ttp180 -58.19 139.88 83.54 Favored Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.643 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.462 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 14.3 Cg_endo -56.59 -45.38 37.46 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.395 2.063 . . . . 0.0 112.434 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.533 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -55.92 -58.35 8.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.173 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.57 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 0.6 OUTLIER -68.35 -29.85 68.67 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.765 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.39 -57.08 10.94 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.319 -179.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.533 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.8 p90 -91.74 -13.56 31.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.747 -179.485 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.57 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 0.1 OUTLIER -62.31 -46.31 89.3 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.844 0.354 . . . . 0.0 110.554 179.785 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -166.39 142.94 4.08 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.244 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -69.75 -26.1 27.98 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.636 2.224 . . . . 0.0 112.258 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -94.95 -36.17 11.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.627 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -98.3 49.88 1.0 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.687 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.466 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -109.66 63.36 0.6 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.826 179.999 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.431 ' HB3' ' HG2' ' A' ' 54' ' ' PRO . 0.0 OUTLIER -41.98 142.81 0.64 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.368 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.489 ' HG3' HG12 ' A' ' 20' ' ' ILE . 0.4 OUTLIER -113.42 152.18 30.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.32 -179.618 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.427 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -127.94 138.28 10.32 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.289 179.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.471 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 28.3 m-90 -97.73 128.32 44.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.887 0.375 . . . . 0.0 110.708 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.554 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 23.2 t90 -113.91 117.36 31.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.309 -179.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.587 ' CE1' HD12 ' A' ' 52' ' ' LEU . 1.3 m-85 -111.72 155.34 23.62 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.031 179.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.758 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.53 126.74 0.77 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.043 0.449 . . . . 0.0 111.884 179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.498 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 17.0 t-160 -98.1 99.12 10.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.608 178.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.811 ' CZ ' HG21 ' A' ' 78' ' ' THR . 34.1 m-85 -85.25 114.52 22.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.629 -179.117 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.445 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 51.9 t0 -88.39 113.89 24.45 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 59.67 -136.04 50.6 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 119.966 -1.111 . . . . 0.0 111.062 -178.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.406 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.4 Cg_exo -73.53 -15.25 24.74 Favored 'Trans proline' 0 N--CA 1.463 -0.28 0 C-N-CA 122.527 2.151 . . . . 0.0 112.266 179.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' TRP . . . . . 0.408 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -118.05 -173.99 2.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.965 0.412 . . . . 0.0 111.765 -178.527 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.788 HD11 ' O ' ' A' ' 48' ' ' ARG . 1.5 tt -129.62 147.1 33.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.59 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.503 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -122.5 -21.03 5.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.98 -179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.788 ' O ' HD11 ' A' ' 46' ' ' ILE . 5.3 ttm180 -127.17 139.23 53.1 Favored 'General case' 0 C--N 1.334 -0.089 0 C-N-CA 120.868 -0.333 . . . . 0.0 111.253 -179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.536 HE21 HD13 ' A' ' 61' ' ' LEU . 1.1 tt0 -154.51 139.24 17.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.786 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.431 ' HE2' ' HB ' ' A' ' 96' ' ' ILE . 1.2 ttm -140.44 116.75 10.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.9 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.444 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -95.95 136.83 35.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.002 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.587 HD12 ' CE1' ' A' ' 38' ' ' TYR . 81.0 mt -134.46 119.13 18.14 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.075 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.427 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 1.7 m-70 -143.24 135.0 12.95 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.915 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.431 ' HG2' ' HB3' ' A' ' 33' ' ' LYS . 9.8 Cg_endo -52.65 -26.86 31.11 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.565 2.177 . . . . 0.0 112.181 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -98.9 -24.46 14.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.968 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.442 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 0.5 OUTLIER -118.01 120.61 32.34 Favored Pre-proline 0 C--O 1.234 0.275 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.84 179.899 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.442 ' HD2' ' HA ' ' A' ' 56' ' ' LYS . 10.8 Cg_endo -54.15 168.89 0.78 Allowed 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.456 2.104 . . . . 0.0 112.204 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.428 ' HA ' ' O ' ' A' ' 51' ' ' GLU . 50.8 Cg_exo -55.52 86.77 0.04 OUTLIER 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.577 2.185 . . . . 0.0 112.38 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.444 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 88.6 mt -67.44 95.56 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.099 0.476 . . . . 0.0 110.62 179.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.46 HD21 ' N ' ' A' ' 102' ' ' GLY . 0.1 OUTLIER -71.65 127.63 33.18 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.913 -179.774 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.898 HD11 ' HB3' ' A' ' 69' ' ' GLU . 0.3 OUTLIER -132.67 147.18 52.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.085 -179.764 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.489 ' HA ' ' HE1' ' A' ' 70' ' ' MET . 10.5 p -156.24 142.1 10.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.837 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.503 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -56.27 164.03 1.46 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.285 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.408 ' HA3' ' HB2' ' A' ' 116' ' ' ARG . . . 76.24 -70.02 2.17 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.324 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.63 -57.21 6.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.862 0.363 . . . . 0.0 110.654 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.424 ' HB3' ' CD2' ' A' ' 61' ' ' LEU . 11.1 m-20 -110.08 45.61 1.09 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.58 179.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.59 -21.71 65.82 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.399 -179.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 5.5 ptp -81.26 -31.81 33.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.89 0.376 . . . . 0.0 110.625 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.898 ' HB3' HD11 ' A' ' 61' ' ' LEU . 27.2 mp0 -85.29 -36.8 20.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.897 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.489 ' HE1' ' HA ' ' A' ' 62' ' ' VAL . 0.8 OUTLIER -46.0 170.07 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.518 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.742 ' SG ' HD13 ' A' ' 46' ' ' ILE . 3.8 m -51.51 -26.6 8.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.109 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 68.16 -78.11 0.04 OUTLIER 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.971 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.51 -178.63 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.22 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -95.4 -164.72 1.19 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.691 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.537 HD21 ' HB3' ' A' ' 41' ' ' PHE . 3.8 mm? -69.48 -49.36 55.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.508 -179.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -62.46 -31.59 72.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.688 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -83.31 -27.94 29.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.505 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.811 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.6 OUTLIER -67.2 -78.42 0.06 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.835 0.35 . . . . 0.0 111.085 -179.763 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 144.44 -21.97 2.04 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.583 -0.818 . . . . 0.0 112.76 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.702 HD22 ' HB2' ' A' ' 15' ' ' PHE . 2.5 mt -51.88 -33.13 35.32 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.91 0.386 . . . . 0.0 111.075 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 68.1 p -83.55 -31.45 26.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.789 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 46.7 mtm-85 -66.45 -29.78 69.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.886 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.412 ' CD ' HG21 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -70.02 -166.5 0.12 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.854 179.977 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -100.61 92.21 5.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.008 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 53.81 74.13 0.34 Allowed Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.803 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -85.41 4.44 35.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.592 0.234 . . . . 0.0 111.56 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.407 ' HA ' ' O ' ' A' ' 14' ' ' PHE . 8.4 tm-20 -59.98 158.09 11.55 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.813 0.339 . . . . 0.0 111.4 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.724 HG21 ' HB3' ' A' ' 16' ' ' ARG . 0.9 OUTLIER -147.38 -179.95 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.177 179.985 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -106.03 146.59 33.21 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.626 179.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -68.18 -16.85 44.96 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.6 2.2 . . . . 0.0 112.69 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.07 -54.58 39.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.147 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -70.36 -41.32 73.28 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.916 0.389 . . . . 0.0 110.992 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.43 ' CE2' ' HD2' ' A' ' 48' ' ' ARG . 9.4 t80 -57.8 -53.01 63.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.941 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.65 -21.22 60.35 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.849 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -60.68 -50.34 73.88 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.283 0.563 . . . . 0.0 109.616 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.538 HG21 HD11 ' A' ' 52' ' ' LEU . 19.9 mm -75.44 -34.9 31.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.636 179.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.458 ' CE2' ' HA3' ' A' ' 102' ' ' GLY . 41.4 t-105 -52.92 -40.46 63.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.915 179.307 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -85.94 -28.22 24.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.717 179.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.429 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.4 OUTLIER -56.75 -44.08 81.38 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.251 -179.75 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 50.2 t -90.09 -76.91 0.41 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.01 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.408 ' C ' HD21 ' A' ' 60' ' ' LEU . . . 173.95 37.45 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.573 -179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.46 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -68.76 -44.27 70.82 Favored Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.499 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.853 HD13 HD21 ' A' ' 127' ' ' LEU . 4.3 mt -60.88 -39.9 83.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.935 0.397 . . . . 0.0 110.922 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 45.1 mm-40 -63.39 -45.81 89.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.12 179.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 21.9 t80 -62.05 -36.22 80.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.174 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 1.043 HD13 HD13 ' A' ' 124' ' ' LEU . 0.3 OUTLIER -71.47 -40.23 70.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.58 179.605 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -64.73 -29.9 70.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.597 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 5.1 m -71.95 -50.06 32.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.475 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.539 ' HB3' ' HB2' ' A' ' 115' ' ' ALA . . . -69.94 -34.07 72.95 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.5 0.667 . . . . 0.0 109.622 178.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.607 HD11 HD22 ' A' ' 106' ' ' LEU . 5.9 mt -56.95 -49.18 80.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 114.941 -1.027 . . . . 0.0 110.512 179.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -72.13 -34.17 68.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.642 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.406 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 12.3 t -75.79 -8.97 58.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.303 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.406 ' HB2' ' O ' ' A' ' 112' ' ' SER . 5.3 mmm180 68.41 27.66 6.32 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.855 0.359 . . . . 0.0 110.909 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -109.62 -24.11 11.11 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.761 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.539 ' HB2' ' HB3' ' A' ' 109' ' ' ALA . . . -56.96 -21.96 34.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.32 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.408 ' HB2' ' HA3' ' A' ' 64' ' ' GLY . 75.2 ttt180 67.68 92.95 0.06 OUTLIER Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.316 179.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.455 ' HB3' HG13 ' A' ' 6' ' ' ILE . 82.3 Cg_exo -46.66 90.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.877 2.385 . . . . 0.0 112.305 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -114.06 -63.41 1.45 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.183 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.424 ' CE2' ' HG3' ' A' ' 12' ' ' GLN . 9.5 t80 -161.8 -55.75 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.037 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.672 ' HB2' ' HE ' ' A' ' 48' ' ' ARG . . . -53.73 -30.12 42.57 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.18 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.435 ' HA ' HD11 ' A' ' 110' ' ' ILE . 22.2 p -69.79 -37.9 76.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.747 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -68.48 -54.06 19.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.011 0.434 . . . . 0.0 110.704 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' MET . . . . . 0.64 ' HE1' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -57.92 -29.63 65.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.564 179.519 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 1.043 HD13 HD13 ' A' ' 106' ' ' LEU . 0.2 OUTLIER -67.08 -50.13 62.71 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.084 0.469 . . . . 0.0 110.312 179.012 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.566 ' HA ' HD12 ' A' ' 128' ' ' LEU . 44.8 mm-40 -53.42 -41.62 66.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.618 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . 0.416 ' HA ' ' HD3' ' A' ' 129' ' ' LYS . 68.0 m-80 -80.95 -31.13 35.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.39 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.853 HD21 HD13 ' A' ' 103' ' ' ILE . 0.9 OUTLIER -70.36 -12.04 61.31 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.534 179.073 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.566 HD12 ' HA ' ' A' ' 125' ' ' GLN . 8.7 mt -91.33 -10.53 40.93 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.382 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.416 ' HD3' ' HA ' ' A' ' 126' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.19 -0.909 . . . . 0.0 111.008 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.418 ' CB ' ' HB3' ' A' ' 4' ' ' GLN . . . . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.909 0.385 . . . . 0.0 111.051 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.815 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.4 OUTLIER -69.11 -62.49 1.36 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.101 -179.889 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -53.63 -30.27 42.02 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.573 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.418 ' HB3' ' CB ' ' A' ' 1' ' ' ALA . 6.9 tp60 -69.26 -43.37 74.07 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.892 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.481 ' HG3' ' N ' ' A' ' 6' ' ' ILE . 5.2 pt-20 -70.1 -39.71 75.35 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.87 0.367 . . . . 0.0 110.934 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.871 HD13 ' HB2' ' A' ' 122' ' ' ALA . 2.9 mp -76.51 -58.98 3.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 121.774 0.797 . . . . 0.0 109.67 178.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.1 t70 41.88 70.59 0.26 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.319 -1.31 . . . . 0.0 111.553 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.7 ptp -58.02 -53.61 56.33 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.191 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 51.2 49.2 21.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.24 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.86 -169.25 3.32 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.05 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -95.18 170.46 9.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.098 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.48 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 4.3 mp0 -131.25 102.81 6.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.936 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.534 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 3.2 mtt-85 -122.08 126.6 48.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.002 0.43 . . . . 0.0 111.015 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.511 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 2.7 m-85 -108.77 134.84 50.93 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.811 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.808 ' CE2' HG22 ' A' ' 81' ' ' THR . 2.9 m-85 -131.43 153.49 49.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.38 0.61 . . . . 0.0 112.542 -178.307 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.503 ' CB ' HG21 ' A' ' 88' ' ' ILE . 0.8 OUTLIER -145.99 142.78 28.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.622 179.21 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.983 HD11 HD22 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -151.35 114.68 3.08 Favored Pre-proline 0 C--N 1.328 -0.362 0 C-N-CA 120.759 -0.377 . . . . 0.0 111.628 -179.456 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.451 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 74.7 Cg_endo -87.49 98.12 0.45 Allowed 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.894 2.396 . . . . 0.0 111.956 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 42.9 p90 -116.72 137.9 51.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.925 0.393 . . . . 0.0 111.059 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.63 HD11 ' NZ ' ' A' ' 34' ' ' LYS . 24.2 mt -78.92 145.72 9.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.325 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.16 142.32 94.86 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.429 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.446 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 19.1 Cg_endo -58.68 -50.78 8.45 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.508 2.139 . . . . 0.0 112.22 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.509 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -55.25 -58.23 8.57 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.066 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.524 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 1.1 m-20 -65.37 -30.25 71.06 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.0 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.51 -56.05 20.3 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.393 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.509 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.7 p90 -94.52 -5.0 47.03 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.976 -179.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.524 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 5.3 mtpp -73.02 -46.58 51.26 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.885 0.374 . . . . 0.0 110.818 179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -162.59 141.48 6.87 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.287 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -73.18 -9.28 23.16 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.686 2.258 . . . . 0.0 112.543 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 78.5 mm-40 -110.83 -33.8 6.43 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.958 0.409 . . . . 0.0 110.814 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -97.44 37.07 1.39 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.761 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.495 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -71.36 -35.02 70.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.412 -179.753 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 46.96 93.35 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.196 -179.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.63 ' NZ ' HD11 ' A' ' 20' ' ' ILE . 0.1 OUTLIER -77.9 149.9 34.17 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.479 -179.763 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.436 ' HA3' ' CD2' ' A' ' 53' ' ' HIS . . . -121.79 132.94 9.18 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.247 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.451 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 21.5 m-90 -98.26 124.23 42.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.894 0.378 . . . . 0.0 110.957 -179.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.422 ' CD1' ' HG2' ' A' ' 51' ' ' GLU . 63.4 t90 -107.64 117.13 33.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.973 -179.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.864 ' CE1' HD12 ' A' ' 52' ' ' LEU . 22.5 m-85 -111.54 151.43 28.7 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.432 179.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.487 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -169.99 124.07 0.75 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.078 0.466 . . . . 0.0 111.343 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.511 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 16.8 t-160 -99.83 96.17 7.4 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.73 179.307 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.606 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 5.1 m-85 -79.09 143.39 35.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.225 -179.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.553 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.3 OUTLIER -113.37 111.71 22.44 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.822 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.87 -133.21 49.5 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 119.907 -1.139 . . . . 0.0 111.224 -178.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_exo -73.36 -16.78 24.53 Favored 'Trans proline' 0 CA--C 1.531 0.325 0 C-N-CA 122.509 2.139 . . . . 0.0 112.517 179.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' TRP . . . . . 0.425 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.5 OUTLIER -119.06 -163.48 0.97 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.751 -178.501 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.606 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 4.9 tt -134.85 155.53 38.49 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.693 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.604 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -131.59 -20.88 2.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.427 -179.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.558 ' O ' HD11 ' A' ' 46' ' ' ILE . 14.5 mtt180 -128.9 134.8 48.39 Favored 'General case' 0 C--O 1.23 0.064 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.764 -179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.425 ' HB3' ' HB2' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -143.98 122.61 12.54 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.971 0.415 . . . . 0.0 111.466 -179.564 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.432 ' HE1' ' HB ' ' A' ' 96' ' ' ILE . 24.2 ttp -122.77 115.6 22.3 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.038 179.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.44 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 1.4 mt-10 -105.2 129.61 53.54 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.005 0.431 . . . . 0.0 111.69 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.864 HD12 ' CE1' ' A' ' 38' ' ' TYR . 5.2 mt -128.75 106.43 8.93 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.312 179.456 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.44 ' HB2' ' HG2' ' A' ' 56' ' ' LYS . 0.2 OUTLIER -131.7 138.7 33.17 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.543 -0.298 . . . . 0.0 111.13 -179.635 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.43 -23.91 26.09 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.381 2.054 . . . . 0.0 112.202 179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -88.46 -32.85 18.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.129 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.514 ' HB2' HD11 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -127.12 125.74 24.17 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.09 -179.983 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.421 ' CB ' ' CD ' ' A' ' 58' ' ' PRO . 76.9 Cg_exo -50.81 -175.66 0.01 OUTLIER 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.692 2.261 . . . . 0.0 112.485 -179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.421 ' CD ' ' CB ' ' A' ' 57' ' ' PRO . 33.3 Cg_exo -58.7 81.3 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.584 2.189 . . . . 0.0 112.498 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.514 HD11 ' HB2' ' A' ' 56' ' ' LYS . 94.6 mt -65.56 95.29 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.092 0.472 . . . . 0.0 110.441 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.452 ' CD2' ' HA2' ' A' ' 102' ' ' GLY . 0.4 OUTLIER -78.0 117.55 19.43 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.108 -179.608 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.425 ' HB2' ' HB3' ' A' ' 49' ' ' GLN . 53.9 mt -121.52 151.37 40.37 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.732 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.771 HG21 HD21 ' A' ' 106' ' ' LEU . 11.8 p -151.63 145.74 16.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.091 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.604 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -61.38 139.89 58.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.916 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.403 ' HA3' ' HG3' ' A' ' 116' ' ' ARG . . . 98.83 -47.43 1.4 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.394 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.543 ' HG3' ' HB1' ' A' ' 109' ' ' ALA . 0.0 OUTLIER -92.67 -42.46 9.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.901 0.381 . . . . 0.0 110.685 179.829 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -121.32 47.9 1.76 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.699 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.53 -29.84 70.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.045 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -85.38 -30.33 23.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.201 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -79.41 -50.11 11.32 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.196 -179.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.4 ' HE1' ' N ' ' A' ' 63' ' ' ALA . 2.1 ptp -52.93 -177.47 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.157 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.48 -50.92 61.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.764 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 75.17 -57.8 0.59 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.311 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -46.26 154.77 0.25 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.326 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -74.83 174.11 9.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.922 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.486 HD12 ' CZ ' ' A' ' 15' ' ' PHE . 4.0 mm? -58.19 -45.99 86.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.473 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -69.71 -40.84 76.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.925 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -65.82 -22.63 66.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.547 -179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.422 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -77.45 -69.94 0.5 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.722 0.296 . . . . 0.0 110.921 -179.898 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 126.11 -19.83 6.39 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.684 -0.769 . . . . 0.0 112.671 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.983 HD22 HD11 ' A' ' 17' ' ' ILE . 0.1 OUTLIER -51.14 -53.11 37.58 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 120.851 0.358 . . . . 0.0 110.713 -179.916 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.808 HG22 ' CE2' ' A' ' 15' ' ' PHE . 11.6 p -58.06 -49.88 75.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.665 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -58.17 -27.15 63.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.456 179.483 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -163.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.578 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -99.71 82.22 2.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.792 0.33 . . . . 0.0 110.81 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.67 70.27 1.03 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.565 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -95.93 32.62 1.85 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.602 0.239 . . . . 0.0 111.164 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.487 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 0.7 OUTLIER -113.07 141.38 46.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.35 -179.891 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.503 HG21 ' CB ' ' A' ' 16' ' ' ARG . 0.1 OUTLIER -124.67 157.28 32.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.78 179.545 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.595 HD12 ' H ' ' A' ' 92' ' ' GLN . 0.3 OUTLIER -61.52 145.63 90.93 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.506 179.747 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -60.6 -23.38 75.54 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.599 2.199 . . . . 0.0 112.51 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -53.3 57.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.22 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.595 ' H ' HD12 ' A' ' 89' ' ' LEU . 6.1 mm-40 -57.71 -56.34 23.22 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.28 -179.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 52.4 t80 -50.18 -53.35 28.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.806 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.36 -20.45 62.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.525 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.403 ' HB2' ' HA ' ' A' ' 92' ' ' GLN . 0.4 OUTLIER -60.59 -50.01 75.23 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 109.541 -0.541 . . . . 0.0 109.541 179.089 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.432 ' HB ' ' HE1' ' A' ' 50' ' ' MET . 15.0 mm -72.38 -35.41 51.81 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.579 179.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.439 ' CH2' ' HG ' ' A' ' 60' ' ' LEU . 12.7 t-105 -52.58 -41.93 64.05 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.855 -0.612 . . . . 0.0 110.125 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -85.99 -26.46 25.43 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.655 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.17 -53.24 60.45 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.449 -179.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 70.9 m -86.85 -87.16 0.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.341 -179.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -167.23 48.64 0.25 Allowed Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.543 -0.837 . . . . 0.0 112.683 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.452 ' HA2' ' CD2' ' A' ' 60' ' ' LEU . . . -69.37 -39.56 80.87 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.565 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.79 HD12 HD22 ' A' ' 127' ' ' LEU . 16.7 mm -70.08 -44.95 77.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.799 0.333 . . . . 0.0 111.288 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.03 -49.21 78.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.813 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 94.0 t80 -59.5 -50.45 73.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.053 0.454 . . . . 0.0 110.407 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.771 HD21 HG21 ' A' ' 62' ' ' VAL . 0.2 OUTLIER -57.29 -46.53 83.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.393 179.508 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.408 ' HG2' HD23 ' A' ' 124' ' ' LEU . 2.8 mm-40 -59.67 -29.82 68.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.663 179.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 15.1 m -67.11 -50.32 61.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.777 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.543 ' HB1' ' HG3' ' A' ' 65' ' ' LYS . . . -70.32 -33.78 71.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.564 0.697 . . . . 0.0 109.436 178.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.553 ' CG1' HG22 ' A' ' 121' ' ' THR . 9.5 mt -56.31 -48.73 79.25 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.258 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -72.0 -32.56 67.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.245 179.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.46 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 0.3 OUTLIER -74.71 -9.28 58.41 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.062 179.491 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.46 ' HB2' ' O ' ' A' ' 112' ' ' SER . 15.7 mmm180 69.66 31.37 3.63 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.966 0.413 . . . . 0.0 110.998 -179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . 0.406 ' HB3' ' CG ' ' A' ' 65' ' ' LYS . 11.2 mt-30 -108.9 -29.97 8.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.555 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.51 ' HB1' ' CG2' ' A' ' 121' ' ' THR . . . -71.38 102.15 2.56 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.866 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.907 ' O ' HG22 ' A' ' 118' ' ' THR . 39.2 mtt85 -58.04 109.78 2.06 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.191 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.865 ' O ' HG23 ' A' ' 6' ' ' ILE . 75.6 Cg_exo -50.5 89.82 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.676 2.25 . . . . 0.0 112.187 179.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.907 HG22 ' O ' ' A' ' 116' ' ' ARG . 1.5 t -141.58 81.77 1.79 Allowed 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.834 0.349 . . . . 0.0 111.822 -179.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.63 ' H ' HG21 ' A' ' 6' ' ' ILE . 7.8 t80 65.13 -64.34 0.17 Allowed 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 179.003 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.401 ' N ' ' O ' ' A' ' 118' ' ' THR . . . -53.54 -52.22 60.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.921 0.391 . . . . 0.0 111.397 -179.184 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.6 ' OG1' ' HA ' ' A' ' 117' ' ' PRO . 0.6 OUTLIER -65.26 -46.58 79.95 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.677 179.669 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.871 ' HB2' HD13 ' A' ' 6' ' ' ILE . . . -54.85 -56.27 21.24 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.387 0.613 . . . . 0.0 110.256 179.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' MET . . . . . 0.828 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -53.69 -33.66 56.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.335 179.17 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.492 HD13 ' CG ' ' A' ' 106' ' ' LEU . 0.1 OUTLIER -63.72 -49.04 74.64 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.15 0.5 . . . . 0.0 109.818 178.997 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 40.7 mm-40 -50.79 -40.2 54.69 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.909 178.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -79.3 -32.0 43.38 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.068 178.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.828 HD13 ' CE ' ' A' ' 123' ' ' MET . 0.3 OUTLIER -59.31 -21.43 59.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.118 178.922 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.472 ' O ' HD12 ' A' ' 128' ' ' LEU . 0.8 OUTLIER -143.01 77.93 1.59 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.952 179.929 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 6.9 mmmt . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.941 -179.996 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.767 0.318 . . . . 0.0 111.058 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.919 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.1 OUTLIER -57.14 -60.1 4.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.987 0.423 . . . . 0.0 110.546 179.824 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -53.84 -35.57 61.63 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.654 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -61.63 -36.63 81.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.365 179.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -73.86 -56.47 4.93 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.093 179.224 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.919 HD12 ' O ' ' A' ' 2' ' ' ARG . 3.1 mp -57.72 -61.74 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.188 179.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 39.37 30.26 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.908 -1.042 . . . . 0.0 112.24 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.713 ' H ' HG22 ' A' ' 6' ' ' ILE . 0.0 OUTLIER 51.48 99.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.004 0.43 . . . . 0.0 111.166 179.759 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.9 mttt -53.31 -58.15 8.1 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.939 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.431 ' HD2' ' HA2' ' A' ' 43' ' ' GLY . 0.0 OUTLIER -177.43 -157.71 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.023 179.925 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -44.76 147.4 0.63 Allowed 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.951 0.405 . . . . 0.0 111.705 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.436 ' HB3' ' HE2' ' A' ' 40' ' ' HIS . 74.2 mm-40 -118.91 112.64 19.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.952 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.594 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 1.1 mtp180 -115.4 132.36 56.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.006 0.432 . . . . 0.0 110.767 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.498 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 1.3 m-85 -115.59 135.21 54.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.399 -179.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.601 ' HB3' HD12 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -136.76 154.17 50.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.289 0.566 . . . . 0.0 112.007 -178.759 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.477 ' HD2' ' CE2' ' A' ' 38' ' ' TYR . 0.6 OUTLIER -149.21 147.16 28.08 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.767 179.872 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.746 HD13 HD13 ' A' ' 80' ' ' LEU . 0.4 OUTLIER -153.28 127.63 4.58 Favored Pre-proline 0 C--O 1.233 0.213 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.781 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.411 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 66.2 Cg_endo -91.87 114.83 0.37 Allowed 'Trans proline' 0 N--CA 1.458 -0.615 0 C-N-CA 123.222 2.614 . . . . 0.0 111.573 179.17 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.7 p90 -131.31 142.95 50.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.955 0.407 . . . . 0.0 111.573 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.716 HD13 ' HE3' ' A' ' 32' ' ' LYS . 23.4 mt -88.03 134.2 28.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.801 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.4 mtt180 -56.21 122.84 51.29 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.571 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.467 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 84.5 Cg_exo -44.5 -46.82 11.73 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.568 2.178 . . . . 0.0 112.787 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.529 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -54.74 -58.24 8.35 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.109 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.541 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 7.0 m-20 -67.96 -29.39 68.43 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.853 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -52.67 -55.04 25.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.273 -179.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.529 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.1 p90 -94.03 -14.31 25.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.91 -179.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.541 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 3.3 mtpt -62.98 -50.95 68.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.797 0.332 . . . . 0.0 110.768 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 179.07 144.53 0.34 Allowed Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.347 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.44 ' HA ' ' HG2' ' A' ' 32' ' ' LYS . 71.9 Cg_endo -73.55 -2.29 11.94 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.756 2.304 . . . . 0.0 112.824 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.38 -46.55 8.65 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.026 0.441 . . . . 0.0 110.575 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -95.33 33.55 1.56 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.195 179.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.716 ' HE3' HD13 ' A' ' 20' ' ' ILE . 2.8 mmtt -45.83 -76.59 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.518 -179.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 61.83 93.87 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.727 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.641 ' NZ ' HD11 ' A' ' 20' ' ' ILE . 1.2 ttmt -91.06 138.28 31.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.375 -179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -107.66 134.63 12.31 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.269 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.42 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 11.4 m-90 -98.61 134.58 41.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.879 0.371 . . . . 0.0 110.82 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.411 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 26.2 t90 -113.39 117.27 31.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.06 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.787 ' CE1' HD12 ' A' ' 52' ' ' LEU . 53.2 m-85 -116.28 142.74 46.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.053 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.718 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -164.97 124.22 1.8 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.279 0.561 . . . . 0.0 111.883 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.507 ' HB3' ' HG3' ' A' ' 48' ' ' ARG . 5.5 t-160 -90.81 95.75 10.29 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.341 -0.845 . . . . 0.0 108.733 178.403 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.629 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 7.7 m-85 -76.98 158.57 30.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.544 -178.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.609 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 3.5 t70 -126.32 115.09 19.14 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.431 ' HA2' ' HD2' ' A' ' 10' ' ' ARG . . . 57.65 -135.61 51.55 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 119.804 -1.189 . . . . 0.0 111.124 -178.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 8.9 Cg_exo -71.7 -18.26 28.86 Favored 'Trans proline' 0 CA--C 1.53 0.289 0 C-N-CA 122.53 2.154 . . . . 0.0 112.278 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' TRP . . . . . 0.402 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.7 OUTLIER -116.15 -159.34 0.72 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.391 -178.83 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.837 HD11 ' O ' ' A' ' 48' ' ' ARG . 4.7 tt -131.62 157.73 43.2 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 CA-C-O 121.304 0.573 . . . . 0.0 112.255 -179.287 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.446 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -112.45 -37.3 5.0 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.013 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.837 ' O ' HD11 ' A' ' 46' ' ' ILE . 0.1 OUTLIER -146.38 160.32 42.2 Favored 'General case' 0 CA--C 1.523 -0.084 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.964 -179.713 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.508 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 9.1 tt0 -149.9 150.55 32.06 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.158 0.504 . . . . 0.0 111.646 -179.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.418 ' HE1' ' N ' ' A' ' 97' ' ' TRP . 3.3 ttm -138.85 122.51 17.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.134 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.402 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 4.3 mt-10 -111.44 139.75 46.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.043 0.449 . . . . 0.0 111.583 -179.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.787 HD12 ' CE1' ' A' ' 38' ' ' TYR . 0.7 OUTLIER -135.08 101.77 4.98 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.364 179.652 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -116.68 138.05 24.21 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.096 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -52.06 -26.6 26.19 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.662 2.241 . . . . 0.0 112.331 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -98.89 -25.04 14.74 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.968 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.613 ' CB ' HD11 ' A' ' 59' ' ' ILE . 0.1 OUTLIER -117.06 118.98 35.53 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.774 -179.807 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.403 ' O ' ' N ' ' A' ' 59' ' ' ILE . 73.1 Cg_exo -48.72 177.71 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.405 2.07 . . . . 0.0 112.261 179.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -56.75 82.4 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.536 2.157 . . . . 0.0 112.345 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.613 HD11 ' CB ' ' A' ' 56' ' ' LYS . 5.8 mt -65.01 107.05 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.861 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.654 HD23 ' HB2' ' A' ' 105' ' ' TYR . 0.3 OUTLIER -83.28 136.96 34.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.893 -179.93 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.813 HD21 ' HB3' ' A' ' 69' ' ' GLU . 0.2 OUTLIER -132.68 145.79 51.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.024 -179.804 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.928 HG21 HD21 ' A' ' 106' ' ' LEU . 12.0 p -150.37 131.91 5.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.982 179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.67 164.7 1.02 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.414 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.79 -70.71 1.15 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.407 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.473 ' HG3' ' HB1' ' A' ' 109' ' ' ALA . 0.0 OUTLIER -64.62 -55.67 18.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.948 0.404 . . . . 0.0 110.788 179.868 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.446 ' CB ' HD13 ' A' ' 61' ' ' LEU . 66.6 m-20 -99.13 59.33 1.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.864 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -69.04 -23.97 64.12 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.203 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 7.1 mmt -85.25 -37.87 19.55 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.994 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.813 ' HB3' HD21 ' A' ' 61' ' ' LEU . 6.0 mt-10 -81.69 -36.59 28.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.202 -179.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.418 ' N ' HD11 ' A' ' 61' ' ' LEU . 63.4 tpp -52.11 158.62 1.07 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.18 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 5.4 t -49.1 -58.7 4.51 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.105 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 66.03 19.36 11.19 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.216 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.61 ' HB2' HG23 ' A' ' 78' ' ' THR . 15.6 mmtt -123.69 131.67 53.66 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.782 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -58.64 166.4 1.85 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.41 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.438 ' HA ' HD23 ' A' ' 75' ' ' LEU . 12.2 mt -58.8 -53.11 62.08 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.682 0.277 . . . . 0.0 111.432 -179.458 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -62.87 -31.93 73.07 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.275 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -77.82 -36.67 49.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.322 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.61 HG23 ' HB2' ' A' ' 73' ' ' LYS . 0.7 OUTLIER -62.8 -73.27 0.11 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.118 -179.808 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 140.23 -6.6 2.81 Favored Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.532 -0.842 . . . . 0.0 113.101 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.746 HD13 HD13 ' A' ' 17' ' ' ILE . 2.6 mm? -63.12 -38.15 90.02 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 121.249 0.547 . . . . 0.0 110.161 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 69.0 p -87.56 -28.52 21.91 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.978 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.04 -36.11 82.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.612 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.624 ' HD3' ' HB2' ' A' ' 86' ' ' ALA . 0.3 OUTLIER -80.24 -164.61 0.71 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.753 179.824 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -109.86 112.88 25.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.911 0.386 . . . . 0.0 111.302 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.82 82.6 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.954 -0.641 . . . . 0.0 113.227 179.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.682 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -118.63 15.19 13.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.718 0.294 . . . . 0.0 111.163 179.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.423 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 14.6 mt-10 -87.02 166.4 15.07 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.895 0.378 . . . . 0.0 111.286 -179.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.472 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 0.8 OUTLIER -146.98 168.11 5.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.008 179.688 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.867 HD12 ' HB2' ' A' ' 91' ' ' ARG . 0.8 OUTLIER -90.01 140.82 27.61 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.742 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.13 -16.47 54.62 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.632 2.221 . . . . 0.0 112.649 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.867 ' HB2' HD12 ' A' ' 89' ' ' LEU . 0.6 OUTLIER -71.76 -54.06 11.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.205 -179.817 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.435 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 0.0 OUTLIER -66.95 -39.83 87.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.972 -179.803 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -58.5 -53.21 60.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.477 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.75 -19.32 62.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.411 179.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.435 ' HB2' ' HA ' ' A' ' 92' ' ' GLN . 0.1 OUTLIER -61.82 -50.18 73.35 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.117 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.404 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 14.0 mm -72.23 -37.76 60.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.405 179.11 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.441 ' O ' ' N ' ' A' ' 102' ' ' GLY . 41.2 t-105 -52.88 -42.15 65.01 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.152 179.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -85.72 -21.9 28.06 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.699 179.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.404 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 4.9 tpt180 -58.24 -54.07 51.1 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.356 -179.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 41.6 t -86.12 -83.01 0.19 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.29 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.577 ' C ' HD21 ' A' ' 60' ' ' LEU . . . -165.84 31.45 0.22 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.601 -179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.532 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -52.64 -48.06 56.73 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.65 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.731 ' HA ' HD11 ' A' ' 124' ' ' LEU . 24.2 mm -66.29 -43.13 91.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.742 0.306 . . . . 0.0 111.056 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.86 -39.43 74.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.97 0.415 . . . . 0.0 110.552 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.654 ' HB2' HD23 ' A' ' 60' ' ' LEU . 17.7 t80 -64.2 -53.48 48.61 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.637 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.928 HD21 HG21 ' A' ' 62' ' ' VAL . 1.5 mt -61.59 -37.66 84.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.632 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.519 ' HG2' HD21 ' A' ' 124' ' ' LEU . 0.3 OUTLIER -64.36 -31.05 72.1 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.702 179.757 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 14.7 m -70.14 -50.33 41.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.642 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.473 ' HB1' ' HG3' ' A' ' 65' ' ' LYS . . . -72.06 -31.91 66.57 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.246 0.546 . . . . 0.0 109.729 179.063 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.595 ' CD1' HD22 ' A' ' 124' ' ' LEU . 4.6 mt -56.89 -47.14 83.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.247 179.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -69.59 -39.31 77.35 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.436 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -68.57 -14.1 62.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.111 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.401 ' HB3' ' NH1' ' A' ' 113' ' ' ARG . 3.6 mmm180 72.45 29.47 2.11 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.817 0.341 . . . . 0.0 111.004 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -111.81 -21.32 11.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.05 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.403 ' HA ' ' HB2' ' A' ' 65' ' ' LYS . . . -56.68 -26.36 56.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.443 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 56.7 mtt180 60.74 96.56 0.05 OUTLIER Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.631 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -47.11 92.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.592 2.195 . . . . 0.0 112.566 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 23.8 m -106.24 -59.54 1.77 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.59 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 18.0 t80 -165.59 -56.26 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.151 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.406 ' CB ' HD11 ' A' ' 106' ' ' LEU . . . -53.8 -40.85 66.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.191 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.623 HG22 HD22 ' A' ' 106' ' ' LEU . 6.6 p -60.79 -40.68 93.5 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.164 179.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.784 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -63.99 -54.26 37.17 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.42 0.628 . . . . 0.0 109.424 178.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' MET . . . . . 0.561 ' CE ' HD13 ' A' ' 127' ' ' LEU . 2.5 tmm? -56.35 -33.63 65.84 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.662 178.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.781 HD13 ' HB3' ' A' ' 106' ' ' LEU . 1.2 tt -67.55 -44.81 77.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.04 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.693 ' HA ' HD12 ' A' ' 128' ' ' LEU . 46.3 mm-40 -52.88 -38.73 61.97 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.014 179.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 49.9 m-20 -80.99 -34.28 33.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.345 179.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.561 HD13 ' CE ' ' A' ' 123' ' ' MET . 1.7 tp -68.98 -11.25 60.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.823 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.693 HD12 ' HA ' ' A' ' 125' ' ' GLN . 14.5 mt -77.6 -17.59 57.67 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.224 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.989 179.888 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.4 ' HB1' ' HB2' ' A' ' 4' ' ' GLN . . . . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.829 0.347 . . . . 0.0 111.006 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.893 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -62.84 -65.11 0.73 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.721 179.958 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -53.94 -39.36 65.82 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.753 179.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.4 ' HB2' ' HB1' ' A' ' 1' ' ' ALA . 3.6 mm-40 -60.96 -34.01 74.09 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.751 179.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.54 -49.39 14.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.266 179.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.893 HD12 ' O ' ' A' ' 2' ' ' ARG . 2.8 mp -62.38 -62.91 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.195 179.096 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.404 ' C ' ' O ' ' A' ' 6' ' ' ILE . 6.4 p-10 29.49 76.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.18 -0.918 . . . . 0.0 112.118 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.737 ' HE3' HG23 ' A' ' 6' ' ' ILE . 16.1 mmt -79.93 -78.97 0.15 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.051 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.3 mttp 53.88 28.98 9.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.017 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.6 ttm-85 -103.54 54.58 0.75 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.01 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 63.67 133.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.108 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.422 ' HG3' ' CZ ' ' A' ' 119' ' ' TYR . 90.6 mm-40 -125.0 102.82 7.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.69 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.477 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 18.3 mtp180 -117.53 129.35 55.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.159 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.504 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 1.3 m-85 -113.46 134.64 54.55 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.982 179.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.828 ' HB2' HD22 ' A' ' 80' ' ' LEU . 2.2 m-85 -134.67 153.49 51.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.215 0.531 . . . . 0.0 112.019 -178.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.466 ' HB3' ' CG2' ' A' ' 88' ' ' ILE . 0.6 OUTLIER -149.17 146.11 27.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.803 179.486 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.507 HG12 HD23 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -143.06 122.31 7.56 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 120.656 0.265 . . . . 0.0 111.359 -179.589 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.463 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 74.3 Cg_endo -88.44 89.49 0.47 Allowed 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.938 2.425 . . . . 0.0 112.354 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 29.1 p90 -109.15 144.78 36.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.819 0.342 . . . . 0.0 110.878 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.814 HG23 ' O ' ' A' ' 33' ' ' LYS . 4.8 mt -90.77 144.96 8.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.045 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.409 ' O ' ' CG ' ' A' ' 25' ' ' GLN . 7.5 mtt180 -70.12 134.4 87.41 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.503 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.583 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 85.3 Cg_exo -41.26 -60.81 0.58 Allowed 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.949 2.432 . . . . 0.0 113.19 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.698 ' HB1' ' HD2' ' A' ' 27' ' ' LYS . . . -46.22 -53.89 9.77 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.899 -179.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.546 ' HB3' ' HA ' ' A' ' 32' ' ' LYS . 1.4 m-20 -60.34 -36.79 78.79 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.651 -0.704 . . . . 0.0 112.072 -178.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.583 ' HG3' ' HA ' ' A' ' 22' ' ' PRO . 1.3 mt-30 -56.92 -57.59 11.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.723 -179.147 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.645 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.8 p90 -86.36 -3.03 58.92 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.71 -179.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.698 ' HD2' ' HB1' ' A' ' 23' ' ' ALA . 0.4 OUTLIER -76.85 -43.69 35.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.865 0.364 . . . . 0.0 110.424 179.353 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.434 ' HA ' ' HD3' ' A' ' 29' ' ' PRO . 3.4 t70 -168.39 148.69 4.29 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.121 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 28' ' ' ASP . 2.8 Cg_exo -73.44 -30.38 10.14 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.758 2.305 . . . . 0.0 111.781 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -94.6 -41.97 9.04 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.802 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -87.35 53.59 2.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.642 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.546 ' HA ' ' HB3' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -122.34 62.09 0.97 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.859 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.814 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -43.02 148.7 0.24 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.313 -179.921 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.92 117.65 34.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.332 -179.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -85.39 124.34 6.75 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.793 -0.718 . . . . 0.0 111.948 179.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.463 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 24.2 m-90 -97.88 131.31 44.47 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.038 0.447 . . . . 0.0 111.258 -179.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.697 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 33.2 t90 -116.2 117.15 29.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.636 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.737 ' CE1' HD12 ' A' ' 52' ' ' LEU . 11.7 m-85 -110.11 152.08 26.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.622 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.511 ' HB3' ' HE1' ' A' ' 41' ' ' PHE . . . -170.3 124.26 0.72 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.013 0.435 . . . . 0.0 111.319 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.504 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 14.1 t-160 -97.11 101.0 12.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.75 179.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.631 ' CE2' HG21 ' A' ' 78' ' ' THR . 7.7 m-85 -87.96 123.38 32.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.495 -179.263 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.459 ' OD2' ' HB3' ' A' ' 47' ' ' ALA . 38.3 m-20 -95.87 121.45 37.62 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 178.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 56.09 -137.77 46.36 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 119.944 -1.122 . . . . 0.0 111.042 -178.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.404 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 7.2 Cg_exo -73.33 -16.06 24.93 Favored 'Trans proline' 0 CA--C 1.531 0.355 0 C-N-CA 122.38 2.053 . . . . 0.0 112.28 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' TRP . . . . . 0.405 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -117.26 -170.25 1.81 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.943 0.401 . . . . 0.0 111.89 -178.434 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.638 HD11 ' O ' ' A' ' 48' ' ' ARG . 3.9 tt -128.28 154.65 39.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.878 -179.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.459 ' HB3' ' OD2' ' A' ' 42' ' ' ASP . . . -131.97 -19.37 2.58 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.132 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.638 ' O ' HD11 ' A' ' 46' ' ' ILE . 5.9 mtm180 -130.27 142.65 50.54 Favored 'General case' 0 C--N 1.337 0.054 0 CA-C-O 120.85 0.357 . . . . 0.0 111.039 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.416 ' HG3' ' HG3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -147.38 132.88 18.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.207 -179.76 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.403 ' HB3' ' HB2' ' A' ' 38' ' ' TYR . 14.1 ttp -133.4 120.71 21.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.331 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.552 ' HB3' HD12 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -105.24 135.0 47.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.267 -179.648 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.737 HD12 ' CE1' ' A' ' 38' ' ' TYR . 54.7 mt -135.15 101.88 5.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.71 179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.413 ' HB2' ' HB2' ' A' ' 56' ' ' LYS . 0.4 OUTLIER -120.75 155.4 57.19 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.015 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.16 -30.03 81.53 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.757 2.305 . . . . 0.0 112.457 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -109.82 9.67 24.65 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.478 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.54 ' HB3' HD11 ' A' ' 59' ' ' ILE . 0.9 OUTLIER -142.3 113.12 6.16 Favored Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.792 179.895 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -50.92 -179.9 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.515 0 C-N-CA 122.432 2.088 . . . . 0.0 112.336 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.25 82.69 0.07 OUTLIER 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.665 2.244 . . . . 0.0 112.488 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.552 HD12 ' HB3' ' A' ' 51' ' ' GLU . 7.1 mt -64.8 98.48 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.991 0.424 . . . . 0.0 110.709 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.567 HD21 ' N ' ' A' ' 102' ' ' GLY . 0.2 OUTLIER -76.1 112.69 12.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.773 -179.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.792 HD21 ' HB3' ' A' ' 69' ' ' GLU . 0.9 OUTLIER -115.74 152.6 32.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.847 -179.719 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.677 HG21 HD21 ' A' ' 106' ' ' LEU . 12.1 p -158.79 146.47 7.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.092 -0.503 . . . . 0.0 111.048 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.22 162.03 2.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.026 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.401 ' CA ' ' HD3' ' A' ' 116' ' ' ARG . . . 75.09 -65.75 2.26 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.065 -179.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.3 -36.4 66.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.034 0.445 . . . . 0.0 110.342 179.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -119.49 54.83 0.98 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.505 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.44 -34.22 77.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.203 -179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 36.5 mmm -85.71 -38.94 17.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.881 0.372 . . . . 0.0 110.777 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.792 ' HB3' HD21 ' A' ' 61' ' ' LEU . 0.3 OUTLIER -72.58 -44.9 61.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.976 -179.804 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.416 ' HG3' ' HG3' ' A' ' 49' ' ' GLN . 21.3 ttm -52.32 163.51 0.4 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.927 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.484 ' SG ' HG22 ' A' ' 78' ' ' THR . 1.8 t -46.7 -55.07 8.36 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.208 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.425 ' CB ' ' O ' ' A' ' 71' ' ' CYS . 2.7 tt0 84.04 -21.89 0.24 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.786 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.47 -179.69 5.87 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.922 0.391 . . . . 0.0 111.163 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -99.26 -171.58 2.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.463 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.558 HD11 ' HB2' ' A' ' 41' ' ' PHE . 3.6 mm? -67.3 -49.99 61.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.568 -179.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.27 -41.72 73.08 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.854 0.359 . . . . 0.0 111.338 -179.394 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -61.81 -38.4 88.0 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.684 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.631 HG21 ' CE2' ' A' ' 41' ' ' PHE . 1.0 OUTLIER -59.82 -72.42 0.11 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.146 -179.643 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 132.88 -19.4 4.42 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.551 -179.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.828 HD22 ' HB2' ' A' ' 15' ' ' PHE . 1.5 mp -52.79 -42.83 65.4 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.032 0.444 . . . . 0.0 110.765 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 28.3 p -71.2 -39.63 71.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.649 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -60.87 -30.41 70.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.557 179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.6 mtpp -60.11 -177.11 0.06 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.691 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.54 68.88 2.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.767 179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.56 64.55 1.68 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.638 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -92.6 26.25 2.74 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.709 0.29 . . . . 0.0 111.233 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.99 155.65 16.65 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.85 0.357 . . . . 0.0 110.928 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.466 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 1.0 OUTLIER -133.56 178.69 5.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.072 179.818 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.593 ' H ' HD23 ' A' ' 89' ' ' LEU . 0.9 OUTLIER -93.75 158.45 36.51 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.828 179.821 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo -73.0 -35.81 4.98 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.736 2.291 . . . . 0.0 112.107 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.592 ' HB2' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -53.96 -54.26 41.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.223 -179.781 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.441 ' HG3' HD21 ' A' ' 89' ' ' LEU . 0.5 OUTLIER -64.3 -45.87 86.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.18 -179.78 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -55.33 -53.25 58.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.014 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -72.6 -20.22 61.33 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.679 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.408 ' HB2' ' HA ' ' A' ' 92' ' ' GLN . 1.3 tm-20 -59.93 -49.63 76.93 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.468 HG21 HD11 ' A' ' 52' ' ' LEU . 16.7 mm -73.76 -35.06 42.45 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.366 179.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.449 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 5.8 t-105 -54.65 -39.7 68.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.991 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.63 -25.59 26.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.531 179.272 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.8 -53.7 54.8 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.085 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 52.3 t -83.96 -76.65 0.29 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.026 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 175.01 39.0 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.598 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.567 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -58.9 -62.22 6.48 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.977 -0.63 . . . . 0.0 112.429 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.619 ' H ' HD12 ' A' ' 103' ' ' ILE . 3.7 mp -52.93 -38.37 28.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.784 0.326 . . . . 0.0 111.258 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.96 -40.13 87.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.982 0.42 . . . . 0.0 110.515 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -69.72 -41.55 75.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.496 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.719 HD12 HD11 ' A' ' 110' ' ' ILE . 0.3 OUTLIER -68.22 -50.31 54.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.876 179.888 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -29.68 70.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.037 179.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 4.0 m -68.52 -50.51 51.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.793 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.518 ' HB1' ' HB2' ' A' ' 114' ' ' GLN . . . -71.29 -35.1 71.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.645 0.736 . . . . 0.0 109.389 178.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.719 HD11 HD12 ' A' ' 106' ' ' LEU . 15.9 mt -56.24 -45.23 81.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.534 179.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -70.34 -41.16 73.56 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.031 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.501 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 21.6 p -76.55 -4.63 43.81 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.424 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.501 ' HB2' ' O ' ' A' ' 112' ' ' SER . 24.2 mmm180 75.38 24.12 1.43 Allowed 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.79 0.329 . . . . 0.0 111.332 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . 0.518 ' HB2' ' HB1' ' A' ' 109' ' ' ALA . 0.0 OUTLIER -90.38 -24.19 20.87 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.386 179.082 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -102.11 107.7 18.87 Favored 'General case' 0 N--CA 1.456 -0.136 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.873 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.648 ' HG3' HG23 ' A' ' 118' ' ' THR . 0.2 OUTLIER -56.17 135.15 74.92 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.937 -179.906 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_exo -52.42 84.95 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.596 2.197 . . . . 0.0 112.517 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.648 HG23 ' HG3' ' A' ' 116' ' ' ARG . 3.6 p -107.62 -176.59 3.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.413 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.422 ' CZ ' ' HG3' ' A' ' 12' ' ' GLN . 40.2 t80 -59.17 -36.35 75.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.87 0.367 . . . . 0.0 110.77 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.482 ' HB2' ' HE ' ' A' ' 48' ' ' ARG . . . -69.15 -52.08 31.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.116 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.595 ' HA ' HD11 ' A' ' 110' ' ' ILE . 60.5 p -58.63 -49.28 78.09 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.835 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.665 ' HB2' HG21 ' A' ' 6' ' ' ILE . . . -57.97 -48.54 79.69 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.244 0.545 . . . . 0.0 109.826 179.115 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' MET . . . . . 0.621 ' HE1' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -62.14 -33.37 74.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.883 178.785 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.509 HD21 ' O ' ' A' ' 103' ' ' ILE . 0.1 OUTLIER -63.97 -50.26 69.28 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.168 179.2 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.529 ' NE2' HG21 ' A' ' 110' ' ' ILE . 86.6 mm-40 -52.92 -42.57 65.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.359 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -79.06 -29.84 43.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.638 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.621 HD13 ' HE1' ' A' ' 123' ' ' MET . 1.3 tt -76.73 -7.02 54.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.647 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.408 HD12 ' HA ' ' A' ' 125' ' ' GLN . 20.3 mt -75.71 -35.34 60.3 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.896 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.188 -0.91 . . . . 0.0 111.113 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.843 ' HB1' ' HB3' ' A' ' 4' ' ' GLN . . . . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.964 0.411 . . . . 0.0 111.026 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.791 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -60.67 -66.63 0.5 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.55 179.88 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.74 -36.73 62.62 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.549 179.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.843 ' HB3' ' HB1' ' A' ' 1' ' ' ALA . 6.5 tp60 -58.31 -36.31 73.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.668 179.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.536 ' HG2' ' HB2' ' A' ' 117' ' ' PRO . 0.3 OUTLIER -73.02 -55.68 6.18 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.901 179.403 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.791 HD12 ' O ' ' A' ' 2' ' ' ARG . 4.5 mp -52.91 -64.61 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.48 0.657 . . . . 0.0 109.61 178.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 29.4 t70 49.58 96.94 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.975 -1.011 . . . . 0.0 111.057 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.407 ' HE2' ' HB3' ' A' ' 8' ' ' MET . 3.1 ptp -87.53 20.22 3.0 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.575 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.48 -31.27 63.66 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.849 0.356 . . . . 0.0 110.999 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 18.6 mtt180 -57.0 173.18 0.22 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.029 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.2 134.14 42.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.943 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 89.7 mm-40 -119.1 102.68 8.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.941 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.498 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -122.34 143.23 49.76 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.787 179.868 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.543 ' CD1' ' N ' ' A' ' 14' ' ' PHE . 0.7 OUTLIER -124.34 134.74 53.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.709 -179.621 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.498 ' CZ ' ' HB3' ' A' ' 13' ' ' ARG . 0.2 OUTLIER -143.56 155.53 44.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.236 0.541 . . . . 0.0 111.881 -179.695 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.854 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.6 153.4 37.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.34 -0.846 . . . . 0.0 109.897 178.71 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.634 HG21 ' CD ' ' A' ' 83' ' ' LYS . 0.1 OUTLIER -148.79 133.09 8.82 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 120.757 0.313 . . . . 0.0 111.535 -179.776 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.428 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 70.7 Cg_endo -91.97 120.25 0.54 Allowed 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 123.183 2.589 . . . . 0.0 111.777 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 54.7 p90 -144.59 155.99 43.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.99 0.424 . . . . 0.0 111.154 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.513 HG23 ' O ' ' A' ' 33' ' ' LYS . 2.2 mt -108.9 150.53 11.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.812 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 -69.23 123.22 87.82 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.25 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.635 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 67.2 Cg_exo -40.0 -50.79 3.3 Favored 'Trans proline' 0 C--O 1.239 0.554 0 C-N-CA 122.952 2.435 . . . . 0.0 112.996 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.683 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -47.6 -59.09 3.51 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.879 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.492 ' HA ' ' HG2' ' A' ' 27' ' ' LYS . 0.8 OUTLIER -62.63 -33.59 75.33 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.505 -0.77 . . . . 0.0 112.833 -178.831 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.635 ' HG3' ' HA ' ' A' ' 22' ' ' PRO . 0.5 OUTLIER -55.89 -53.89 51.28 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 -178.314 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.683 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.9 p90 -88.88 -40.72 12.91 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -178.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.545 ' HG2' ' O ' ' A' ' 23' ' ' ALA . 11.0 ptmt -58.34 -36.26 73.17 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 111.949 0.351 . . . . 0.0 111.949 -178.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -156.91 116.67 2.06 Favored Pre-proline 0 C--N 1.33 -0.28 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.893 -179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.27 -7.01 19.85 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 122.617 2.212 . . . . 0.0 112.366 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -95.8 -36.14 11.26 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.947 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -88.99 46.02 1.35 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.441 178.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.431 ' HD3' ' HA ' ' A' ' 25' ' ' GLN . 3.9 mmtp -78.86 59.65 2.64 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.948 -179.272 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.513 ' O ' HG23 ' A' ' 20' ' ' ILE . 12.2 mmtm -53.8 100.7 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.025 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.92 121.35 31.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.949 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -113.66 144.48 18.18 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.727 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.451 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 11.2 m-90 -106.21 132.73 51.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.843 0.354 . . . . 0.0 110.745 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.513 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 22.4 t90 -115.05 117.56 30.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.222 -179.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.833 ' CE1' HD12 ' A' ' 52' ' ' LEU . 0.4 OUTLIER -117.24 152.28 35.16 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.32 179.146 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.61 ' HB3' ' HE1' ' A' ' 41' ' ' PHE . . . -170.58 130.29 0.86 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.203 0.525 . . . . 0.0 111.807 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.575 ' HB3' ' HG3' ' A' ' 48' ' ' ARG . 8.4 t-160 -96.68 103.68 15.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.496 -0.775 . . . . 0.0 108.997 178.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.759 ' CE2' HG21 ' A' ' 78' ' ' THR . 7.1 m-85 -90.3 127.42 36.16 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.589 -179.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.428 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 1.1 m-20 -93.88 113.36 25.36 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 178.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 57.48 -136.51 50.6 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.025 -1.084 . . . . 0.0 110.959 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -71.17 -19.2 29.89 Favored 'Trans proline' 0 N--CA 1.465 -0.192 0 C-N-CA 122.385 2.056 . . . . 0.0 112.08 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' TRP . . . . . 0.404 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -111.4 -174.0 2.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.505 -178.864 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.675 HG21 ' SG ' ' A' ' 71' ' ' CYS . 1.4 tt -121.44 149.33 24.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.172 0.51 . . . . 0.0 112.198 -179.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.415 ' N ' HG13 ' A' ' 46' ' ' ILE . . . -105.42 -40.33 5.84 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.832 -179.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.575 ' HG3' ' HB3' ' A' ' 40' ' ' HIS . 1.6 ptp180 -149.58 153.24 36.8 Favored 'General case' 0 CA--C 1.523 -0.084 0 C-N-CA 120.542 -0.463 . . . . 0.0 111.512 -179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.71 ' OE1' HD12 ' A' ' 61' ' ' LEU . 6.7 tt0 -148.23 156.11 42.17 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.896 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.782 ' HE1' HD11 ' A' ' 52' ' ' LEU . 22.8 ptm -142.61 122.64 13.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.297 179.523 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.477 ' O ' ' HA ' ' A' ' 58' ' ' PRO . 0.0 OUTLIER -98.78 126.51 44.44 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.324 -179.405 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.833 HD12 ' CE1' ' A' ' 38' ' ' TYR . 20.4 mt -128.21 112.05 14.09 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.752 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 4.2 m-70 -140.02 134.63 15.87 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.2 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_exo -50.99 -26.19 17.95 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.399 2.066 . . . . 0.0 112.234 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -96.68 -28.76 14.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.949 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.44 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 5.5 mttp -116.26 121.68 33.23 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.79 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.44 ' HD2' ' HA ' ' A' ' 56' ' ' LYS . 9.5 Cg_endo -50.94 169.63 0.17 Allowed 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.341 2.028 . . . . 0.0 112.111 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.477 ' HA ' ' O ' ' A' ' 51' ' ' GLU . 19.2 Cg_endo -60.84 78.54 0.07 OUTLIER 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.536 2.157 . . . . 0.0 112.477 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 11.8 mt -65.46 89.96 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 121.075 0.464 . . . . 0.0 110.7 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.504 HD13 ' HA2' ' A' ' 102' ' ' GLY . 7.2 mt -68.68 113.72 6.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.558 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.932 HD21 ' HB3' ' A' ' 69' ' ' GLU . 5.7 mt -101.96 155.72 17.98 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.399 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.588 HG13 ' O ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -164.52 140.08 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.867 179.99 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.12 161.2 7.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.928 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.403 ' HA3' ' HB2' ' A' ' 116' ' ' ARG . . . 79.39 -69.86 2.92 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.84 -179.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.51 -45.12 73.12 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.043 0.449 . . . . 0.0 110.426 179.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.479 ' OD2' HD23 ' A' ' 61' ' ' LEU . 21.9 m-20 -114.35 52.64 0.83 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.569 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -62.46 -38.22 88.97 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.107 -179.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 75.7 mmm -85.64 -31.08 22.75 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.949 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.932 ' HB3' HD21 ' A' ' 61' ' ' LEU . 0.3 OUTLIER -75.52 -36.54 60.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.049 -179.754 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.86 ' HA ' HD13 ' A' ' 61' ' ' LEU . 0.2 OUTLIER -47.42 172.45 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.244 179.861 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.675 ' SG ' HG21 ' A' ' 46' ' ' ILE . 21.5 p -45.88 -41.55 11.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.181 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.424 ' CB ' ' O ' ' A' ' 71' ' ' CYS . 10.5 tt0 82.19 -13.78 0.83 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.84 179.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.88 -176.41 3.05 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.908 0.385 . . . . 0.0 110.864 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -106.4 174.07 6.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.463 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.496 HD11 ' CZ ' ' A' ' 15' ' ' PHE . 32.4 tp -56.21 -44.21 79.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.461 -179.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -70.96 -46.18 62.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.714 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.48 -28.88 65.33 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -178.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.759 HG21 ' CE2' ' A' ' 41' ' ' PHE . 0.9 OUTLIER -56.49 -67.28 0.32 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.736 0.303 . . . . 0.0 111.243 -179.589 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 131.46 -20.28 4.69 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.611 -0.804 . . . . 0.0 112.876 -179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.582 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 6.7 mt -53.22 -29.91 34.95 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.977 0.418 . . . . 0.0 110.822 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 11.2 p -86.24 -43.36 13.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.737 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.53 -30.18 69.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.703 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.634 ' CD ' HG21 ' A' ' 17' ' ' ILE . 43.6 mttt -67.45 -177.25 0.69 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.978 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 20.5 mmt85 -81.62 73.75 8.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.1 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.92 65.05 3.81 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.65 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.582 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -76.82 -5.35 47.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.573 0.225 . . . . 0.0 111.501 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -55.03 150.03 11.02 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.973 0.416 . . . . 0.0 111.147 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.854 HG21 ' HB3' ' A' ' 16' ' ' ARG . 9.8 pt -136.46 169.45 20.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.135 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.893 HD12 ' HB2' ' A' ' 91' ' ' ARG . 1.0 OUTLIER -82.58 146.17 52.79 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.757 179.789 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -67.34 -24.78 42.92 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.557 2.171 . . . . 0.0 112.534 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.893 ' HB2' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -60.35 -54.1 49.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.992 -179.926 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.414 ' HG3' HD21 ' A' ' 89' ' ' LEU . 5.9 mm-40 -58.61 -49.0 79.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.006 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -55.66 -53.32 58.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.714 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.83 -21.82 65.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.791 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.74 -50.59 68.48 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.059 0.457 . . . . 0.0 109.862 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.405 ' HB ' ' CE ' ' A' ' 50' ' ' MET . 18.8 mm -77.85 -34.48 19.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.71 179.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.56 ' HZ2' HD12 ' A' ' 106' ' ' LEU . 28.0 t-105 -52.59 -40.68 62.89 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.974 -0.557 . . . . 0.0 109.909 179.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -86.12 -30.91 22.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.425 179.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -57.34 -54.23 49.19 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.424 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 73.7 m -74.69 -75.85 0.15 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.162 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.418 ' C ' HD13 ' A' ' 60' ' ' LEU . . . 171.25 38.32 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.619 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.504 ' HA2' HD13 ' A' ' 60' ' ' LEU . . . -69.21 -41.7 78.61 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.342 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.583 HG23 ' HG ' ' A' ' 124' ' ' LEU . 37.1 mm -65.15 -44.08 95.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.757 0.313 . . . . 0.0 110.824 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -49.09 78.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.328 179.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.421 ' CE2' ' CG2' ' A' ' 62' ' ' VAL . 2.2 t80 -62.6 -37.89 88.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.065 179.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.68 HD13 ' CD1' ' A' ' 124' ' ' LEU . 0.1 OUTLIER -69.1 -35.72 76.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.442 179.462 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.91 -33.24 75.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.306 179.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 2.6 m -68.78 -49.92 54.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.3 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.418 ' HB3' ' HB2' ' A' ' 115' ' ' ALA . . . -69.07 -34.79 75.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.398 0.618 . . . . 0.0 109.772 179.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.727 HD11 ' HA ' ' A' ' 121' ' ' THR . 2.6 mt -56.94 -47.13 83.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.61 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -72.15 -33.1 67.47 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.562 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 10.0 t -77.57 -8.94 58.6 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.23 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 112' ' ' SER . 74.1 mmt-85 68.81 26.83 5.9 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-O 120.907 0.384 . . . . 0.0 111.105 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -108.92 -21.9 12.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.774 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.418 ' HB2' ' HB3' ' A' ' 109' ' ' ALA . . . -56.81 -22.62 37.64 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.365 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.549 ' HG2' HG23 ' A' ' 118' ' ' THR . 2.2 ttt180 68.49 81.83 0.2 Allowed Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.835 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.536 ' HB2' ' HG2' ' A' ' 5' ' ' GLU . 68.7 Cg_exo -51.85 89.42 0.03 OUTLIER 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.654 2.236 . . . . 0.0 112.489 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.549 HG23 ' HG2' ' A' ' 116' ' ' ARG . 71.5 p -117.9 -36.64 3.58 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.889 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.439 ' HA ' HG23 ' A' ' 6' ' ' ILE . 12.0 t80 -176.3 -49.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.126 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . . . . . . . . . . . -55.02 -52.14 64.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.215 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.727 ' HA ' HD11 ' A' ' 110' ' ' ILE . 70.5 p -59.58 -45.21 92.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.629 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.703 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -54.94 -55.48 30.18 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 121.662 0.744 . . . . 0.0 109.627 179.118 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' MET . . . . . 0.467 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -57.58 -32.75 67.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.784 178.492 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.68 ' CD1' HD13 ' A' ' 106' ' ' LEU . 0.1 OUTLIER -67.82 -41.98 82.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.079 178.724 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.466 ' HA ' HD12 ' A' ' 128' ' ' LEU . 84.8 mm-40 -52.66 -44.53 66.25 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.329 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . 0.432 ' OD1' ' HA ' ' A' ' 123' ' ' MET . 0.9 OUTLIER -81.08 -27.73 35.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.66 179.465 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.467 HD13 ' CE ' ' A' ' 123' ' ' MET . 1.0 OUTLIER -64.82 -19.26 65.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.851 0.358 . . . . 0.0 110.344 178.958 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.466 HD12 ' HA ' ' A' ' 125' ' ' GLN . 17.8 mt -73.23 -19.93 60.97 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.241 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 3.2 mptt . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.247 -0.882 . . . . 0.0 111.002 -179.992 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.806 0.336 . . . . 0.0 111.008 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.928 ' O ' HD12 ' A' ' 6' ' ' ILE . 88.0 mtm-85 -58.37 -59.0 6.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.056 0.455 . . . . 0.0 110.994 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.445 ' H ' ' HG2' ' A' ' 3' ' ' GLN . 0.3 OUTLIER -54.13 -34.48 60.44 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.117 0.484 . . . . 0.0 110.065 179.831 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -66.34 -38.9 88.7 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.184 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.438 ' HG2' ' HA ' ' A' ' 2' ' ' ARG . 16.7 pt-20 -79.14 -44.28 22.31 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.785 0.326 . . . . 0.0 110.904 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.928 HD12 ' O ' ' A' ' 2' ' ' ARG . 2.8 mp -72.68 -58.82 4.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.531 0.681 . . . . 0.0 109.898 178.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.6 t70 38.4 83.13 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.575 -1.193 . . . . 0.0 111.738 -179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -76.24 0.07 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.877 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.9 29.73 0.77 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.397 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -140.73 -168.36 2.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.003 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.84 153.36 17.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.023 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.437 ' HG2' ' CZ ' ' A' ' 119' ' ' TYR . 13.5 mp0 -122.1 102.94 8.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.888 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.503 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -108.99 136.99 47.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.007 0.432 . . . . 0.0 110.833 -179.822 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.508 ' CD1' ' N ' ' A' ' 14' ' ' PHE . 0.4 OUTLIER -119.55 138.87 52.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.189 -179.701 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.826 ' HB2' HD13 ' A' ' 80' ' ' LEU . 5.5 m-85 -142.3 152.15 42.69 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.463 0.649 . . . . 0.0 112.685 -178.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.493 ' HA ' ' O ' ' A' ' 37' ' ' TRP . 8.2 ttp180 -149.59 147.41 28.11 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 114.836 -1.074 . . . . 0.0 109.59 179.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.671 HD13 HD23 ' A' ' 80' ' ' LEU . 0.6 OUTLIER -153.4 129.53 5.35 Favored Pre-proline 0 C--N 1.331 -0.235 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 -179.796 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.455 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 52.8 Cg_endo -91.88 117.57 0.45 Allowed 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 123.23 2.62 . . . . 0.0 111.621 179.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 39.1 p90 -135.76 160.03 39.81 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.12 0.486 . . . . 0.0 111.558 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.605 HG12 ' HD3' ' A' ' 34' ' ' LYS . 1.9 mt -102.18 147.24 9.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.186 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.9 mtp180 -75.25 141.51 74.03 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.118 179.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.476 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 11.5 Cg_endo -55.13 -52.36 8.07 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.584 2.189 . . . . 0.0 112.702 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.568 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -53.46 -58.83 5.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.377 -179.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.559 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 20.2 m-20 -67.09 -30.7 70.81 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.109 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.59 -56.54 14.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.469 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.568 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.3 p90 -91.39 -16.85 26.74 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.659 -179.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.559 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 0.6 OUTLIER -59.51 -45.16 92.51 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.794 0.331 . . . . 0.0 110.784 179.668 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -168.11 133.18 1.51 Allowed Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.267 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -67.43 -13.49 39.38 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.57 2.18 . . . . 0.0 112.271 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -98.1 -34.29 10.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.383 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -98.54 26.63 5.39 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.823 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.464 ' HB3' HG21 ' A' ' 20' ' ' ILE . 40.9 mttt -57.98 -67.18 0.37 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.457 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 4.1 mmmm 60.06 116.4 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.925 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.605 ' HD3' HG12 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -108.38 143.49 37.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.002 0.429 . . . . 0.0 110.964 179.788 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -95.45 139.01 14.27 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.21 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.483 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 12.8 m-90 -97.68 111.08 23.5 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.112 0.482 . . . . 0.0 110.495 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.575 ' HZ3' HD11 ' A' ' 80' ' ' LEU . 12.1 t90 -95.7 117.5 30.63 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.551 -178.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.805 ' CE1' HD12 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -117.86 144.8 45.08 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.153 179.001 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.692 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.32 124.5 0.72 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.122 0.487 . . . . 0.0 111.696 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.503 ' HB3' ' HG3' ' A' ' 48' ' ' ARG . 8.8 t-160 -92.64 104.34 16.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.341 178.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.645 ' CE2' HG21 ' A' ' 78' ' ' THR . 3.5 m-85 -86.86 153.02 21.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.179 0.514 . . . . 0.0 111.658 -178.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.453 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 28.1 p-10 -123.19 114.06 19.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.073 178.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 59.23 -135.49 51.61 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 119.892 -1.147 . . . . 0.0 111.151 -178.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.402 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 7.6 Cg_exo -72.7 -17.61 25.92 Favored 'Trans proline' 0 N--CA 1.464 -0.227 0 C-N-CA 122.506 2.137 . . . . 0.0 112.469 179.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' TRP . . . . . 0.421 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.7 OUTLIER -116.02 -165.91 1.09 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.514 -178.584 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.82 HD11 ' O ' ' A' ' 48' ' ' ARG . 2.4 tt -128.1 151.87 35.47 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.137 0 CA-C-O 121.122 0.487 . . . . 0.0 111.927 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -103.03 -40.78 6.34 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.531 -0.758 . . . . 0.0 111.816 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.82 ' O ' HD11 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -144.85 154.28 42.49 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 120.7 -0.4 . . . . 0.0 111.396 -179.535 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.412 ' OE1' ' CZ2' ' A' ' 37' ' ' TRP . 7.9 tt0 -141.13 141.73 34.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.362 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.418 ' SD ' HD11 ' A' ' 52' ' ' LEU . 5.3 ttm -135.99 111.64 9.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.178 179.412 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.489 ' HB3' ' HB ' ' A' ' 59' ' ' ILE . 4.5 tt0 -102.82 137.41 41.07 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.892 0.377 . . . . 0.0 111.523 -179.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.805 HD12 ' CE1' ' A' ' 38' ' ' TYR . 3.2 mt -133.79 124.78 27.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.8 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.421 ' CD2' ' HG2' ' A' ' 51' ' ' GLU . 25.6 m-70 -139.33 134.61 16.61 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.537 -0.302 . . . . 0.0 111.1 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -50.64 -25.71 15.45 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.54 2.16 . . . . 0.0 112.245 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -99.53 -27.37 13.74 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.006 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -114.47 118.99 40.8 Favored Pre-proline 0 C--O 1.234 0.262 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.826 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -49.7 177.37 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.565 2.177 . . . . 0.0 112.559 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -58.67 85.74 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.699 2.266 . . . . 0.0 112.216 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.489 ' HB ' ' HB3' ' A' ' 51' ' ' GLU . 44.4 mt -71.34 101.28 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.77 179.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.496 HD21 ' N ' ' A' ' 102' ' ' GLY . 1.1 mp -78.66 144.66 35.17 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.096 -179.687 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.804 HD13 ' HA ' ' A' ' 70' ' ' MET . 84.5 mt -146.21 151.17 37.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.966 179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.5 p -156.48 149.88 10.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.987 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.69 140.47 58.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.209 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.56 -49.46 1.46 Allowed Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.332 -179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.492 ' HD2' ' HB2' ' A' ' 109' ' ' ALA . 0.1 OUTLIER -88.08 -63.03 1.36 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.885 0.374 . . . . 0.0 110.727 179.809 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.779 ' HB3' HD22 ' A' ' 61' ' ' LEU . 18.6 m-20 -101.24 55.01 0.83 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.8 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -71.06 -27.26 63.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.971 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 50.0 mtp -84.77 -28.9 25.88 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.991 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -87.49 -42.08 13.04 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.09 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.804 ' HA ' HD13 ' A' ' 61' ' ' LEU . 4.8 ptm -57.25 -166.92 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.074 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.574 ' SG ' HG22 ' A' ' 78' ' ' THR . 17.0 t -81.52 104.5 11.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.087 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -73.77 -17.96 61.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.935 179.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.4 mptp? -78.84 177.12 8.96 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.018 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.526 ' O ' HG23 ' A' ' 78' ' ' THR . 9.4 m120 -105.37 -173.59 2.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.857 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.696 HD11 HG21 ' A' ' 81' ' ' THR . 0.7 OUTLIER -54.72 -53.08 59.64 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.744 -179.462 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -71.58 -54.36 10.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.871 0.367 . . . . 0.0 111.787 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -50.03 -38.2 36.57 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.645 HG21 ' CE2' ' A' ' 41' ' ' PHE . 2.0 p -48.12 -61.56 1.92 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.777 0.322 . . . . 0.0 111.543 -179.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 125.15 -28.68 5.04 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.544 -0.836 . . . . 0.0 112.703 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.826 HD13 ' HB2' ' A' ' 15' ' ' PHE . 1.1 mt -49.05 -45.55 43.07 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.998 0.428 . . . . 0.0 110.737 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.696 HG21 HD11 ' A' ' 75' ' ' LEU . 0.6 OUTLIER -74.89 -32.26 61.8 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.46 179.695 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 5.9 mmm180 -61.74 -32.07 72.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.493 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.686 ' HD2' ' HB2' ' A' ' 86' ' ' ALA . 0.1 OUTLIER -86.3 -174.65 5.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.631 179.82 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 8.4 mpt_? -102.47 119.48 38.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.946 0.403 . . . . 0.0 111.123 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 60.65 85.25 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.749 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.686 ' HB2' ' HD2' ' A' ' 83' ' ' LYS . . . -130.92 19.79 5.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.639 0.257 . . . . 0.0 111.244 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.48 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 30.5 mt-10 -99.83 160.0 14.64 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.959 0.409 . . . . 0.0 111.239 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.468 ' CG2' ' HB3' ' A' ' 16' ' ' ARG . 0.8 OUTLIER -138.16 174.51 10.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.042 179.916 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.479 HD12 ' H ' ' A' ' 92' ' ' GLN . 0.4 OUTLIER -98.06 147.99 33.85 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.545 179.584 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -66.97 -22.98 47.43 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.483 2.122 . . . . 0.0 112.7 -179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -54.79 40.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.786 0.327 . . . . 0.0 111.082 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.479 ' H ' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -70.51 -34.84 72.78 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.03 -179.976 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.472 ' CE1' ' HD3' ' A' ' 48' ' ' ARG . 21.8 t80 -62.64 -53.23 57.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.482 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.81 -22.05 63.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.548 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.11 -50.82 71.67 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 179.157 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.564 HG21 HD11 ' A' ' 52' ' ' LEU . 17.5 mm -71.53 -35.93 58.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.259 178.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.436 ' CZ3' ' HG ' ' A' ' 60' ' ' LEU . 18.4 t-105 -53.45 -40.49 65.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.029 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -85.72 -23.93 27.15 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.816 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.427 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 7.4 mtt-85 -56.85 -54.1 50.28 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.053 -179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 43.1 t -81.51 -81.32 0.14 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.037 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -173.98 39.64 0.13 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.553 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.496 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -61.33 -55.23 30.36 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.634 179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.453 HD12 HD22 ' A' ' 127' ' ' LEU . 10.1 mm -57.18 -42.95 80.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.769 0.318 . . . . 0.0 111.173 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -65.25 -49.28 70.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.681 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 34.2 t80 -60.57 -40.07 90.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.514 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.795 HD12 HD11 ' A' ' 110' ' ' ILE . 0.2 OUTLIER -70.38 -45.93 65.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.87 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.561 ' NE2' HD11 ' A' ' 128' ' ' LEU . 1.7 mm-40 -61.88 -29.95 70.54 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.988 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 54.6 p -72.55 -50.32 26.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.805 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.492 ' HB2' ' HD2' ' A' ' 65' ' ' LYS . . . -68.93 -35.9 77.33 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.579 0.704 . . . . 0.0 109.161 178.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.795 HD11 HD12 ' A' ' 106' ' ' LEU . 13.6 mt -58.59 -44.3 89.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.912 178.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.96 -43.13 83.9 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.535 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.435 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 5.9 m -72.58 -10.09 59.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.246 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.435 ' HB2' ' O ' ' A' ' 112' ' ' SER . 16.3 mmt180 75.39 27.28 1.07 Allowed 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.909 0.385 . . . . 0.0 110.987 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -92.31 -28.67 16.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.384 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.511 ' HB1' ' CG2' ' A' ' 121' ' ' THR . . . -82.95 94.66 7.78 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.749 179.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.8 ptt180 -53.29 118.37 14.1 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.218 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -52.96 88.53 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.519 2.146 . . . . 0.0 112.124 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 5.2 t -110.2 -46.29 3.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.052 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.437 ' CZ ' ' HG2' ' A' ' 12' ' ' GLN . 9.8 t80 -177.36 -54.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.187 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.468 ' O ' ' HG3' ' A' ' 123' ' ' MET . . . -53.82 -40.31 66.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.863 0.363 . . . . 0.0 111.177 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.527 HG22 ' CD1' ' A' ' 106' ' ' LEU . 62.6 p -69.27 -43.74 73.29 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.481 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.659 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -58.57 -58.12 9.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.172 0.511 . . . . 0.0 110.239 179.186 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' MET . . . . . 0.612 ' HE2' ' N ' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -55.36 -29.93 59.35 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.046 179.119 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.612 ' N ' ' HE2' ' A' ' 123' ' ' MET . 0.1 OUTLIER -67.17 -48.94 66.46 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 121.022 0.439 . . . . 0.0 109.852 178.805 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.513 ' HA ' HD12 ' A' ' 128' ' ' LEU . 75.7 mm-40 -50.01 -39.62 41.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.796 179.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -80.09 -35.16 37.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.059 178.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.453 HD22 HD12 ' A' ' 103' ' ' ILE . 0.6 OUTLIER -57.81 -20.29 34.63 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.652 179.046 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.561 HD11 ' NE2' ' A' ' 107' ' ' GLN . 9.6 mt -82.51 -23.02 34.82 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.141 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 12.2 mmtp . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.164 -0.922 . . . . 0.0 110.927 179.906 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.413 ' HB1' ' HB3' ' A' ' 4' ' ' GLN . . . . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.832 0.349 . . . . 0.0 111.095 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.943 ' O ' HD12 ' A' ' 6' ' ' ILE . 1.5 mtm180 -55.5 -57.45 11.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.832 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.82 -40.55 66.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.851 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.413 ' HB3' ' HB1' ' A' ' 1' ' ' ALA . 6.4 tp60 -58.08 -37.41 74.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.613 179.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -71.49 -56.85 5.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.987 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.943 HD12 ' O ' ' A' ' 2' ' ' ARG . 2.8 mp -54.05 -62.69 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.349 179.025 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.0 t70 47.72 92.19 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.083 -179.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.0 mtm -87.51 67.2 9.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.565 0.698 . . . . 0.0 110.715 -179.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.3 mttp -148.69 34.25 0.77 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.791 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -121.58 -166.61 1.4 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.012 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -93.04 125.25 37.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.986 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.447 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 7.9 mp0 -111.96 102.8 11.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.974 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.538 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 2.9 mtt180 -113.92 126.8 55.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.977 0.418 . . . . 0.0 110.953 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.493 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 2.2 m-85 -109.0 134.99 50.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.857 -0.61 . . . . 0.0 109.884 179.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.819 ' CB ' HD22 ' A' ' 80' ' ' LEU . 2.6 m-85 -131.25 152.65 50.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.29 0.567 . . . . 0.0 112.335 -178.374 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.523 ' CB ' HG21 ' A' ' 88' ' ' ILE . 41.3 ttp85 -149.28 148.06 29.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.92 179.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.616 HG23 ' HB1' ' A' ' 86' ' ' ALA . 0.3 OUTLIER -152.08 121.73 3.45 Favored Pre-proline 0 C--N 1.329 -0.286 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.646 179.905 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -86.15 88.41 0.78 Allowed 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.93 2.42 . . . . 0.0 112.32 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.7 p90 -116.0 139.66 50.04 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.931 0.396 . . . . 0.0 111.02 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.735 HG23 ' O ' ' A' ' 33' ' ' LYS . 13.2 mt -86.85 142.58 12.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.927 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -57.8 110.22 2.35 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.118 179.369 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.499 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 76.4 Cg_exo -39.76 -51.84 2.83 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.795 2.33 . . . . 0.0 112.863 -179.393 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.545 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -50.07 -58.76 4.83 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.871 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.555 ' HA ' ' HG2' ' A' ' 27' ' ' LYS . 6.1 m-20 -67.07 -33.05 74.65 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.24 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.421 ' HB3' ' HA ' ' A' ' 22' ' ' PRO . 0.0 OUTLIER -52.07 -43.55 63.89 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.361 -0.836 . . . . 0.0 112.736 -178.904 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.545 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.7 p90 -104.59 -34.93 8.02 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -178.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.555 ' HG2' ' HA ' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -61.84 -32.31 72.63 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.664 -0.415 . . . . 0.0 111.601 -178.774 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.406 ' CB ' ' HB2' ' A' ' 31' ' ' ASN . 67.7 m-20 -150.2 120.32 3.83 Favored Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 120.844 -0.343 . . . . 0.0 111.523 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -72.67 -7.84 21.47 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.539 2.159 . . . . 0.0 112.321 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -109.81 -32.41 7.08 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.937 0.399 . . . . 0.0 110.394 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.406 ' HB2' ' CB ' ' A' ' 28' ' ' ASP . 84.2 m-20 -97.72 28.18 3.99 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.658 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.641 ' HB3' HG21 ' A' ' 20' ' ' ILE . 13.5 mttt -59.83 -59.05 6.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.918 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.735 ' O ' HG23 ' A' ' 20' ' ' ILE . 17.8 mmtt 70.54 113.78 0.05 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.599 -179.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.409 ' HD2' HG12 ' A' ' 20' ' ' ILE . 0.3 OUTLIER -83.01 110.86 18.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.489 -179.938 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.45 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -91.34 117.59 5.22 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.593 -0.813 . . . . 0.0 112.833 -179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 10.1 m-90 -97.84 126.24 43.11 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.853 0.359 . . . . 0.0 110.431 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.541 ' CZ3' HD11 ' A' ' 80' ' ' LEU . 11.2 t90 -113.65 119.87 38.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.614 -179.192 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.799 ' CE1' HD12 ' A' ' 52' ' ' LEU . 4.1 m-85 -115.96 150.46 37.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.956 -0.565 . . . . 0.0 109.941 178.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.535 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -170.45 123.75 0.68 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.161 0.505 . . . . 0.0 111.61 179.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.493 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 18.0 t-160 -93.17 98.28 11.19 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.451 178.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.669 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 20.4 m-85 -85.93 127.31 34.58 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.426 -179.146 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.551 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 25.0 p-10 -93.7 110.99 22.59 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 178.53 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 58.93 -134.53 52.44 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.053 -1.07 . . . . 0.0 111.122 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_exo -71.66 -19.64 27.62 Favored 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 122.489 2.126 . . . . 0.0 112.204 179.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' TRP . . . . . 0.423 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.6 OUTLIER -112.82 -170.11 1.61 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.274 -178.851 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.686 HD13 ' SG ' ' A' ' 71' ' ' CYS . 3.2 tt -127.35 151.69 34.49 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-O 121.263 0.554 . . . . 0.0 112.114 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -111.6 -32.64 6.61 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.917 -179.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.47 ' CZ ' ' CE2' ' A' ' 93' ' ' PHE . 4.2 ptm180 -157.19 154.97 30.11 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.46 -179.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.679 ' HB3' HD11 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -161.55 159.02 27.26 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.242 179.801 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.467 ' HE1' ' HB ' ' A' ' 96' ' ' ILE . 11.3 ttp -134.46 154.84 51.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.852 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.464 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.2 OUTLIER -129.49 117.67 20.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.897 179.694 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.799 HD12 ' CE1' ' A' ' 38' ' ' TYR . 1.3 mt -120.35 106.18 11.62 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.876 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.45 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 6.8 m170 -127.54 134.12 25.84 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.698 179.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -51.94 -23.44 16.58 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.342 2.028 . . . . 0.0 112.262 179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -100.34 -26.95 13.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.113 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.443 ' HB2' ' HB2' ' A' ' 53' ' ' HIS . 7.9 mttt -117.84 126.02 27.61 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.977 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -54.9 173.46 0.27 Allowed 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.767 2.312 . . . . 0.0 112.463 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -60.25 88.02 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.714 2.276 . . . . 0.0 112.383 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.701 HG22 ' CD2' ' A' ' 61' ' ' LEU . 75.0 mt -70.4 100.57 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.799 179.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.44 ' HG ' ' CH2' ' A' ' 97' ' ' TRP . 0.3 OUTLIER -77.97 123.99 27.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.693 -179.966 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.701 ' CD2' HG22 ' A' ' 59' ' ' ILE . 2.8 mm? -121.02 139.55 53.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.25 -179.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 10.2 p -149.14 139.26 16.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.951 179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.616 ' HB2' ' HE1' ' A' ' 70' ' ' MET . . . -59.16 155.95 13.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.988 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.416 ' HA3' ' HB2' ' A' ' 116' ' ' ARG . . . 85.76 -63.49 4.25 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.112 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.19 -67.93 0.6 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.997 0.427 . . . . 0.0 110.483 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.467 ' CB ' HD13 ' A' ' 61' ' ' LEU . 5.6 m-20 -97.11 47.16 1.04 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.404 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.463 ' HA ' ' HG2' ' A' ' 70' ' ' MET . 1.4 t0 -63.31 -25.35 68.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.438 -179.601 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -85.56 -35.73 20.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.753 0.311 . . . . 0.0 111.151 -179.696 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.536 ' CB ' HD11 ' A' ' 61' ' ' LEU . 1.1 mp0 -80.18 -36.22 35.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.256 -179.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.616 ' HE1' ' HB2' ' A' ' 63' ' ' ALA . 0.7 OUTLIER -56.0 -169.36 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.876 0.37 . . . . 0.0 111.146 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.686 ' SG ' HD13 ' A' ' 46' ' ' ILE . 3.5 m -68.19 -44.38 76.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.571 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 69.23 -64.65 0.33 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.101 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 11.0 mptt -54.3 178.91 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.113 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -94.67 -168.69 1.88 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.604 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.666 HD22 HG23 ' A' ' 81' ' ' THR . 7.8 mt -71.99 -53.38 13.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.386 -179.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -31.69 70.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.219 -179.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 48.1 tt0 -80.5 -36.37 33.38 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.327 -179.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.642 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 1.0 OUTLIER -61.54 -80.06 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.051 -179.772 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 147.53 -16.43 1.45 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.507 -0.854 . . . . 0.0 113.038 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.819 HD22 ' CB ' ' A' ' 15' ' ' PHE . 5.3 mt -53.89 -35.24 61.38 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.905 0.383 . . . . 0.0 110.915 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.666 HG23 HD22 ' A' ' 75' ' ' LEU . 22.6 p -81.81 -39.92 23.32 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.594 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.5 mmm180 -63.97 -30.54 71.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.545 179.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -165.76 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.728 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -102.23 83.48 2.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.778 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 58.15 71.26 0.78 Allowed Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.336 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.616 ' HB1' HG23 ' A' ' 17' ' ' ILE . . . -98.17 34.42 1.96 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.666 0.269 . . . . 0.0 110.978 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -90.9 147.81 22.89 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.224 -179.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.523 HG21 ' CB ' ' A' ' 16' ' ' ARG . 1.3 pt -139.09 179.46 3.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.057 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.605 HD12 ' CB ' ' A' ' 91' ' ' ARG . 0.4 OUTLIER -106.33 149.9 38.81 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.648 179.594 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -61.98 -30.7 83.67 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.506 2.137 . . . . 0.0 112.215 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.605 ' CB ' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -56.51 -54.0 50.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.351 -179.845 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -64.02 -53.84 43.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.418 -179.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.47 ' CE2' ' CZ ' ' A' ' 48' ' ' ARG . 6.2 t80 -52.65 -53.23 50.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.189 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.402 ' OE2' ' NH1' ' A' ' 48' ' ' ARG . 1.2 tt0 -66.58 -22.75 66.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.39 179.562 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.09 -50.36 73.56 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.161 0.505 . . . . 0.0 109.756 179.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.467 ' HB ' ' HE1' ' A' ' 50' ' ' MET . 17.0 mm -71.48 -34.5 53.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.662 179.362 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.467 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 25.5 t-105 -54.33 -38.14 65.67 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.031 179.27 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.644 ' HG3' HD13 ' A' ' 103' ' ' ILE . 1.4 tt0 -85.55 -27.85 25.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.659 179.335 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.3 mtp85 -56.82 -50.65 71.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.13 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 76.6 m -84.97 -80.79 0.2 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.153 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -178.99 37.55 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.614 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.467 ' HA3' ' CD2' ' A' ' 97' ' ' TRP . . . -59.66 -59.59 10.27 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.492 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.923 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.8 mp -52.8 -30.39 15.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.808 0.337 . . . . 0.0 111.477 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.83 -45.34 74.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.003 0.43 . . . . 0.0 110.578 179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -68.23 -39.44 82.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.42 179.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.889 ' CD1' HD13 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -69.68 -50.97 38.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.03 -179.852 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -29.59 69.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.87 0.366 . . . . 0.0 110.789 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 6.1 m -69.01 -50.12 51.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.653 179.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.64 -32.73 68.27 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.507 0.67 . . . . 0.0 109.854 178.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.633 HD11 ' HA ' ' A' ' 121' ' ' THR . 9.3 mt -58.97 -48.48 86.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 114.869 -1.059 . . . . 0.0 110.584 179.428 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -70.57 -35.78 73.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.578 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.5 -15.39 62.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.055 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 9.5 mmm180 74.97 35.27 0.62 Allowed 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.876 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -108.67 -27.35 9.87 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.792 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.14 -172.09 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.149 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.416 ' HB2' ' HA3' ' A' ' 64' ' ' GLY . 3.2 ttt180 -129.66 93.7 34.11 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.906 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -50.41 89.47 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.532 2.155 . . . . 0.0 112.323 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 6.5 p -129.07 -51.97 1.21 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.878 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.447 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 13.4 t80 -165.56 -55.49 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.265 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.436 ' O ' ' HG3' ' A' ' 123' ' ' MET . . . -53.96 -42.61 69.1 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.273 -179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.633 ' HA ' HD11 ' A' ' 110' ' ' ILE . 10.2 p -66.6 -38.74 87.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.686 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.907 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -67.73 -58.41 4.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.145 0.498 . . . . 0.0 110.688 179.727 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' MET . . . . . 0.436 ' HG3' ' O ' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -53.04 -29.6 30.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.414 179.521 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.923 HD11 ' HA ' ' A' ' 103' ' ' ILE . 0.4 OUTLIER -66.39 -52.74 43.62 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.02 0.438 . . . . 0.0 109.944 178.961 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -49.87 -37.04 29.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.012 179.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -80.99 -34.19 33.18 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.227 179.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.06 -18.85 60.08 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.398 179.082 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.9 mt -86.34 -30.25 22.35 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.88 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.146 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.853 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.537 ' HB1' ' HB3' ' A' ' 4' ' ' GLN . . . . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 121.006 0.431 . . . . 0.0 110.966 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.902 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.1 OUTLIER -56.25 -59.4 4.99 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.741 -179.998 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.29 -39.63 64.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.731 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.537 ' HB3' ' HB1' ' A' ' 1' ' ' ALA . 7.6 tp60 -57.87 -36.74 72.78 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.358 179.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.469 ' HB2' ' HB2' ' A' ' 117' ' ' PRO . 1.0 OUTLIER -70.97 -57.04 4.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.099 179.443 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.902 HD12 ' O ' ' A' ' 2' ' ' ARG . 3.7 mp -52.45 -61.03 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.498 0.665 . . . . 0.0 109.996 178.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 53.8 t0 43.65 88.31 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.524 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.8 ptp -89.94 50.69 1.92 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.811 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 18.0 mttm -87.66 -35.24 18.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.904 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -180.0 3.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.93 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -82.42 158.14 23.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.015 -179.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.445 ' HG2' ' CZ ' ' A' ' 119' ' ' TYR . 8.2 mp0 -122.02 103.45 8.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.907 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.514 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -110.79 130.0 55.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.948 0.404 . . . . 0.0 110.893 179.829 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.518 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 0.9 OUTLIER -115.27 135.15 54.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.307 -179.946 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.6 ' CE1' HD11 ' A' ' 75' ' ' LEU . 0.3 OUTLIER -140.4 153.57 46.38 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.365 0.602 . . . . 0.0 112.219 -179.713 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.675 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.58 143.0 25.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.173 -0.921 . . . . 0.0 109.393 179.112 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.55 HG23 ' HB1' ' A' ' 86' ' ' ALA . 0.3 OUTLIER -141.05 135.63 15.42 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 120.857 0.36 . . . . 0.0 111.919 -179.376 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.492 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 61.7 Cg_endo -92.07 103.28 0.21 Allowed 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 123.301 2.667 . . . . 0.0 112.296 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 15.1 p90 -123.31 148.79 45.6 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.937 0.398 . . . . 0.0 110.934 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.459 HG21 ' HB2' ' A' ' 32' ' ' LYS . 3.8 mt -94.3 149.25 4.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.016 -179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -71.86 131.13 86.01 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.678 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.575 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 77.6 Cg_exo -40.21 -60.16 0.62 Allowed 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.974 2.449 . . . . 0.0 113.138 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.635 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -45.85 -53.8 9.16 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.866 -179.596 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.466 ' HB3' ' HA ' ' A' ' 32' ' ' LYS . 4.3 m-20 -62.96 -34.49 77.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.257 -178.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.575 ' HG3' ' HA ' ' A' ' 22' ' ' PRO . 1.1 mt-30 -58.12 -57.49 12.59 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.703 0.287 . . . . 0.0 111.631 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.635 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.6 p90 -84.71 -7.5 59.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.641 -179.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.542 ' HD2' ' HB1' ' A' ' 23' ' ' ALA . 4.0 mtpp -74.1 -42.93 59.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.843 0.354 . . . . 0.0 110.56 179.409 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -173.07 139.0 0.85 Allowed Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.037 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -69.81 -21.54 33.11 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.6 2.2 . . . . 0.0 112.366 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -97.97 -31.72 12.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.715 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -100.25 42.63 1.1 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.778 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.466 ' HA ' ' HB3' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -102.26 60.44 0.84 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.508 179.703 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.411 ' HB3' ' HG2' ' A' ' 54' ' ' PRO . 13.9 mmtp -36.92 115.82 0.4 Allowed 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.679 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -85.22 134.04 34.16 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.207 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.452 ' HA2' ' HD3' ' A' ' 54' ' ' PRO . . . -120.93 138.58 12.76 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.648 -0.786 . . . . 0.0 112.531 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.492 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 29.3 m-90 -97.91 148.05 23.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.905 0.383 . . . . 0.0 110.82 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.441 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 86.4 t90 -130.93 117.36 19.14 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.909 -179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.891 ' CE1' HD12 ' A' ' 52' ' ' LEU . 2.2 m-85 -112.67 152.81 28.56 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.847 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.677 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.77 124.74 0.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.302 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.518 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 12.1 t-160 -93.92 101.74 13.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.151 179.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.758 ' CZ ' HG21 ' A' ' 78' ' ' THR . 11.0 m-85 -85.86 126.19 33.87 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.513 -179.51 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.469 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 4.2 m-20 -100.09 116.92 33.24 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 178.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 59.63 -140.09 48.18 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 119.986 -1.102 . . . . 0.0 111.014 -178.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -72.1 -12.68 28.25 Favored 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.489 2.126 . . . . 0.0 112.208 179.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' TRP . . . . . . . . . . . . . 1.2 m95 -118.22 -168.25 1.49 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.936 0.398 . . . . 0.0 111.95 -178.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.677 ' CD1' ' HB1' ' A' ' 39' ' ' ALA . 4.3 tt -134.73 156.12 39.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.576 -179.429 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.703 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -132.45 -28.32 1.67 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.867 -0.606 . . . . 0.0 112.123 -179.472 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.472 ' CB ' ' HB3' ' A' ' 40' ' ' HIS . 6.5 ttm180 -115.57 133.53 55.94 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.828 0.347 . . . . 0.0 111.107 -179.559 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.467 ' HB3' ' HB3' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -137.63 134.14 35.15 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.853 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 3.1 ttm -141.16 111.77 6.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.724 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.644 ' HB3' HD12 ' A' ' 59' ' ' ILE . 0.0 OUTLIER -96.76 135.76 38.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.997 -179.74 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.891 HD12 ' CE1' ' A' ' 38' ' ' TYR . 38.3 mt -131.13 102.14 5.88 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.744 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.5 m170 -121.66 138.4 28.4 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.918 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.452 ' HD3' ' HA2' ' A' ' 35' ' ' GLY . 50.3 Cg_exo -54.44 -29.4 58.87 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.45 2.1 . . . . 0.0 112.388 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 37.2 p30 -95.75 -20.71 18.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.193 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.8 mttt -124.2 115.16 27.5 Favored Pre-proline 0 C--N 1.331 -0.2 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.834 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -47.17 173.34 0.03 OUTLIER 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.512 2.141 . . . . 0.0 112.451 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -54.53 88.5 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.489 2.126 . . . . 0.0 112.356 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.644 HD12 ' HB3' ' A' ' 51' ' ' GLU . 5.4 mt -65.77 104.6 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.906 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.629 ' HG ' ' HA2' ' A' ' 102' ' ' GLY . 0.0 OUTLIER -76.43 133.22 39.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.804 -179.995 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.971 HD21 ' HB3' ' A' ' 69' ' ' GLU . 0.7 OUTLIER -141.32 154.43 45.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.087 -179.928 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.5 p -157.63 144.09 9.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.826 179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.703 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -55.68 151.63 10.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.855 0.359 . . . . 0.0 111.198 -179.639 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.404 ' HA3' ' HB2' ' A' ' 116' ' ' ARG . . . 84.08 -63.3 4.46 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.68 -0.772 . . . . 0.0 112.217 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.95 -31.54 63.07 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.939 0.399 . . . . 0.0 110.573 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.426 ' CB ' ' HG ' ' A' ' 61' ' ' LEU . 9.3 m-20 -119.56 56.72 0.93 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.664 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.05 -32.22 73.26 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.071 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -85.57 -34.33 21.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.274 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.971 ' HB3' HD21 ' A' ' 61' ' ' LEU . 11.9 mp0 -81.15 -51.65 8.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.123 -179.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.433 ' CE ' ' N ' ' A' ' 63' ' ' ALA . 28.0 tpp -38.36 152.1 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.415 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.42 ' O ' ' CB ' ' A' ' 72' ' ' GLU . 0.5 OUTLIER -42.04 -60.15 1.52 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.221 179.97 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.42 ' CB ' ' O ' ' A' ' 71' ' ' CYS . 0.0 OUTLIER 83.51 -21.79 0.26 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.934 179.647 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.5 ' O ' HG23 ' A' ' 78' ' ' THR . 0.7 OUTLIER -94.74 122.48 37.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.644 0.259 . . . . 0.0 110.834 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.411 ' N ' ' CG ' ' A' ' 77' ' ' GLU . 7.2 m120 -50.83 176.09 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.886 0.374 . . . . 0.0 111.053 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.89 HD12 HG23 ' A' ' 81' ' ' THR . 0.6 OUTLIER -50.65 -46.71 58.52 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -179.2 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.92 -56.31 12.4 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.537 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.422 ' HG3' ' CA ' ' A' ' 73' ' ' LYS . 1.1 pm0 -61.45 -18.08 57.34 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.758 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.3 OUTLIER -74.81 -63.62 1.21 Allowed 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.917 179.843 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 122.83 -12.85 8.67 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.586 -0.816 . . . . 0.0 113.101 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.9 ' O ' ' HB3' ' A' ' 86' ' ' ALA . 3.4 mm? -54.13 -36.67 63.51 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.267 0.556 . . . . 0.0 110.387 179.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.89 HG23 HD12 ' A' ' 75' ' ' LEU . 45.9 p -83.94 -21.51 31.8 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.912 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 7.7 mtt180 -84.52 -11.89 55.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.592 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.624 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 0.3 OUTLIER -93.34 24.7 3.75 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.958 0.409 . . . . 0.0 111.34 -179.849 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 3.5 mmt85 37.73 93.94 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 77.64 46.53 9.66 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.764 -0.732 . . . . 0.0 113.585 178.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.9 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -101.82 16.6 25.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.79 0.295 . . . . 0.0 111.011 179.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.555 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -89.27 167.08 13.36 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.898 0.38 . . . . 0.0 111.353 -179.673 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.675 HG21 ' HB3' ' A' ' 16' ' ' ARG . 0.9 OUTLIER -143.45 -179.95 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.999 179.843 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.596 HD12 ' HB2' ' A' ' 91' ' ' ARG . 0.2 OUTLIER -101.76 155.77 36.01 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.743 179.742 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.29 -22.87 24.85 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.499 2.132 . . . . 0.0 112.404 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.596 ' HB2' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -57.91 -54.04 51.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.116 -179.847 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -66.4 -38.28 87.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.903 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.452 ' CE1' ' HD2' ' A' ' 48' ' ' ARG . 15.3 t80 -58.28 -53.15 61.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.919 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.411 ' OE1' ' NH1' ' A' ' 48' ' ' ARG . 0.2 OUTLIER -70.13 -23.56 63.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.782 179.852 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.27 -50.95 72.03 Favored 'General case' 0 CA--C 1.52 -0.209 0 N-CA-C 109.203 -0.666 . . . . 0.0 109.203 179.04 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.4 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 20.5 mm -74.8 -30.79 24.89 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.954 178.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.436 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 24.2 t-105 -57.6 -36.4 71.7 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.737 178.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -85.41 -29.4 24.42 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.289 179.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.4 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 7.7 mtm180 -56.66 -52.97 62.87 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.108 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 42.6 t -83.5 -82.02 0.16 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.3 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -177.02 37.47 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.525 -0.845 . . . . 0.0 112.791 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.629 ' HA2' ' HG ' ' A' ' 60' ' ' LEU . . . -56.08 -64.39 4.43 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.416 179.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.935 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.7 mp -52.94 -33.54 19.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.974 0.416 . . . . 0.0 111.181 179.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -68.17 -45.42 73.53 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.514 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -68.03 -41.69 81.75 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.424 179.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.927 ' CD1' HD13 ' A' ' 124' ' ' LEU . 0.3 OUTLIER -66.91 -51.13 59.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.83 179.86 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.425 ' HA ' ' HB ' ' A' ' 110' ' ' ILE . 0.0 OUTLIER -60.39 -29.23 68.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.846 179.919 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.404 ' N ' ' HG3' ' A' ' 107' ' ' GLN . 12.3 t -68.23 -50.69 52.37 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.735 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.99 -33.94 70.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.5 0.667 . . . . 0.0 109.35 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.495 HD12 HD22 ' A' ' 124' ' ' LEU . 10.3 mt -56.61 -46.11 82.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.009 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -68.63 -37.7 79.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.147 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.446 ' O ' ' HB2' ' A' ' 113' ' ' ARG . 5.2 t -72.27 -10.51 59.88 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.9 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.446 ' HB2' ' O ' ' A' ' 112' ' ' SER . 3.6 mpp_? 69.65 32.51 3.29 Favored 'General case' 0 C--O 1.23 0.079 0 CA-C-O 121.015 0.436 . . . . 0.0 111.097 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.5 mt-30 -106.3 -25.92 11.74 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.398 179.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -75.99 90.57 3.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.078 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.404 ' HB2' ' HA3' ' A' ' 64' ' ' GLY . 12.2 mtt180 -48.86 105.57 0.52 Allowed Pre-proline 0 C--N 1.331 -0.198 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.833 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.469 ' HB2' ' HB2' ' A' ' 5' ' ' GLU . 50.0 Cg_exo -53.44 98.84 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.392 2.061 . . . . 0.0 112.566 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.438 HG21 ' HB2' ' A' ' 47' ' ' ALA . 79.5 m -112.63 -43.86 3.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.609 179.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.622 ' HA ' HG23 ' A' ' 6' ' ' ILE . 14.8 t80 -178.23 -47.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.951 179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.461 ' O ' ' HG3' ' A' ' 123' ' ' MET . . . -56.31 -39.21 72.38 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.265 -179.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.65 HG22 HD22 ' A' ' 106' ' ' LEU . 37.7 p -68.98 -37.26 78.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.506 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.632 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -59.96 -58.35 8.93 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.214 0.53 . . . . 0.0 110.332 179.406 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' MET . . . . . 0.564 ' HE1' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -58.17 -29.4 65.57 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.167 178.934 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.935 HD11 ' HA ' ' A' ' 103' ' ' ILE . 0.3 OUTLIER -70.28 -46.93 63.35 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.145 0.498 . . . . 0.0 109.875 178.982 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 17.8 mm-40 -50.73 -40.98 55.77 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.652 -0.703 . . . . 0.0 109.807 179.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 28.4 m-20 -76.1 -34.35 59.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.857 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.634 HD22 HG12 ' A' ' 103' ' ' ILE . 0.1 OUTLIER -60.14 -20.0 56.36 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.374 178.893 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.476 ' O ' HD12 ' A' ' 128' ' ' LEU . 1.0 OUTLIER -148.5 81.82 1.46 Allowed 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.938 179.991 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.988 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.914 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.453 ' HB1' ' HB3' ' A' ' 4' ' ' GLN . . . . . . . . 0 N--CA 1.485 1.322 0 CA-C-O 120.989 0.423 . . . . 0.0 111.015 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.898 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.1 OUTLIER -58.44 -59.2 5.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.951 179.999 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.58 -38.28 59.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.738 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.453 ' HB3' ' HB1' ' A' ' 1' ' ' ALA . 1.2 tm0? -57.51 -47.36 82.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.885 0.374 . . . . 0.0 110.29 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -55.82 -53.54 55.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.134 -0.485 . . . . 0.0 109.931 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.898 HD12 ' O ' ' A' ' 2' ' ' ARG . 3.3 mp -56.24 -58.79 4.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.231 179.009 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.404 ' C ' ' O ' ' A' ' 6' ' ' ILE . 1.0 OUTLIER 30.79 72.91 0.06 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.904 -1.044 . . . . 0.0 111.853 -179.923 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.703 ' HG3' HG22 ' A' ' 6' ' ' ILE . 3.9 mtm -66.58 -72.8 0.15 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.163 -179.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.0 mtmm 50.27 29.72 3.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.137 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.6 176.12 8.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.997 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -81.59 137.28 35.52 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.995 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.445 ' HG3' ' CE2' ' A' ' 119' ' ' TYR . 33.7 mm-40 -100.72 102.74 13.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.751 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.572 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -110.27 124.75 52.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.031 -179.45 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.502 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 1.1 m-85 -110.77 152.91 26.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.473 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.777 ' HB2' HD22 ' A' ' 80' ' ' LEU . 4.4 m-85 -152.2 152.73 32.61 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.367 0.603 . . . . 0.0 112.178 -179.559 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.721 ' NH1' HD12 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -148.96 139.43 22.51 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.394 179.217 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.506 HG23 ' HB1' ' A' ' 86' ' ' ALA . 0.1 OUTLIER -142.25 125.72 9.6 Favored Pre-proline 0 C--N 1.329 -0.295 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.731 -179.319 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.501 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 67.9 Cg_endo -89.86 101.71 0.32 Allowed 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 123.065 2.51 . . . . 0.0 112.155 179.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 10.1 p90 -120.02 145.42 46.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.856 0.36 . . . . 0.0 110.912 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.481 HG12 ' HG3' ' A' ' 34' ' ' LYS . 3.0 mt -89.63 150.34 3.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.925 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.402 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 0.5 OUTLIER -72.15 126.65 91.1 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.719 179.963 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.596 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 70.3 Cg_exo -39.83 -60.33 0.57 Allowed 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 123.043 2.495 . . . . 0.0 113.097 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.672 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -44.87 -52.71 8.33 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.837 -179.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.516 ' HB3' ' HA ' ' A' ' 32' ' ' LYS . 2.1 m-20 -65.62 -37.06 85.52 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.539 -0.755 . . . . 0.0 112.508 -178.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.596 ' HG3' ' HA ' ' A' ' 22' ' ' PRO . 1.0 OUTLIER -54.91 -57.53 11.27 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -178.866 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.672 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.0 p90 -83.75 -16.75 43.6 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.706 -179.22 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.436 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -60.98 -47.1 88.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.755 0.312 . . . . 0.0 110.286 179.564 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 177.08 141.28 0.24 Allowed Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.124 179.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -62.42 -19.01 66.08 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.621 2.214 . . . . 0.0 112.289 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -86.34 -39.43 16.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.589 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -105.87 57.83 0.66 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.69 179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.516 ' HA ' ' HB3' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -111.7 54.76 0.68 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.607 -179.984 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.455 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.2 OUTLIER -41.58 138.46 1.35 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.549 -179.844 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.481 ' HG3' HG12 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -107.93 144.03 35.75 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.046 0.451 . . . . 0.0 111.862 -179.42 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -121.28 129.44 7.76 Favored Glycine 0 N--CA 1.45 -0.417 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.807 179.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.501 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 28.9 m-90 -98.08 133.99 41.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.013 0.435 . . . . 0.0 111.146 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.649 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 15.6 t90 -113.48 117.27 31.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.965 -179.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.686 ' CE1' HD12 ' A' ' 52' ' ' LEU . 10.9 m-85 -110.38 147.57 33.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.219 179.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.843 ' HB2' ' NE2' ' A' ' 49' ' ' GLN . . . -170.13 124.71 0.75 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.059 0.457 . . . . 0.0 111.992 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.504 ' HB3' ' CB ' ' A' ' 48' ' ' ARG . 12.7 t-160 -97.68 98.04 9.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.375 178.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.777 ' CZ ' HG21 ' A' ' 78' ' ' THR . 11.8 m-85 -85.32 119.34 25.59 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.715 -178.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.463 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 3.3 p-10 -91.21 114.8 27.43 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 178.451 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 57.69 -135.95 51.23 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 119.908 -1.139 . . . . 0.0 111.153 -178.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -72.62 -17.31 26.44 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 122.536 2.158 . . . . 0.0 112.444 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -115.36 -172.67 2.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.946 0.403 . . . . 0.0 111.8 -178.595 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.771 HD11 ' O ' ' A' ' 48' ' ' ARG . 2.8 tt -131.98 153.67 38.91 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.726 -179.567 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.409 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -127.24 -26.77 3.03 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.646 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.771 ' O ' HD11 ' A' ' 46' ' ' ILE . 2.1 ttp180 -117.5 136.77 53.0 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-O 120.817 0.341 . . . . 0.0 111.295 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.843 ' NE2' ' HB2' ' A' ' 39' ' ' ALA . 0.7 OUTLIER -145.12 132.48 20.65 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.887 179.967 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 2.5 ttm -143.48 129.45 19.55 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.677 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.482 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -114.11 140.71 48.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.165 -179.61 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.686 HD12 ' CE1' ' A' ' 38' ' ' TYR . 31.1 mt -135.29 108.53 7.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.811 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 33.0 m-70 -135.85 138.2 27.29 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.858 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.406 ' HG2' ' HB3' ' A' ' 33' ' ' LYS . 9.9 Cg_endo -52.8 -23.88 22.03 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.602 2.201 . . . . 0.0 112.254 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -96.18 -28.71 14.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.999 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 1.8 mtpp -118.3 122.14 30.51 Favored Pre-proline 0 C--O 1.233 0.229 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.844 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.36 -179.99 0.07 OUTLIER 'Trans proline' 0 C--N 1.348 0.536 0 C-N-CA 122.582 2.188 . . . . 0.0 112.237 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.417 ' O ' HD13 ' A' ' 60' ' ' LEU . 42.4 Cg_exo -56.75 85.08 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.545 2.163 . . . . 0.0 112.332 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.57 HG22 ' HG ' ' A' ' 61' ' ' LEU . 91.1 mt -65.42 98.06 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.8 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.469 HD21 ' N ' ' A' ' 102' ' ' GLY . 0.4 OUTLIER -82.2 112.83 19.58 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.703 -179.975 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.57 ' HG ' HG22 ' A' ' 59' ' ' ILE . 71.9 mt -123.6 148.24 46.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.071 0.462 . . . . 0.0 111.324 -179.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.641 HG12 ' HE2' ' A' ' 105' ' ' TYR . 13.4 p -149.43 150.66 13.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.787 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.417 ' HB1' ' HD3' ' A' ' 116' ' ' ARG . . . -58.38 145.81 36.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.846 0.355 . . . . 0.0 111.305 -179.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.409 ' HA3' ' HB2' ' A' ' 116' ' ' ARG . . . 87.92 -61.41 4.05 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.159 -179.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.542 ' NZ ' ' HB2' ' A' ' 109' ' ' ALA . 0.8 OUTLIER -72.23 -68.38 0.47 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.896 0.379 . . . . 0.0 110.603 179.735 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.427 ' HB3' HD22 ' A' ' 61' ' ' LEU . 0.7 OUTLIER -98.91 36.56 1.66 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.607 179.753 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.5 -21.28 36.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.284 -179.746 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 3.6 mpp? -82.13 -31.92 30.35 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.848 0.356 . . . . 0.0 110.659 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.449 ' HB3' HD13 ' A' ' 61' ' ' LEU . 1.9 mm-40 -84.69 -43.91 13.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.718 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.523 ' HE2' ' HB2' ' A' ' 49' ' ' GLN . 47.5 ttm -55.55 163.47 1.29 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.608 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.735 ' SG ' HG22 ' A' ' 78' ' ' THR . 0.5 OUTLIER -55.72 120.53 7.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.819 179.988 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -88.15 8.14 28.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.384 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.467 ' O ' HG23 ' A' ' 78' ' ' THR . 0.0 OUTLIER -117.4 144.71 44.69 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.901 179.884 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.456 ' O ' HG23 ' A' ' 78' ' ' THR . 8.7 m120 -65.59 -176.63 0.36 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.666 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.642 HD11 ' CZ ' ' A' ' 15' ' ' PHE . 28.1 tp -64.98 -43.83 91.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.407 -179.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.46 -31.87 69.19 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.066 -179.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -86.95 -26.03 24.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.666 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.777 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.7 OUTLIER -58.84 -76.44 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.771 0.32 . . . . 0.0 111.101 -179.762 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 140.27 -22.32 2.75 Favored Glycine 0 N--CA 1.453 -0.18 0 C-N-CA 120.51 -0.853 . . . . 0.0 113.005 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.777 HD22 ' HB2' ' A' ' 15' ' ' PHE . 1.0 OUTLIER -49.01 -42.8 39.26 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.89 0.376 . . . . 0.0 110.914 -179.908 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 45.7 p -71.75 -34.5 69.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.714 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 17.5 mmt180 -59.1 -33.47 70.88 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.6 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.96 179.69 0.5 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.915 179.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 1.9 mpp_? -93.91 73.34 4.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.572 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 78.63 66.62 1.7 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.232 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.591 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -93.31 24.94 3.59 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.689 0.281 . . . . 0.0 111.524 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.424 ' HA ' ' HA ' ' A' ' 15' ' ' PHE . 47.1 mt-10 -80.61 167.81 19.63 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.793 0.33 . . . . 0.0 110.889 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.721 HD12 ' NH1' ' A' ' 16' ' ' ARG . 2.4 tt -148.41 159.65 6.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.106 0.479 . . . . 0.0 110.86 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.472 ' N ' ' CG1' ' A' ' 88' ' ' ILE . 5.1 mp -78.54 145.15 66.86 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.877 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.76 -23.75 25.86 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.604 2.202 . . . . 0.0 112.441 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.15 -40.47 74.74 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.045 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.0 mt-30 -69.0 -45.88 69.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.911 0.386 . . . . 0.0 110.844 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.438 ' CE2' ' HB3' ' A' ' 38' ' ' TYR . 7.6 t80 -56.09 -53.13 60.77 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.609 179.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.411 ' OE2' ' NH1' ' A' ' 48' ' ' ARG . 0.0 OUTLIER -68.2 -23.34 64.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.675 179.689 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.21 -50.2 74.59 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 121.246 0.546 . . . . 0.0 109.55 179.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.452 HG21 HD11 ' A' ' 52' ' ' LEU . 17.5 mm -74.41 -35.26 38.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.384 179.114 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.44 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 9.7 t-105 -53.12 -40.14 63.97 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.953 179.246 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.645 ' HG3' HD13 ' A' ' 103' ' ' ILE . 10.2 tt0 -85.69 -26.97 25.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.748 179.225 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.84 -45.75 82.18 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.131 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 40.6 t -91.24 -79.22 0.37 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.039 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 179.18 36.95 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.686 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.469 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -59.9 -57.81 17.43 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.344 179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.846 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.7 mp -53.03 -34.9 21.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.797 0.332 . . . . 0.0 111.233 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.04 -43.36 82.95 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.022 0.439 . . . . 0.0 110.29 179.492 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.641 ' HE2' HG12 ' A' ' 62' ' ' VAL . 92.7 t80 -67.97 -38.89 83.27 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.493 179.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.904 ' CD1' HD13 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -70.63 -50.85 32.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.856 179.96 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.419 ' HA ' ' HB ' ' A' ' 110' ' ' ILE . 0.0 OUTLIER -59.97 -29.48 68.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.811 -179.941 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.409 ' N ' ' HG3' ' A' ' 107' ' ' GLN . 37.1 p -69.86 -50.49 42.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.554 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.542 ' HB2' ' NZ ' ' A' ' 65' ' ' LYS . . . -71.54 -30.24 65.67 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.534 0.683 . . . . 0.0 109.516 178.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.744 HD11 HD22 ' A' ' 106' ' ' LEU . 15.9 mt -61.21 -49.33 85.07 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.467 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.229 179.075 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -66.07 -37.96 87.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.43 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 63.8 m -82.17 -4.94 58.04 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.959 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? 63.91 64.05 0.79 Allowed 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 121.071 0.462 . . . . 0.0 111.07 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -151.59 25.09 0.68 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.52 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -104.89 -9.87 17.7 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.506 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.417 ' HD3' ' HB1' ' A' ' 63' ' ' ALA . 22.5 ttt180 65.13 86.33 0.14 Allowed Pre-proline 0 C--N 1.332 -0.167 0 CA-C-O 120.799 0.333 . . . . 0.0 110.919 -179.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -50.35 99.53 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.568 2.178 . . . . 0.0 112.164 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.487 ' C ' HG23 ' A' ' 6' ' ' ILE . 0.6 OUTLIER -129.41 -45.22 1.22 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.957 -179.829 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.445 ' CE2' ' HG3' ' A' ' 12' ' ' GLN . 16.3 t80 -177.66 -52.17 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.952 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.539 ' HB1' HD11 ' A' ' 106' ' ' LEU . . . -53.94 -39.51 65.96 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.243 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.619 HG22 ' CD2' ' A' ' 106' ' ' LEU . 40.2 p -67.05 -40.89 87.24 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.857 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.599 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -66.33 -57.87 6.55 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 121.096 0.474 . . . . 0.0 110.684 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' MET . . . . . 0.583 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -53.1 -29.65 31.84 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.209 179.455 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.904 HD13 ' CD1' ' A' ' 106' ' ' LEU . 0.3 OUTLIER -69.66 -48.69 58.92 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 121.129 0.49 . . . . 0.0 110.03 178.821 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.443 ' HA ' HD12 ' A' ' 128' ' ' LEU . 36.5 mm-40 -50.32 -36.27 31.23 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.065 179.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -83.21 -32.67 26.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.975 178.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.583 HD13 ' CE ' ' A' ' 123' ' ' MET . 0.2 OUTLIER -62.69 -17.56 60.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.453 179.138 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.443 HD12 ' HA ' ' A' ' 125' ' ' GLN . 12.1 mt -88.13 -19.5 26.9 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.226 -179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 8.6 mmtt . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.022 -179.926 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.815 0.341 . . . . 0.0 111.192 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.555 ' O ' HD12 ' A' ' 6' ' ' ILE . 8.0 mmt180 -57.55 -64.0 1.04 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.431 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -53.26 -36.98 61.7 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.226 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -58.61 -33.74 70.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.301 179.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -74.58 -47.89 29.88 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.382 179.599 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.555 HD12 ' O ' ' A' ' 2' ' ' ARG . 2.8 mp -59.66 -63.52 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.389 179.418 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.3 p30 40.58 79.9 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.471 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 4.1 mtm -54.85 -73.58 0.05 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.286 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.13 29.92 17.41 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.031 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -146.0 167.09 24.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.895 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.1 mm100 -80.64 154.38 27.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.077 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.441 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 9.3 mp0 -113.48 107.61 16.06 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.789 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.501 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -108.15 127.62 53.98 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.902 0.382 . . . . 0.0 111.039 -179.642 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.507 ' CE2' ' CD2' ' A' ' 40' ' ' HIS . 1.4 m-85 -114.09 151.14 32.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.389 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.889 ' HB2' HD22 ' A' ' 80' ' ' LEU . 9.0 m-85 -150.24 157.72 43.39 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.185 0.517 . . . . 0.0 112.062 -179.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.643 ' CB ' HG21 ' A' ' 88' ' ' ILE . 34.3 ttp180 -149.21 149.66 31.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.835 179.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.525 HD11 ' CD2' ' A' ' 80' ' ' LEU . 0.0 OUTLIER -151.47 115.77 3.1 Favored Pre-proline 0 C--N 1.33 -0.272 0 C-N-CA 121.066 -0.254 . . . . 0.0 111.284 -179.858 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.416 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 89.8 Cg_endo -82.85 85.24 1.62 Allowed 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 122.725 2.284 . . . . 0.0 112.301 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.444 ' CE2' ' HB2' ' A' ' 37' ' ' TRP . 9.0 p90 -103.91 140.47 37.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.998 0.427 . . . . 0.0 110.729 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.629 HG21 ' HB2' ' A' ' 32' ' ' LYS . 17.4 mt -91.47 141.5 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.2 -179.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.7 135.91 86.52 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.586 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.477 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 51.4 Cg_exo -54.52 -55.68 3.12 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.388 2.059 . . . . 0.0 112.949 -179.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.566 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -51.13 -54.96 20.37 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.71 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.538 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 40.7 m-20 -70.88 -31.04 67.58 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.158 -179.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -52.33 -57.11 10.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.65 -179.474 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.566 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.3 p90 -88.55 -19.14 26.75 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.594 -179.397 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.538 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 1.7 mtpp -56.04 -54.98 38.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.915 0.388 . . . . 0.0 110.801 179.744 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.8 p30 -167.27 144.79 3.92 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.327 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.404 ' HA ' ' HD2' ' A' ' 32' ' ' LYS . 70.6 Cg_endo -73.35 -4.42 15.39 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.709 2.272 . . . . 0.0 112.764 179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -98.3 -40.58 8.26 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.856 0.36 . . . . 0.0 110.928 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -109.07 34.3 3.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.803 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.629 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -66.31 -33.22 75.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.08 -179.919 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.56 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.9 OUTLIER 59.68 108.33 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.78 -179.795 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.418 ' N ' ' HG2' ' A' ' 54' ' ' PRO . 0.2 OUTLIER -88.82 112.93 23.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.565 -179.933 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.438 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -92.67 122.02 6.73 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.621 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.416 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 15.5 m-90 -98.62 121.0 40.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.871 0.367 . . . . 0.0 110.677 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.701 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 21.9 t90 -108.44 117.5 34.32 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.326 -179.429 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.92 ' CE1' HD12 ' A' ' 52' ' ' LEU . 14.2 m-85 -110.98 153.3 25.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.259 179.422 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.625 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -165.79 124.07 1.56 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.131 0.491 . . . . 0.0 111.681 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.507 ' CD2' ' CE2' ' A' ' 14' ' ' PHE . 11.7 t-160 -97.65 94.71 7.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.671 179.086 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.755 ' HZ ' HG21 ' A' ' 78' ' ' THR . 13.6 m-85 -78.03 149.19 34.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.472 -179.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.471 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 88.0 m-20 -122.64 110.83 16.02 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.14 178.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.47 -132.58 50.04 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.051 -1.071 . . . . 0.0 111.152 -178.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.408 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 5.7 Cg_exo -73.64 -18.19 22.62 Favored 'Trans proline' 0 N--CA 1.464 -0.261 0 C-N-CA 122.557 2.171 . . . . 0.0 112.505 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' TRP . . . . . 0.429 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.5 OUTLIER -117.51 -164.76 1.02 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.87 0.366 . . . . 0.0 111.769 -178.492 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.803 HD11 ' O ' ' A' ' 48' ' ' ARG . 3.3 tt -136.66 152.98 29.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.183 -179.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.698 ' HB2' HG21 ' A' ' 118' ' ' THR . . . -125.28 -18.9 5.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.839 -0.619 . . . . 0.0 112.071 -179.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.803 ' O ' HD11 ' A' ' 46' ' ' ILE . 8.5 mtt180 -132.79 136.63 46.41 Favored 'General case' 0 N--CA 1.458 -0.07 0 CA-C-O 120.854 0.359 . . . . 0.0 111.406 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.449 ' HB3' ' HB3' ' A' ' 61' ' ' LEU . 0.8 OUTLIER -146.74 118.73 8.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.827 179.824 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.543 ' HE1' ' HB ' ' A' ' 96' ' ' ILE . 16.1 ttp -112.83 118.05 33.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.714 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.426 ' O ' ' HA ' ' A' ' 58' ' ' PRO . 8.8 mt-10 -101.52 118.39 36.86 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.381 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.92 HD12 ' CE1' ' A' ' 38' ' ' TYR . 13.8 mt -119.27 116.53 26.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.627 179.697 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.443 ' HB2' ' HB2' ' A' ' 56' ' ' LYS . 7.9 m-70 -129.94 130.94 23.2 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-O 120.63 0.253 . . . . 0.0 111.004 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.418 ' HG2' ' N ' ' A' ' 34' ' ' LYS . 58.8 Cg_exo -51.65 -24.62 17.98 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 122.399 2.066 . . . . 0.0 112.391 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.6 p-10 -104.15 -22.94 13.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.205 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.443 ' HB2' ' HB2' ' A' ' 53' ' ' HIS . 0.3 OUTLIER -119.66 127.87 26.19 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.63 -0.259 . . . . 0.0 110.946 179.828 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_endo -49.71 171.65 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.664 2.243 . . . . 0.0 112.451 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.426 ' HA ' ' O ' ' A' ' 51' ' ' GLU . 27.6 Cg_endo -62.68 77.61 0.11 Allowed 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.605 2.203 . . . . 0.0 112.354 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.403 ' HB ' ' HB2' ' A' ' 51' ' ' GLU . 6.7 mt -56.92 100.37 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 121.088 0.471 . . . . 0.0 110.765 179.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.519 HD21 ' HA2' ' A' ' 102' ' ' GLY . 0.4 OUTLIER -76.43 131.84 39.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.062 -179.694 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.688 HD21 ' HB3' ' A' ' 69' ' ' GLU . 0.3 OUTLIER -132.19 146.66 52.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.72 179.93 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.748 HG21 HD21 ' A' ' 106' ' ' LEU . 13.6 p -150.75 137.16 12.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.224 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.04 167.68 2.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.273 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.25 -66.52 0.72 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.521 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.46 ' HG3' ' HB1' ' A' ' 109' ' ' ALA . 0.1 OUTLIER -70.1 -66.49 0.59 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.925 0.393 . . . . 0.0 110.949 -179.929 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.507 ' HB3' HD13 ' A' ' 61' ' ' LEU . 16.4 t0 -101.59 56.4 0.83 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.945 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.18 -17.43 62.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.592 -179.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 2.4 mtm -77.09 -30.9 55.61 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.895 0.379 . . . . 0.0 110.748 -179.715 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.688 ' HB3' HD21 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -98.6 -21.44 16.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.196 179.984 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.3 -176.48 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.169 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.677 ' SG ' HD13 ' A' ' 46' ' ' ILE . 8.1 m -63.61 -47.25 82.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.795 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 70.29 25.35 4.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.112 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.41 ' HB2' HG23 ' A' ' 78' ' ' THR . 0.0 OUTLIER -148.64 154.41 39.66 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.705 179.833 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -79.54 -170.97 2.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.397 179.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.866 HD11 ' CZ ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -59.21 -53.1 62.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.252 -179.713 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.75 -44.75 66.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.175 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -54.78 -33.0 60.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.58 -179.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.755 HG21 ' HZ ' ' A' ' 41' ' ' PHE . 0.8 OUTLIER -71.35 -69.3 0.39 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.065 -179.646 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 133.48 -19.65 4.24 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.863 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.889 HD22 ' HB2' ' A' ' 15' ' ' PHE . 1.3 mp -51.85 -34.32 40.14 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.85 0.357 . . . . 0.0 111.025 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.778 ' CG2' HD12 ' A' ' 75' ' ' LEU . 0.2 OUTLIER -77.14 -43.07 35.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.654 179.733 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.409 ' HB3' ' NH1' ' A' ' 82' ' ' ARG . 0.1 OUTLIER -60.06 -29.74 68.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.716 179.786 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -168.16 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.889 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.0 77.37 1.24 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.801 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 72.05 68.06 1.7 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.402 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.572 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -96.55 21.16 9.63 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.691 0.282 . . . . 0.0 111.267 179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -86.1 150.18 24.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.924 0.392 . . . . 0.0 111.1 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.643 HG21 ' CB ' ' A' ' 16' ' ' ARG . 1.3 pt -133.67 -179.66 3.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.004 179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.921 HD12 ' HB3' ' A' ' 91' ' ' ARG . 0.8 OUTLIER -96.32 141.5 23.22 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.707 179.753 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -66.12 -13.86 41.77 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.577 2.184 . . . . 0.0 112.688 -179.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.921 ' HB3' HD12 ' A' ' 89' ' ' LEU . 2.7 tpm_? -73.39 -49.89 24.77 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.43 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.428 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 0.2 OUTLIER -65.26 -42.93 92.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.968 0.413 . . . . 0.0 110.675 179.824 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -56.54 -53.39 58.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.555 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.27 -19.74 62.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.464 179.465 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.428 ' HB2' ' HA ' ' A' ' 92' ' ' GLN . 0.5 OUTLIER -61.25 -50.42 73.14 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 179.162 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.569 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 19.0 mm -73.72 -33.84 39.27 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.445 179.033 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.446 ' CH2' ' HG ' ' A' ' 60' ' ' LEU . 10.0 t-105 -53.03 -39.45 63.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.242 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -85.89 -30.54 22.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.609 179.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.569 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -58.13 -52.12 66.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.23 -179.882 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 32.4 m -78.29 -71.1 0.45 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.089 -179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 163.38 40.5 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.638 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.519 ' HA2' HD21 ' A' ' 60' ' ' LEU . . . -60.35 -47.86 89.01 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.37 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.681 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.7 mp -56.55 -34.63 42.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.847 0.356 . . . . 0.0 111.426 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -67.84 -48.69 65.45 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.836 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -67.73 -41.14 83.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.715 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.789 HD12 HD11 ' A' ' 110' ' ' ILE . 0.2 OUTLIER -67.84 -50.63 55.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.945 179.954 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.41 ' HG3' ' N ' ' A' ' 108' ' ' SER . 0.0 OUTLIER -60.78 -29.54 69.5 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.78 179.801 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.41 ' N ' ' HG3' ' A' ' 107' ' ' GLN . 4.1 m -67.99 -50.81 53.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.604 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.516 ' HB1' ' HB2' ' A' ' 114' ' ' GLN . . . -71.43 -32.33 68.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.413 0.625 . . . . 0.0 109.732 179.021 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.789 HD11 HD12 ' A' ' 106' ' ' LEU . 5.0 mt -56.76 -49.16 79.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.406 179.073 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -69.42 -36.61 76.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.51 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 51.9 m -74.83 -9.29 58.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.282 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 70.86 39.81 1.01 Allowed 'General case' 0 N--CA 1.461 0.079 0 CA-C-O 120.901 0.381 . . . . 0.0 111.033 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . 0.516 ' HB2' ' HB1' ' A' ' 109' ' ' ALA . 13.6 mt-30 -111.74 -28.99 7.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.835 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.452 ' HB1' ' CG2' ' A' ' 121' ' ' THR . . . -58.01 -166.81 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.144 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.593 ' O ' HG22 ' A' ' 118' ' ' THR . 5.1 ttt180 -132.56 93.64 24.25 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.03 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.431 ' HB3' HG13 ' A' ' 6' ' ' ILE . 51.9 Cg_exo -52.8 89.06 0.03 OUTLIER 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.61 2.207 . . . . 0.0 112.116 179.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.698 HG21 ' HB2' ' A' ' 47' ' ' ALA . 4.6 t -132.88 -49.67 0.88 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.237 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.441 ' CE2' ' HG2' ' A' ' 12' ' ' GLN . 12.1 t80 -163.21 -62.28 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.889 0.376 . . . . 0.0 111.163 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.572 ' HB1' ' NE ' ' A' ' 48' ' ' ARG . . . -53.85 -38.47 64.72 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.445 -179.59 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.51 HG22 ' CG1' ' A' ' 110' ' ' ILE . 0.9 OUTLIER -67.38 -44.64 78.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.693 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.49 ' HB2' HD13 ' A' ' 6' ' ' ILE . . . -62.56 -58.11 8.72 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.156 0.503 . . . . 0.0 110.696 179.56 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' MET . . . . . 0.759 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -53.56 -29.98 39.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.485 179.512 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.681 HD11 ' HA ' ' A' ' 103' ' ' ILE . 0.2 OUTLIER -66.54 -50.59 62.64 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.037 0.446 . . . . 0.0 109.922 178.863 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -49.77 -37.52 30.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.74 179.19 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -82.73 -31.46 28.45 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.014 178.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.759 HD13 ' CE ' ' A' ' 123' ' ' MET . 0.4 OUTLIER -61.4 -18.81 60.54 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.514 179.21 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.689 ' O ' HD12 ' A' ' 128' ' ' LEU . 0.9 OUTLIER -134.13 79.46 1.81 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.066 -179.962 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.918 179.966 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.3 0 CA-C-O 120.866 0.365 . . . . 0.0 111.056 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.669 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.4 OUTLIER -58.2 -62.28 1.95 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.64 179.847 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -53.77 -32.19 51.49 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.624 179.548 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -63.72 -37.16 86.31 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.404 179.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -73.91 -55.89 5.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.116 179.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.669 HD12 ' O ' ' A' ' 2' ' ' ARG . 4.9 mp -61.15 -59.72 3.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.356 179.238 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.1 t70 41.14 72.63 0.15 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.963 -1.017 . . . . 0.0 111.409 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 8.5 mtm -57.24 -82.44 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.031 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.3 mttm 49.49 34.08 6.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.826 0.346 . . . . 0.0 111.124 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -139.72 164.12 30.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.069 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -78.97 117.06 19.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.868 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 94.8 mm-40 -84.94 102.66 13.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.899 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.536 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 1.5 mmp_? -119.82 144.0 47.57 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.849 0.357 . . . . 0.0 110.645 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.527 ' CD1' ' N ' ' A' ' 14' ' ' PHE . 0.9 OUTLIER -123.98 134.85 53.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.346 -179.653 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.889 ' HB2' HD22 ' A' ' 80' ' ' LEU . 7.7 m-85 -135.36 152.59 51.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.337 0.589 . . . . 0.0 111.971 -179.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.539 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.0 OUTLIER -149.4 142.62 25.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.691 179.15 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -145.88 127.27 7.53 Favored Pre-proline 0 C--N 1.328 -0.36 0 C-N-CA 120.709 -0.396 . . . . 0.0 111.983 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.415 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 60.7 Cg_endo -89.64 91.19 0.35 Allowed 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 123.176 2.584 . . . . 0.0 111.97 179.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.407 ' CD1' ' O ' ' A' ' 19' ' ' PHE . 27.1 p90 -111.27 133.96 53.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.983 0.421 . . . . 0.0 111.238 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.683 HG23 ' O ' ' A' ' 33' ' ' LYS . 17.2 mt -89.94 142.78 12.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.763 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 mtt180 -60.08 130.11 88.83 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.215 179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.455 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 9.3 Cg_endo -52.75 -50.93 12.35 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.46 2.107 . . . . 0.0 112.497 -179.567 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.54 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -53.98 -58.33 7.7 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.334 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.59 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 10.3 m-20 -66.0 -33.49 75.92 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.97 -179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -50.66 -54.63 21.48 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.469 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.54 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.4 p90 -95.8 -12.38 25.41 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.841 -179.529 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.59 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 1.6 mtpp -62.17 -48.61 79.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.93 0.395 . . . . 0.0 110.566 179.704 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -160.95 140.91 8.19 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.155 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_endo -73.19 -5.74 17.7 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.621 2.214 . . . . 0.0 112.592 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -108.17 -33.92 7.0 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.897 0.38 . . . . 0.0 110.605 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -97.82 30.17 3.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.763 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 15.6 mttt -65.43 -59.98 3.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.976 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.683 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.0 OUTLIER 62.83 121.44 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.519 -179.519 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.98 131.46 45.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.045 -179.315 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -103.88 121.64 7.11 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.187 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.432 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 8.0 m-90 -97.81 119.62 36.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.903 0.382 . . . . 0.0 110.758 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.597 ' HZ3' HD11 ' A' ' 80' ' ' LEU . 21.6 t90 -108.68 117.5 34.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.07 -179.633 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.873 ' CE1' HD12 ' A' ' 52' ' ' LEU . 4.5 m-85 -110.76 154.34 24.05 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.266 179.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.826 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.38 123.83 0.69 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.123 0.487 . . . . 0.0 111.554 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.507 ' CG ' ' CE2' ' A' ' 14' ' ' PHE . 9.0 t-160 -95.57 96.05 8.79 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 178.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.803 ' HZ ' HG21 ' A' ' 78' ' ' THR . 7.4 m-85 -75.12 159.49 31.59 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.255 0.55 . . . . 0.0 111.433 -178.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.54 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.6 OUTLIER -133.09 120.35 21.16 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.113 179.003 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 58.39 -137.43 50.09 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 119.881 -1.152 . . . . 0.0 110.96 -178.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.401 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 6.2 Cg_exo -73.34 -16.23 24.83 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.456 2.104 . . . . 0.0 112.21 179.331 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' TRP . . . . . 0.418 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.8 OUTLIER -119.24 -158.85 0.75 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.344 -178.56 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.826 ' CD1' ' HB1' ' A' ' 39' ' ' ALA . 5.6 tt -130.82 154.84 41.3 Favored 'Isoleucine or valine' 0 C--O 1.231 0.108 0 CA-C-O 121.059 0.457 . . . . 0.0 112.089 -179.439 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -112.29 -35.44 5.6 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.457 -179.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.568 ' O ' HD11 ' A' ' 46' ' ' ILE . 0.0 OUTLIER -150.85 158.25 43.91 Favored 'General case' 0 N--CA 1.462 0.142 0 C-N-CA 120.255 -0.578 . . . . 0.0 111.781 -179.392 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.504 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 21.8 pt20 -161.17 159.25 28.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.407 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.479 ' HE3' ' N ' ' A' ' 97' ' ' TRP . 0.0 OUTLIER -134.24 122.7 23.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.436 179.46 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.463 ' HB2' ' HB ' ' A' ' 59' ' ' ILE . 2.1 mt-10 -90.09 115.71 27.56 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.838 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.873 HD12 ' CE1' ' A' ' 38' ' ' TYR . 33.1 mt -119.09 101.86 8.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.937 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.418 ' CD2' ' N ' ' A' ' 53' ' ' HIS . 3.2 m-70 -135.11 136.26 24.44 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.565 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.431 ' HG2' ' HB3' ' A' ' 33' ' ' LYS . 10.0 Cg_endo -51.08 -28.65 25.61 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.713 2.276 . . . . 0.0 112.215 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 15.2 p30 -96.41 -26.37 15.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.816 179.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -113.1 112.6 49.73 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.77 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -50.01 175.05 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.468 2.112 . . . . 0.0 112.433 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -60.95 79.38 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.616 2.21 . . . . 0.0 112.357 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.463 ' HB ' ' HB2' ' A' ' 51' ' ' GLU . 7.6 mt -77.49 93.32 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.022 0.439 . . . . 0.0 110.502 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.66 HD13 ' HA2' ' A' ' 102' ' ' GLY . 2.8 mt -75.49 107.44 7.63 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.977 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.881 HD13 ' HA ' ' A' ' 70' ' ' MET . 3.8 mt -98.32 153.41 18.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.912 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.689 HG21 HD21 ' A' ' 106' ' ' LEU . 13.7 p -154.78 142.07 12.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.952 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.67 164.66 1.95 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.397 -179.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 66.68 -76.5 0.15 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.417 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.88 -61.79 2.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.977 0.418 . . . . 0.0 110.808 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.483 ' CB ' HD23 ' A' ' 61' ' ' LEU . 7.5 m-20 -108.14 42.83 1.3 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.672 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.61 -17.4 64.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.434 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -76.81 -28.05 55.42 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.803 0.335 . . . . 0.0 110.669 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.857 ' CG ' HD21 ' A' ' 61' ' ' LEU . 4.2 pm0 -109.19 -23.84 11.42 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.249 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.881 ' HA ' HD13 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -50.4 176.55 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.868 0.366 . . . . 0.0 110.981 179.723 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.507 ' HB3' HG21 ' A' ' 46' ' ' ILE . 7.0 t -52.33 -66.7 0.34 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.802 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 72.37 7.12 5.63 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.516 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.47 157.9 18.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.962 0.41 . . . . 0.0 111.045 179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -83.04 168.3 17.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.222 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.464 HD11 ' CE2' ' A' ' 15' ' ' PHE . 4.2 mm? -53.91 -53.58 50.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.747 0.308 . . . . 0.0 111.601 -179.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.56 -31.63 68.74 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.685 -179.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -70.34 -40.8 73.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.462 -179.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.803 HG21 ' HZ ' ' A' ' 41' ' ' PHE . 0.2 OUTLIER -54.8 -76.58 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.306 -179.584 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 143.27 -24.21 2.21 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.508 -0.853 . . . . 0.0 113.007 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.889 HD22 ' HB2' ' A' ' 15' ' ' PHE . 1.0 OUTLIER -53.94 -48.58 70.09 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.06 0.457 . . . . 0.0 110.538 179.875 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -59.53 -48.32 82.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.614 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.76 -30.11 68.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.635 179.605 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.34 177.35 0.5 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.811 179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -87.96 78.28 8.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.826 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 69.27 68.51 1.62 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.372 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -90.84 16.31 9.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.465 0.174 . . . . 0.0 111.463 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -84.03 155.15 22.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.953 0.406 . . . . 0.0 111.186 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.539 HG21 ' HB3' ' A' ' 16' ' ' ARG . 0.8 OUTLIER -136.95 179.04 4.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.964 179.748 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.578 ' H ' HD12 ' A' ' 89' ' ' LEU . 1.8 mp -94.07 137.93 22.79 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.607 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.72 -21.18 62.06 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.437 2.092 . . . . 0.0 112.334 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.12 -39.43 72.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.997 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -70.12 -50.44 40.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.009 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.45 ' CZ ' ' HG2' ' A' ' 50' ' ' MET . 16.7 t80 -54.91 -49.42 71.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.767 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.14 -21.93 61.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.748 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.9 -50.44 72.18 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.2 0.524 . . . . 0.0 109.614 179.131 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.438 ' HB ' ' HE3' ' A' ' 50' ' ' MET . 20.8 mm -77.47 -34.11 20.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.671 179.336 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.508 ' CZ3' HD23 ' A' ' 60' ' ' LEU . 53.0 t-105 -52.96 -40.55 63.78 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.919 179.353 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -86.15 -30.16 22.7 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.453 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -56.78 -54.15 49.62 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.221 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 95.3 m -75.8 -82.06 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.003 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -178.62 35.99 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.515 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.66 ' HA2' HD13 ' A' ' 60' ' ' LEU . . . -67.69 -37.66 89.22 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.607 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.655 ' CD1' HD22 ' A' ' 127' ' ' LEU . 30.9 mm -70.21 -39.41 76.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.855 0.359 . . . . 0.0 111.162 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.7 -42.92 97.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.974 0.416 . . . . 0.0 110.425 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -67.53 -42.99 81.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.717 179.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.856 HD12 HD11 ' A' ' 110' ' ' ILE . 0.2 OUTLIER -66.49 -50.25 63.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.056 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.422 ' HA ' ' HB ' ' A' ' 110' ' ' ILE . 0.0 OUTLIER -60.9 -29.56 69.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.024 -179.962 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . 0.401 ' N ' ' HG3' ' A' ' 107' ' ' GLN . 8.5 t -68.87 -50.49 49.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.76 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.09 -31.1 65.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.351 0.596 . . . . 0.0 109.505 178.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.856 HD11 HD12 ' A' ' 106' ' ' LEU . 10.7 mt -56.96 -48.8 80.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.127 179.136 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -69.53 -39.35 77.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.577 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.39 -12.03 61.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.191 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 73.2 35.83 0.89 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.842 0.353 . . . . 0.0 110.908 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -106.8 -28.91 9.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.661 179.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.99 -170.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.025 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -140.16 96.21 8.15 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.951 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -45.88 107.09 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.509 2.14 . . . . 0.0 112.276 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.585 ' C ' HG23 ' A' ' 6' ' ' ILE . 1.7 p -144.69 -45.82 0.24 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.171 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -174.37 -49.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.916 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.436 ' O ' ' HB2' ' A' ' 124' ' ' LEU . . . -58.14 -39.06 77.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.232 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.473 HG22 ' CD1' ' A' ' 106' ' ' LEU . 40.3 p -68.64 -44.76 73.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.746 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.21 -58.26 9.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.089 0.471 . . . . 0.0 110.427 179.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' MET . . . . . 0.54 ' HE2' ' N ' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -56.19 -29.59 61.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.18 179.22 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.54 ' N ' ' HE2' ' A' ' 123' ' ' MET . 0.0 OUTLIER -67.65 -51.36 50.84 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.003 0.43 . . . . 0.0 109.943 178.956 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 46.6 mm-40 -49.75 -38.39 33.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.067 179.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 23.5 m-80 -79.63 -34.23 40.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.227 179.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.655 HD22 ' CD1' ' A' ' 103' ' ' ILE . 0.3 OUTLIER -61.49 -18.68 60.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.387 179.065 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.626 ' O ' HD12 ' A' ' 128' ' ' LEU . 1.0 OUTLIER -148.23 84.07 1.5 Allowed 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.873 -179.893 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.304 -0.855 . . . . 0.0 110.938 179.918 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.787 ' HB1' ' HB2' ' A' ' 4' ' ' GLN . . . . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.912 0.386 . . . . 0.0 110.974 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.9 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -57.44 -61.01 2.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.984 179.961 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -64.36 -34.32 77.89 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.369 179.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.787 ' HB2' ' HB1' ' A' ' 1' ' ' ALA . 3.6 mm-40 -57.66 -33.09 67.96 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.593 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.93 -53.03 7.92 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.119 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.9 HD12 ' O ' ' A' ' 2' ' ' ARG . 2.7 mp -61.03 -62.55 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.45 0.643 . . . . 0.0 110.225 179.124 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.4 t70 42.33 75.15 0.09 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.81 -1.086 . . . . 0.0 111.535 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.2 ptp -57.4 -70.09 0.14 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.161 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.4 mttt 45.31 40.91 5.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.967 0.413 . . . . 0.0 111.419 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.86 161.35 38.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.004 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 87.8 mm-40 -70.23 146.93 50.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.593 179.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.9 mp0 -112.82 113.73 25.95 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.918 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.473 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.7 OUTLIER -126.0 124.09 39.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.051 179.842 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.501 ' CD1' ' N ' ' A' ' 14' ' ' PHE . 0.2 OUTLIER -113.67 134.66 54.6 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.699 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.912 ' HB2' HD22 ' A' ' 80' ' ' LEU . 1.9 m-85 -133.5 160.65 36.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.28 0.562 . . . . 0.0 112.179 -178.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.647 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.4 OUTLIER -149.11 144.09 26.42 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.827 179.625 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.462 ' HA ' ' HD3' ' A' ' 18' ' ' PRO . 0.7 OUTLIER -153.22 117.5 2.81 Favored Pre-proline 0 C--N 1.33 -0.269 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.96 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.489 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 1.2 Cg_endo -83.67 89.27 1.05 Allowed 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 123.057 2.504 . . . . 0.0 111.781 179.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.421 ' CD1' ' O ' ' A' ' 19' ' ' PHE . 20.8 p90 -103.1 136.58 42.64 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.944 0.402 . . . . 0.0 110.997 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.558 HG12 ' HG3' ' A' ' 34' ' ' LYS . 10.6 mt -84.81 139.67 17.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.072 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.7 mtp180 -60.66 139.06 93.08 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.261 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.461 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 19.5 Cg_endo -58.29 -50.55 9.51 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 122.409 2.073 . . . . 0.0 112.301 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.531 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -53.84 -58.34 7.6 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.077 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.541 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 45.4 m-20 -66.38 -32.69 74.23 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.983 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.429 ' HB3' ' O ' ' A' ' 22' ' ' PRO . 0.0 OUTLIER -50.37 -52.45 37.19 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.347 -179.653 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.531 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.9 p90 -98.17 -15.75 19.77 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.972 -179.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.541 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 0.7 OUTLIER -60.92 -46.51 90.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.937 0.398 . . . . 0.0 110.729 179.861 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -161.86 138.44 6.15 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.021 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.29 -7.08 20.57 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.515 2.143 . . . . 0.0 112.729 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -111.26 -29.75 7.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.854 0.359 . . . . 0.0 110.897 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.3 m120 -97.95 29.05 3.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.121 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.437 ' HB3' HG21 ' A' ' 20' ' ' ILE . 17.5 mttt -64.7 -62.32 1.65 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.115 0.484 . . . . 0.0 110.525 179.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 21.9 mmmt 67.77 100.98 0.05 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.505 -179.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.558 ' HG3' HG12 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -81.87 139.17 34.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.457 -179.467 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.441 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -110.49 130.18 9.71 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.05 179.467 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.489 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 22.9 m-90 -97.49 112.85 24.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.054 0.454 . . . . 0.0 110.875 -179.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.732 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 26.9 t90 -101.92 117.47 34.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.01 -179.509 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.89 ' CE1' HD12 ' A' ' 52' ' ' LEU . 1.2 m-85 -114.45 156.04 25.26 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.414 179.319 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.94 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -163.53 123.78 2.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.331 0.586 . . . . 0.0 111.852 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.507 ' HB3' ' CB ' ' A' ' 48' ' ' ARG . 2.4 t-160 -90.71 84.51 5.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.208 -0.906 . . . . 0.0 108.841 178.603 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.703 ' CD2' HD12 ' A' ' 75' ' ' LEU . 13.7 m-85 -71.83 149.83 44.88 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.836 -178.518 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.432 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.5 OUTLIER -133.03 119.13 19.65 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.432 -0.804 . . . . 0.0 108.898 178.968 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 62.71 -140.52 46.0 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 119.966 -1.111 . . . . 0.0 110.929 -178.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.406 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 2.6 Cg_exo -75.89 -1.17 11.07 Favored 'Trans proline' 0 CA--C 1.531 0.33 0 C-N-CA 122.691 2.261 . . . . 0.0 112.421 179.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' TRP . . . . . 0.406 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 1.5 m95 -135.5 -158.44 0.87 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.582 -178.374 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.94 ' CD1' ' HB1' ' A' ' 39' ' ' ALA . 4.2 tt -139.31 155.21 25.87 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.099 0 CA-C-O 121.119 0.485 . . . . 0.0 111.861 -179.231 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.447 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -123.85 -24.29 4.48 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.594 -0.73 . . . . 0.0 112.12 -179.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.857 ' O ' HD11 ' A' ' 46' ' ' ILE . 3.2 mtt180 -126.47 133.65 51.14 Favored 'General case' 0 C--O 1.227 -0.099 0 C-N-CA 120.844 -0.343 . . . . 0.0 110.536 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.413 ' NE2' ' HA ' ' A' ' 70' ' ' MET . 0.5 OUTLIER -144.16 137.48 27.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.913 0.387 . . . . 0.0 111.423 -179.943 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.628 ' HE1' ' HB ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -133.62 115.51 14.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.524 179.729 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.414 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.1 OUTLIER -95.46 115.67 27.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.104 -179.73 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.89 HD12 ' CE1' ' A' ' 38' ' ' TYR . 15.1 mt -115.22 101.87 9.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.649 179.684 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.441 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 2.0 m-70 -123.8 133.6 24.74 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.041 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -52.66 -27.33 32.92 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.268 1.979 . . . . 0.0 112.118 179.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -94.75 -26.92 16.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.936 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.5 mptt -121.2 118.93 29.86 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.999 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.431 ' HB3' ' HD2' ' A' ' 58' ' ' PRO . 88.1 Cg_exo -46.09 170.13 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.536 2.157 . . . . 0.0 112.238 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.595 ' O ' HD13 ' A' ' 60' ' ' LEU . 18.0 Cg_endo -58.2 82.22 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.446 2.098 . . . . 0.0 112.3 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.414 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 76.2 mt -61.03 105.36 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.735 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.771 HD11 ' SG ' ' A' ' 100' ' ' CYS . 3.0 mp -81.43 121.38 26.18 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.987 -179.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.605 HD22 ' HB3' ' A' ' 66' ' ' ASP . 73.9 mt -129.4 154.17 47.19 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.076 -179.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.543 ' HB ' HD21 ' A' ' 106' ' ' LEU . 10.6 p -153.51 143.15 14.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.028 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.492 ' N ' ' HE1' ' A' ' 70' ' ' MET . . . -54.44 147.62 13.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.151 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.72 -50.51 2.3 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.568 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.74 -75.68 0.42 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.833 0.349 . . . . 0.0 110.888 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.605 ' HB3' HD22 ' A' ' 61' ' ' LEU . 0.4 OUTLIER -85.93 56.14 3.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.916 -179.87 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -68.18 -28.7 67.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.204 -179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.96 -20.71 34.72 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.235 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -94.78 -50.07 5.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.287 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.492 ' HE1' ' N ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -58.35 -163.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.153 -179.915 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.696 ' SG ' HD13 ' A' ' 46' ' ' ILE . 1.8 m -73.65 114.36 11.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.595 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -103.14 37.76 1.91 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.886 0.374 . . . . 0.0 110.764 -179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.415 ' HB2' ' HG3' ' A' ' 77' ' ' GLU . 0.0 OUTLIER -147.09 -179.18 6.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.819 179.954 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -94.67 164.21 13.05 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.683 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.703 HD12 ' CD2' ' A' ' 41' ' ' PHE . 0.6 OUTLIER -54.92 -32.32 61.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.659 -179.573 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.57 -56.06 7.41 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -179.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.415 ' HG3' ' HB2' ' A' ' 73' ' ' LYS . 5.5 pt-20 -77.91 -3.91 44.12 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.689 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -65.34 -53.56 41.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.755 0.312 . . . . 0.0 110.758 179.911 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 117.79 -25.13 8.62 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.7 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.912 HD22 ' HB2' ' A' ' 15' ' ' PHE . 1.2 mt -56.92 -32.24 65.75 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.747 0.308 . . . . 0.0 111.005 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 5.1 p -80.04 -34.03 38.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.927 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -67.01 -30.5 70.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.876 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.58 -173.96 0.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.808 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.03 74.46 4.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.976 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 69.25 65.57 2.55 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.602 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.495 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -72.58 -10.26 59.58 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.637 0.256 . . . . 0.0 111.387 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -52.28 148.07 7.01 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.898 0.38 . . . . 0.0 111.388 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.647 HG21 ' HB3' ' A' ' 16' ' ' ARG . 1.0 OUTLIER -139.8 179.29 2.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.105 179.897 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.476 HD12 ' CB ' ' A' ' 91' ' ' ARG . 0.4 OUTLIER -98.41 150.19 36.48 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.578 179.664 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -63.51 -29.94 71.14 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.489 2.126 . . . . 0.0 112.349 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.476 ' CB ' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -57.0 -49.69 74.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.472 -179.723 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.516 ' HA ' ' HG2' ' A' ' 95' ' ' GLU . 4.8 mm-40 -64.37 -46.23 84.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.937 0.399 . . . . 0.0 111.637 -179.366 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.467 ' CZ ' ' HG2' ' A' ' 50' ' ' MET . 15.2 t80 -64.72 -43.93 91.84 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.365 -179.547 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -79.6 -30.02 41.34 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -179.053 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.516 ' HG2' ' HA ' ' A' ' 92' ' ' GLN . 11.8 pt-20 -63.91 -46.43 84.83 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 120.129 -0.628 . . . . 0.0 109.799 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.628 ' HB ' ' HE1' ' A' ' 50' ' ' MET . 38.0 mm -71.21 -37.84 67.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 CA-C-O 121.142 0.496 . . . . 0.0 110.018 178.61 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.461 ' CE2' ' HA3' ' A' ' 102' ' ' GLY . 47.5 t-105 -52.48 -39.64 61.41 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.228 179.399 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -85.51 -24.57 27.27 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.729 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.61 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -56.77 -45.7 81.92 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.291 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' CYS . . . . . 0.771 ' SG ' HD11 ' A' ' 60' ' ' LEU . 2.2 p -88.66 -54.63 4.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.606 -179.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.408 ' O ' ' HG2' ' A' ' 104' ' ' GLN . . . 148.96 45.88 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.584 -0.817 . . . . 0.0 112.556 -179.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.489 ' HA2' HD23 ' A' ' 60' ' ' LEU . . . -71.09 -38.98 63.5 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.932 -0.652 . . . . 0.0 112.387 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.596 HD12 HD22 ' A' ' 127' ' ' LEU . 20.6 mm -62.44 -55.08 26.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.725 0.297 . . . . 0.0 110.951 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 101' ' ' GLY . 0.0 OUTLIER -56.19 -45.06 79.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.561 179.826 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -59.9 -49.36 77.99 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.342 179.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.589 HD12 HD11 ' A' ' 110' ' ' ILE . 0.3 OUTLIER -60.01 -46.19 90.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.798 179.816 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.464 ' HG2' HD23 ' A' ' 124' ' ' LEU . 1.1 mm100 -59.41 -29.63 67.89 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.032 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -69.84 -50.67 40.43 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.933 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.13 -31.29 65.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.456 0.646 . . . . 0.0 109.607 178.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.589 HD11 HD12 ' A' ' 106' ' ' LEU . 12.3 mt -58.69 -48.96 84.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 CA-C-N 114.971 -1.013 . . . . 0.0 110.363 179.139 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -66.38 -42.44 87.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.321 179.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.74 -15.72 63.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.011 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 75.54 32.53 0.7 Allowed 'General case' 0 N--CA 1.462 0.154 0 CA-C-O 120.921 0.391 . . . . 0.0 110.977 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -100.32 -26.73 13.8 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.792 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.585 ' HB1' HG21 ' A' ' 121' ' ' THR . . . -59.11 -162.88 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.041 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.471 ' O ' HG22 ' A' ' 118' ' ' THR . 0.0 OUTLIER -138.31 93.38 11.46 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.219 -179.88 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.452 ' HB3' HG13 ' A' ' 6' ' ' ILE . 72.4 Cg_exo -51.06 89.27 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.602 2.201 . . . . 0.0 112.035 179.594 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.517 ' CA ' HG23 ' A' ' 6' ' ' ILE . 9.0 t -138.23 -47.66 0.53 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.414 -179.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.453 ' CE1' ' CE1' ' A' ' 40' ' ' HIS . 14.4 t80 -167.23 -47.35 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.629 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.451 ' HB1' ' HG3' ' A' ' 48' ' ' ARG . . . -59.97 -52.4 65.58 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.664 -179.34 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.585 HG21 ' HB1' ' A' ' 115' ' ' ALA . 69.1 p -65.32 -49.12 70.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.718 -179.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.518 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -55.86 -48.39 75.62 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.414 0.626 . . . . 0.0 109.799 179.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' MET . . . . . 0.832 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -58.01 -31.45 66.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.245 -0.888 . . . . 0.0 109.875 178.762 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.493 HD22 HD12 ' A' ' 110' ' ' ILE . 0.1 OUTLIER -66.39 -49.41 66.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.891 178.837 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 63.7 mm-40 -49.99 -40.65 44.97 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.966 179.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -77.95 -32.82 51.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.129 178.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.832 HD13 ' CE ' ' A' ' 123' ' ' MET . 0.2 OUTLIER -63.03 -17.53 62.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.53 179.027 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.476 HD21 HD23 ' A' ' 124' ' ' LEU . 0.7 OUTLIER -141.49 70.96 1.35 Allowed 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.038 -179.839 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 32.7 mmtt . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.845 179.975 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.749 0.309 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.753 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.2 OUTLIER -60.18 -57.89 10.86 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.994 0.426 . . . . 0.0 110.635 179.86 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.427 ' O ' ' N ' ' A' ' 7' ' ' ASP . 0.2 OUTLIER -57.62 -31.15 65.94 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.253 0.549 . . . . 0.0 109.84 179.353 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.411 ' HA ' ' NE2' ' A' ' 4' ' ' GLN . 5.1 tp60 -64.71 -41.8 95.73 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.078 179.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.472 ' HG3' ' N ' ' A' ' 6' ' ' ILE . 9.9 pt-20 -73.06 -46.31 52.37 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.758 0.313 . . . . 0.0 110.846 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.753 HD12 ' O ' ' A' ' 2' ' ' ARG . 3.5 mp -69.42 -58.98 4.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 121.766 0.793 . . . . 0.0 109.534 178.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.427 ' N ' ' O ' ' A' ' 3' ' ' GLN . 16.6 t70 49.67 92.15 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.398 -1.274 . . . . 0.0 111.234 -179.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.448 ' HG2' ' CD2' ' A' ' 119' ' ' TYR . 0.0 OUTLIER -62.22 -69.61 0.24 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.892 179.867 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.6 mmtt 52.77 28.24 6.16 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.109 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -154.75 -179.96 8.51 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.804 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -97.67 167.98 10.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.865 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.47 ' HG2' ' CZ ' ' A' ' 119' ' ' TYR . 10.5 mp0 -119.38 108.3 14.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.902 179.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.54 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -117.58 120.56 38.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.019 -179.739 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.489 ' CD2' ' CG ' ' A' ' 40' ' ' HIS . 0.1 OUTLIER -113.8 148.94 35.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.515 179.897 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.84 ' HB2' HD22 ' A' ' 80' ' ' LEU . 0.2 OUTLIER -152.39 162.8 40.66 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.296 0.569 . . . . 0.0 111.857 179.944 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.695 ' HB3' HG21 ' A' ' 88' ' ' ILE . 7.0 ttp180 -149.26 148.04 29.1 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.896 179.36 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.492 HG21 ' CD ' ' A' ' 83' ' ' LYS . 0.2 OUTLIER -149.61 124.48 4.8 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 120.72 0.295 . . . . 0.0 111.688 -179.751 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.468 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 67.1 Cg_endo -91.66 97.91 0.21 Allowed 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 123.007 2.471 . . . . 0.0 112.284 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -113.21 143.27 44.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.814 0.34 . . . . 0.0 110.834 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.43 HG12 ' HG2' ' A' ' 34' ' ' LYS . 5.7 mt -85.66 153.02 3.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.372 -179.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.0 mtp180 -80.25 140.57 52.92 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.671 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.485 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 51.8 Cg_exo -55.34 -47.92 23.43 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.558 2.172 . . . . 0.0 112.844 -179.576 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.54 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -54.94 -58.98 5.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.35 -179.383 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.484 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 1.8 m-20 -67.99 -31.18 70.7 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.552 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.42 -50.39 59.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.573 -179.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.54 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.3 p90 -102.21 -5.29 24.53 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 112.16 0.429 . . . . 0.0 112.16 -179.268 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.484 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 6.0 mtpp -74.41 -39.11 62.85 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.835 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -174.44 140.79 0.74 Allowed Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.417 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.469 ' HA ' ' HG2' ' A' ' 32' ' ' LYS . 61.4 Cg_endo -72.3 -22.28 22.14 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.671 2.248 . . . . 0.0 112.288 179.627 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -84.63 -36.95 21.63 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.169 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -94.47 41.6 1.09 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.821 179.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.469 ' HG2' ' HA ' ' A' ' 29' ' ' PRO . 18.2 mmtm -78.08 61.17 2.57 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.698 -179.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 17.7 mmtt -46.2 95.5 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.338 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.43 ' HG2' HG12 ' A' ' 20' ' ' ILE . 0.6 OUTLIER -83.89 131.99 34.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.783 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.435 ' HA3' ' CD2' ' A' ' 53' ' ' HIS . . . -115.99 142.51 17.59 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.655 -0.783 . . . . 0.0 112.849 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.468 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 22.0 m-90 -105.82 138.35 42.16 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.757 0.313 . . . . 0.0 110.732 179.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.621 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 41.7 t90 -123.98 116.83 23.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.791 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.858 ' CE1' HD12 ' A' ' 52' ' ' LEU . 3.1 m-85 -109.73 154.53 22.77 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.413 179.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.582 ' HB1' HD12 ' A' ' 46' ' ' ILE . . . -170.21 125.46 0.77 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.154 0.502 . . . . 0.0 112.041 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.489 ' CG ' ' CD2' ' A' ' 14' ' ' PHE . 16.8 t-160 -96.89 96.61 8.66 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.757 179.016 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.771 ' CZ ' HG21 ' A' ' 78' ' ' THR . 19.5 m-85 -83.91 122.54 28.87 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.579 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.513 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.6 OUTLIER -91.75 111.06 22.43 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 178.289 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.19 -135.6 50.09 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.018 -1.087 . . . . 0.0 110.928 -178.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.404 ' HD2' ' CD1' ' A' ' 45' ' ' TRP . 8.1 Cg_exo -72.5 -16.68 27.23 Favored 'Trans proline' 0 N--CA 1.463 -0.278 0 C-N-CA 122.444 2.096 . . . . 0.0 112.317 179.424 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' TRP . . . . . 0.404 ' CD1' ' HD2' ' A' ' 44' ' ' PRO . 0.8 OUTLIER -115.08 -170.3 1.73 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.597 -178.696 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.589 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 3.5 tt -133.07 153.65 38.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 121.172 0.51 . . . . 0.0 111.998 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.579 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -129.73 -22.21 2.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.492 -0.777 . . . . 0.0 111.959 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.699 ' NE ' ' HB1' ' A' ' 120' ' ' ALA . 3.5 mtt180 -130.22 142.3 50.57 Favored 'General case' 0 N--CA 1.46 0.04 0 CA-C-O 120.77 0.319 . . . . 0.0 111.167 -179.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.494 ' HA ' ' HA ' ' A' ' 39' ' ' ALA . 0.1 OUTLIER -155.88 129.86 8.63 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.991 0.424 . . . . 0.0 111.175 179.942 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.642 ' SD ' HD11 ' A' ' 52' ' ' LEU . 1.0 OUTLIER -125.47 120.53 31.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.695 179.891 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.491 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -98.53 132.85 43.63 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.071 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.858 HD12 ' CE1' ' A' ' 38' ' ' TYR . 14.1 mt -135.06 101.98 5.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.846 179.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.435 ' CD2' ' HA3' ' A' ' 35' ' ' GLY . 61.3 m170 -126.26 138.26 31.92 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.931 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.407 ' HD3' ' HA2' ' A' ' 35' ' ' GLY . 53.3 Cg_exo -52.26 -23.64 18.62 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.439 2.092 . . . . 0.0 112.341 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -98.58 -27.45 14.01 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.233 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 1.9 mttm -118.49 125.41 27.84 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.053 -179.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -55.53 177.05 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.522 2.148 . . . . 0.0 112.27 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -59.68 84.97 0.07 OUTLIER 'Trans proline' 0 C--N 1.343 0.262 0 C-N-CA 122.642 2.228 . . . . 0.0 112.498 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.693 HG22 HD23 ' A' ' 61' ' ' LEU . 67.1 mt -66.21 98.12 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.003 0.43 . . . . 0.0 110.634 179.64 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.557 HD21 ' C ' ' A' ' 101' ' ' GLY . 0.2 OUTLIER -72.92 107.82 5.51 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.933 -179.827 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.907 HD11 ' CB ' ' A' ' 69' ' ' GLU . 1.1 mm? -110.15 147.46 33.65 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.959 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 11.9 p -156.53 140.51 7.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.936 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.579 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -56.08 170.7 0.3 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.025 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.28 -72.28 0.32 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.325 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.405 ' HG2' ' HB3' ' A' ' 114' ' ' GLN . 0.5 OUTLIER -64.28 -54.0 40.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.824 0.345 . . . . 0.0 110.694 179.839 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.428 ' CB ' HD13 ' A' ' 61' ' ' LEU . 59.7 m-20 -114.19 57.46 0.7 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.867 179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -20.19 63.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.212 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -85.58 -43.3 13.61 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.049 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.907 ' CB ' HD11 ' A' ' 61' ' ' LEU . 3.2 mm-40 -68.41 -39.58 81.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.02 -179.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -48.26 167.66 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.905 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.529 ' SG ' HG22 ' A' ' 78' ' ' THR . 0.9 OUTLIER -56.09 -30.66 62.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.864 0.364 . . . . 0.0 111.083 -179.798 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 75.97 -61.07 0.47 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.059 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 2.2 mptt -53.45 161.49 0.98 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.189 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.55 ' O ' HG23 ' A' ' 78' ' ' THR . 11.1 m120 -77.59 -172.89 2.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.555 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.542 HD11 ' CZ ' ' A' ' 15' ' ' PHE . 28.0 tp -64.47 -51.97 60.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.558 -179.542 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.16 -31.37 68.82 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.837 0.351 . . . . 0.0 111.383 -179.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -66.95 -37.9 85.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.611 -179.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.771 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 21.0 p -59.41 -74.13 0.07 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.785 0.326 . . . . 0.0 111.122 -179.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 143.03 -17.76 2.34 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.807 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.84 HD22 ' HB2' ' A' ' 15' ' ' PHE . 0.6 OUTLIER -50.49 -41.1 52.84 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.979 0.418 . . . . 0.0 110.756 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -73.94 -26.84 60.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.725 179.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.98 -26.91 57.22 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.975 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.492 ' CD ' HG21 ' A' ' 17' ' ' ILE . 0.3 OUTLIER -70.86 -171.08 0.49 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.115 -179.853 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.6 90.93 4.9 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.951 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 62.5 68.97 1.44 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.559 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -88.14 -22.0 24.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.779 0.323 . . . . 0.0 111.077 179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -53.92 143.26 21.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.307 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.695 HG21 ' HB3' ' A' ' 16' ' ' ARG . 1.6 pt -130.16 169.66 20.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.127 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.6 ' H ' HD23 ' A' ' 89' ' ' LEU . 0.8 OUTLIER -84.59 147.56 49.65 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.67 179.845 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -66.02 -26.06 51.17 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.558 2.172 . . . . 0.0 112.353 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.6 ' HB2' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -61.16 -54.37 45.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.104 -179.897 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -50.91 71.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.12 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -54.22 -53.07 58.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.713 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -70.57 -20.8 62.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.502 179.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.15 -50.34 74.05 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.013 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.437 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 20.0 mm -75.4 -33.67 28.23 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.387 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.303 178.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.475 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 14.1 t-105 -52.75 -41.07 63.68 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.972 179.281 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.06 -29.0 23.74 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.381 179.188 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.437 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.0 OUTLIER -61.35 -45.92 92.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.207 -179.813 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 44.3 t -88.02 -83.45 0.21 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.976 -179.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.557 ' C ' HD21 ' A' ' 60' ' ' LEU . . . -176.09 34.38 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.607 -0.806 . . . . 0.0 112.63 -179.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.518 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -58.26 -54.89 33.99 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.603 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.869 ' HA ' HD11 ' A' ' 124' ' ' LEU . 1.8 mt -58.33 -34.69 50.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.796 0.331 . . . . 0.0 111.108 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.75 -49.16 74.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.604 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -64.18 -42.52 96.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.432 179.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.939 ' CD1' HD13 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -64.0 -46.31 85.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.693 179.675 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.44 ' HG2' HD21 ' A' ' 124' ' ' LEU . 8.1 mm100 -61.49 -29.72 70.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.77 179.752 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 37.7 m -68.33 -50.31 54.25 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.749 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.27 -33.37 69.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.362 0.601 . . . . 0.0 109.518 178.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.641 HD11 HD22 ' A' ' 106' ' ' LEU . 8.6 mt -56.91 -48.92 80.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.159 -0.928 . . . . 0.0 110.368 179.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -67.86 -38.33 82.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.413 179.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 1.1 m -78.07 -4.88 49.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.235 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 7.8 mmt85 65.27 35.88 7.38 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.964 0.411 . . . . 0.0 110.922 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . 0.405 ' HB3' ' HG2' ' A' ' 65' ' ' LYS . 0.0 OUTLIER -111.15 -25.2 9.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.873 179.86 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.482 ' HB1' ' CG2' ' A' ' 121' ' ' THR . . . -56.45 -29.93 62.26 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.161 179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 72.05 97.65 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.345 179.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.432 ' HB3' HG13 ' A' ' 6' ' ' ILE . 65.8 Cg_exo -52.3 87.85 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.746 2.297 . . . . 0.0 111.932 179.577 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.538 ' C ' HG23 ' A' ' 6' ' ' ILE . 9.0 t -112.22 -43.48 3.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.106 -179.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.47 ' CZ ' ' HG2' ' A' ' 12' ' ' GLN . 23.0 t80 -178.89 -63.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.035 179.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.699 ' HB1' ' NE ' ' A' ' 48' ' ' ARG . . . -53.67 -36.12 61.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.995 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.502 HG22 ' CG1' ' A' ' 110' ' ' ILE . 0.8 OUTLIER -60.83 -47.09 87.96 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.06 179.467 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.598 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -65.79 -46.4 78.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.389 0.614 . . . . 0.0 109.695 178.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' MET . . . . . 0.606 ' HE3' HD12 ' A' ' 127' ' ' LEU . 1.9 tmm? -58.11 -35.81 72.0 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.251 179.087 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.939 HD13 ' CD1' ' A' ' 106' ' ' LEU . 0.6 OUTLIER -67.69 -45.97 73.63 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.74 178.996 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.747 ' HA ' HD12 ' A' ' 128' ' ' LEU . 60.7 mm-40 -50.52 -38.4 44.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.968 179.092 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 66.5 m-20 -76.77 -34.95 58.0 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.065 179.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.606 HD12 ' HE3' ' A' ' 123' ' ' MET . 1.2 mt -59.3 -21.13 59.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.084 178.659 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.747 HD12 ' HA ' ' A' ' 125' ' ' GLN . 1.8 mt -91.6 -65.81 0.98 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.93 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 1.8 mmtt . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.283 -0.865 . . . . 0.0 111.213 179.9 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.838 0.352 . . . . 0.0 110.956 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.993 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.2 OUTLIER -63.22 -54.25 40.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.145 0.498 . . . . 0.0 110.897 -179.93 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.61 -36.07 61.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.232 0.539 . . . . 0.0 110.035 179.755 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.1 tp60 -62.77 -44.87 95.05 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.891 179.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.453 ' CG ' ' O ' ' A' ' 2' ' ' ARG . 16.5 pt-20 -72.21 -45.48 60.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.934 -179.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.993 HD12 ' O ' ' A' ' 2' ' ' ARG . 2.8 mp -65.49 -61.06 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.681 0.753 . . . . 0.0 109.96 179.008 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 44.1 t0 45.0 86.36 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.553 -1.203 . . . . 0.0 111.176 -179.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.0 ptp -88.46 52.14 2.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.048 -179.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.72 -28.02 14.08 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.005 179.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 51.5 mtt-85 -66.25 -177.49 0.53 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.877 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -90.71 138.16 31.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.874 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.456 ' HG2' ' CZ ' ' A' ' 119' ' ' TYR . 5.7 mp0 -108.08 102.82 11.95 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.889 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.483 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 2.5 mtp180 -111.92 133.84 53.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.019 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.505 ' CE2' ' CG ' ' A' ' 40' ' ' HIS . 1.2 m-85 -117.7 134.96 54.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.145 179.799 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.809 ' CE1' HD21 ' A' ' 75' ' ' LEU . 1.4 m-85 -136.31 157.23 47.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.251 0.548 . . . . 0.0 112.003 -179.037 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.707 ' HB3' HG21 ' A' ' 88' ' ' ILE . 16.4 ttp180 -149.38 145.89 27.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.785 179.428 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.685 HG21 ' CE ' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -140.84 125.01 10.48 Favored Pre-proline 0 C--N 1.328 -0.327 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.447 -179.72 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -88.19 96.75 0.4 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 123.009 2.473 . . . . 0.0 112.186 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.407 ' CD1' ' O ' ' A' ' 19' ' ' PHE . 10.9 p90 -120.39 142.61 49.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.912 0.387 . . . . 0.0 111.107 -179.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.524 HG23 ' O ' ' A' ' 33' ' ' LYS . 17.0 mt -87.9 145.41 7.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.935 179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.14 129.26 93.92 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.485 179.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.474 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 75.8 Cg_exo -50.04 -48.96 17.59 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.431 2.087 . . . . 0.0 112.659 -179.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.543 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -54.37 -58.24 8.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.439 -179.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.554 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 36.9 m-20 -67.38 -31.77 72.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.913 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -51.61 -55.44 19.27 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.493 -179.574 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.543 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 2.0 p90 -93.89 -14.28 26.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.728 -179.43 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.554 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 3.0 mtpp -60.97 -47.25 87.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.952 0.406 . . . . 0.0 110.6 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -164.87 142.35 5.13 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.094 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -70.66 -22.42 27.96 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.735 2.29 . . . . 0.0 112.666 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -95.09 -32.83 12.92 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.789 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 30.5 m120 -101.37 48.14 0.9 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.728 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.01 59.53 0.67 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.795 -179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.524 ' O ' HG23 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -44.25 146.14 0.7 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.259 179.938 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.26 117.49 34.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.013 -179.486 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -92.17 126.33 8.46 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.228 179.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 8.6 m-90 -102.16 135.21 44.15 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.902 0.382 . . . . 0.0 111.01 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.73 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 33.7 t90 -117.01 117.21 29.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.048 -179.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.868 ' CE1' HD12 ' A' ' 52' ' ' LEU . 12.0 m-85 -111.87 150.91 29.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.122 179.434 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.85 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -169.55 125.05 0.84 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.146 0.498 . . . . 0.0 112.042 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.505 ' CG ' ' CE2' ' A' ' 14' ' ' PHE . 14.4 t-160 -91.92 99.56 12.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.649 178.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.74 ' CZ ' HG21 ' A' ' 78' ' ' THR . 36.9 m-85 -85.23 118.87 25.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.776 -179.085 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.493 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 0.7 OUTLIER -91.59 115.17 27.82 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.28 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 57.78 -135.82 51.38 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 119.967 -1.111 . . . . 0.0 111.107 -178.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -72.38 -18.77 26.05 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.436 2.091 . . . . 0.0 112.353 179.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' TRP . . . . . 0.418 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.6 OUTLIER -114.24 -171.56 1.94 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.969 0.414 . . . . 0.0 111.692 -178.752 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.85 ' CD1' ' HB1' ' A' ' 39' ' ' ALA . 1.7 tt -131.03 148.5 33.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.509 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.613 ' CB ' HG21 ' A' ' 118' ' ' THR . . . -122.92 -20.58 5.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.839 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.749 ' O ' HD11 ' A' ' 46' ' ' ILE . 2.3 mtt180 -129.94 138.38 50.85 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.84 0.352 . . . . 0.0 111.333 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.475 ' HB3' ' HB3' ' A' ' 61' ' ' LEU . 7.2 tt0 -147.96 121.06 8.86 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.908 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 7.3 ttm -121.01 112.76 19.14 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.708 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -94.23 129.76 40.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.14 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.868 HD12 ' CE1' ' A' ' 38' ' ' TYR . 8.5 mt -129.05 112.1 13.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.854 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 53.8 m-70 -128.52 129.97 23.54 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.774 179.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.408 ' HB2' ' HG2' ' A' ' 33' ' ' LYS . 86.4 Cg_exo -46.68 -27.11 5.05 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.515 2.143 . . . . 0.0 112.543 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -95.08 -33.97 12.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.946 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.1 mtpt -111.95 120.44 42.03 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.954 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -47.56 174.05 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.598 2.199 . . . . 0.0 112.579 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.463 ' HA ' HD23 ' A' ' 52' ' ' LEU . 48.9 Cg_exo -55.95 85.38 0.04 OUTLIER 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.7 2.266 . . . . 0.0 112.341 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 84.5 mt -64.47 92.14 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.097 0.475 . . . . 0.0 110.737 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.591 HD21 ' N ' ' A' ' 102' ' ' GLY . 0.3 OUTLIER -64.68 132.78 50.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.719 -179.886 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.96 HD11 ' HB3' ' A' ' 69' ' ' GLU . 0.2 OUTLIER -140.88 150.03 42.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.163 -179.52 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.526 HG12 ' HE2' ' A' ' 105' ' ' TYR . 13.3 p -153.36 148.96 13.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.121 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.558 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -60.26 166.92 2.68 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.974 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.18 -73.39 0.29 Allowed Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.393 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -58.95 -57.6 12.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.845 0.355 . . . . 0.0 110.8 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.411 ' HB3' HD21 ' A' ' 61' ' ' LEU . 81.5 m-20 -108.96 48.51 0.86 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.639 179.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.22 -17.88 65.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.422 -179.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 17.9 mmt -82.14 -32.63 29.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.848 0.356 . . . . 0.0 110.563 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.96 ' HB3' HD11 ' A' ' 61' ' ' LEU . 1.2 mp0 -89.24 -40.81 12.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.799 179.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.434 ' CA ' HD22 ' A' ' 61' ' ' LEU . 32.1 ttm -53.34 162.51 0.74 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.142 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.502 ' SG ' HG22 ' A' ' 78' ' ' THR . 1.7 t -50.08 118.1 2.73 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.941 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -82.98 0.84 42.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.772 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.28 164.56 16.8 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.79 0.329 . . . . 0.0 110.997 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.555 ' O ' HG23 ' A' ' 78' ' ' THR . 7.2 m120 -83.31 -179.84 7.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.974 -179.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.809 HD21 ' CE1' ' A' ' 15' ' ' PHE . 4.3 mt -65.78 -34.24 77.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.444 -179.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.5 -42.11 71.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.087 -178.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -93.87 -3.75 51.25 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.303 0.482 . . . . 0.0 112.303 -178.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.74 HG21 ' CZ ' ' A' ' 41' ' ' PHE . 0.2 OUTLIER -67.08 -64.11 0.92 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.795 0.331 . . . . 0.0 110.813 179.945 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.405 ' CA ' ' NH1' ' A' ' 82' ' ' ARG . . . 129.82 -15.83 5.63 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.763 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.809 HD22 ' HB2' ' A' ' 15' ' ' PHE . 1.1 mp -68.25 -45.07 74.18 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.892 0.377 . . . . 0.0 110.892 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.755 HG23 HD22 ' A' ' 75' ' ' LEU . 52.9 p -65.44 -52.16 55.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.174 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.405 ' NH1' ' CA ' ' A' ' 79' ' ' GLY . 0.0 OUTLIER -62.01 -27.59 68.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.961 -179.833 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.685 ' CE ' HG21 ' A' ' 17' ' ' ILE . 0.4 OUTLIER -59.48 -167.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.861 179.83 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.18 73.67 7.17 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.005 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 59.71 65.35 3.47 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.651 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.99 -14.03 62.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.8 0.333 . . . . 0.0 111.492 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.69 143.18 21.13 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.273 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.707 HG21 ' HB3' ' A' ' 16' ' ' ARG . 2.1 pt -127.16 -179.88 3.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.193 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 8.9 mt -81.85 137.96 46.87 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.838 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.5 -51.25 5.43 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.428 2.085 . . . . 0.0 111.986 179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.87 -38.26 69.9 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.19 -179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -62.33 -52.38 63.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.935 0.398 . . . . 0.0 110.981 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.53 ' HB2' HD11 ' A' ' 88' ' ' ILE . 43.2 t80 -54.27 -53.0 59.58 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.57 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.404 ' OE2' ' NH1' ' A' ' 48' ' ' ARG . 0.1 OUTLIER -68.8 -21.23 64.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.515 179.436 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.52 -50.64 72.75 Favored 'General case' 0 CA--C 1.52 -0.207 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 179.041 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.438 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 17.4 mm -71.96 -32.9 45.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.351 179.157 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.469 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 19.4 t-105 -55.72 -37.22 68.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.995 179.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.68 -27.92 25.03 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.642 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.438 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 0.2 OUTLIER -56.58 -54.3 47.51 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.348 -179.541 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 40.9 t -83.54 -80.18 0.19 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.025 -179.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.566 ' C ' HD21 ' A' ' 60' ' ' LEU . . . 178.85 36.48 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.579 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.591 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -54.29 -55.23 27.6 Favored Glycine 0 N--CA 1.453 -0.188 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.418 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.821 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.6 mp -56.69 -40.49 70.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.768 0.318 . . . . 0.0 111.292 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -59.7 -49.03 79.32 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.571 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.526 ' HE2' HG12 ' A' ' 62' ' ' VAL . 82.9 t80 -61.26 -42.16 98.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.401 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 1.065 HD13 HD13 ' A' ' 124' ' ' LEU . 0.4 OUTLIER -64.92 -41.56 95.45 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.63 179.705 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -63.11 -32.72 74.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.727 179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -67.97 -50.18 57.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.514 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.4 -35.84 78.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.437 0.636 . . . . 0.0 109.456 178.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.637 HD12 HD22 ' A' ' 124' ' ' LEU . 3.8 mt -59.62 -48.87 85.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.357 179.012 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.405 ' HG3' ' N ' ' A' ' 112' ' ' SER . 7.5 pt-20 -67.03 -30.93 71.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.725 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . 0.405 ' N ' ' HG3' ' A' ' 111' ' ' GLU . 23.4 m -86.23 -7.03 58.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.206 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 22.6 mmt85 70.27 29.01 3.75 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 120.898 0.38 . . . . 0.0 110.88 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 84.1 mm-40 -99.44 -25.18 14.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.587 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -58.04 -164.93 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.933 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . 0.492 ' O ' HG22 ' A' ' 118' ' ' THR . 5.7 ttt180 -140.48 89.94 10.31 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.102 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.405 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 77.9 Cg_exo -51.31 87.91 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.705 2.27 . . . . 0.0 112.349 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.613 HG21 ' CB ' ' A' ' 47' ' ' ALA . 5.7 t -127.35 -45.03 1.53 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.868 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.456 ' CZ ' ' HG2' ' A' ' 12' ' ' GLN . 27.9 t80 -168.56 -61.66 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.886 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.458 ' O ' ' HG3' ' A' ' 123' ' ' MET . . . -54.09 -37.33 64.13 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.317 -179.73 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.605 HG22 ' CG1' ' A' ' 110' ' ' ILE . 0.2 OUTLIER -68.33 -41.06 81.34 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.557 179.961 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.662 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -65.53 -56.25 13.39 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.523 179.538 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' MET . . . . . 0.568 ' HE1' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -55.38 -29.12 57.86 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.315 179.293 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 1.065 HD13 HD13 ' A' ' 106' ' ' LEU . 0.3 OUTLIER -64.51 -52.4 58.0 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.079 0.466 . . . . 0.0 110.043 179.055 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . 0.753 ' HA ' HD12 ' A' ' 128' ' ' LEU . 34.6 mm-40 -53.09 -42.69 66.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.717 179.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -78.63 -30.63 46.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.666 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.568 HD13 ' HE1' ' A' ' 123' ' ' MET . 1.3 tt -76.02 -7.81 55.53 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.523 179.269 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.753 HD12 ' HA ' ' A' ' 125' ' ' GLN . 7.0 mt -89.04 -10.61 46.88 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.24 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 14.6 mmtt . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.319 -0.848 . . . . 0.0 111.052 179.948 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.713 ' HB1' ' HB3' ' A' ' 4' ' ' GLN . . . . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.824 0.345 . . . . 0.0 110.993 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.91 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.2 OUTLIER -58.48 -59.91 4.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.887 179.9 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.39 -41.06 65.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.66 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.713 ' HB3' ' HB1' ' A' ' 1' ' ' ALA . 5.4 tp60 -61.04 -32.25 71.87 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.508 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.422 ' HG2' ' HB2' ' A' ' 117' ' ' PRO . 0.3 OUTLIER -77.77 -53.83 7.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.014 179.546 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.91 HD12 ' O ' ' A' ' 2' ' ' ARG . 2.7 mp -53.61 -64.6 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.327 0.584 . . . . 0.0 109.929 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 10.1 t0 42.25 88.46 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.405 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . 0.455 ' HG2' ' CE2' ' A' ' 119' ' ' TYR . 0.0 OUTLIER -55.04 -90.29 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.968 -179.902 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.6 mtmt 44.26 33.34 0.82 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.688 0.28 . . . . 0.0 111.554 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -135.84 151.12 49.72 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.034 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.8 mm-40 -61.48 152.72 29.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.786 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.402 ' OE1' ' CE1' ' A' ' 40' ' ' HIS . 93.1 mm-40 -123.89 102.71 7.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.907 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.475 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -112.58 123.64 50.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.023 179.977 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.46 ' CD1' ' N ' ' A' ' 14' ' ' PHE . 2.5 m-85 -108.91 134.89 50.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.012 179.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.919 ' HB2' HD22 ' A' ' 80' ' ' LEU . 15.1 m-85 -132.79 148.84 52.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.234 0.54 . . . . 0.0 112.12 -178.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.92 ' HD3' HD12 ' A' ' 88' ' ' ILE . 0.3 OUTLIER -147.2 138.93 24.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.605 179.597 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.668 HG21 ' HG2' ' A' ' 83' ' ' LYS . 0.2 OUTLIER -149.33 123.27 4.63 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-O 120.725 0.298 . . . . 0.0 111.613 -179.582 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.449 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 91.0 Cg_endo -89.16 119.59 0.97 Allowed 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.016 2.478 . . . . 0.0 111.964 179.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.432 ' O ' ' N ' ' A' ' 35' ' ' GLY . 11.4 p90 -139.31 154.84 47.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.883 0.373 . . . . 0.0 111.068 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 58.5 mt -105.06 142.19 18.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.769 179.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -58.76 136.99 86.87 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.47 179.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.457 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 15.9 Cg_endo -57.46 -46.56 26.79 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.516 2.144 . . . . 0.0 112.585 -179.624 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.523 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -55.44 -58.87 5.97 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.316 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.521 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 2.7 m-20 -66.52 -32.71 74.24 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.684 179.768 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.403 ' HA ' ' HE3' ' A' ' 32' ' ' LYS . 0.4 OUTLIER -50.62 -51.23 50.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.48 -179.696 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.523 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.8 p90 -103.32 -1.64 28.4 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.119 -179.139 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.521 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 16.0 mtpp -77.89 -40.07 41.13 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.919 -0.313 . . . . 0.0 110.949 179.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -172.78 143.57 1.18 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.44 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.482 ' HA ' ' HG2' ' A' ' 32' ' ' LYS . 67.8 Cg_endo -73.03 -22.7 19.2 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.807 2.338 . . . . 0.0 112.295 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -83.97 -36.2 23.39 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.111 179.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 30.1 m120 -94.38 41.79 1.09 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.995 179.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.482 ' HG2' ' HA ' ' A' ' 29' ' ' PRO . 13.9 mmtm -80.74 59.93 3.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.779 -179.589 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.1 94.6 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.964 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.17 -170.08 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.979 -179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 19' ' ' PHE . . . -170.11 108.52 0.29 Allowed Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.23 -179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.482 ' HB3' ' CE1' ' A' ' 38' ' ' TYR . 18.0 m-90 -97.58 131.57 44.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.846 0.355 . . . . 0.0 110.682 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.727 ' CZ3' HD21 ' A' ' 80' ' ' LEU . 18.3 t90 -121.02 117.5 27.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.22 -179.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.526 ' HE2' HD22 ' A' ' 52' ' ' LEU . 1.8 m-85 -120.2 148.02 44.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.201 179.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.706 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.47 124.64 0.71 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.215 0.531 . . . . 0.0 111.69 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.479 ' HB3' ' CG ' ' A' ' 48' ' ' ARG . 10.9 t-160 -93.22 105.77 17.81 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 178.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.719 ' HA ' ' HA ' ' A' ' 46' ' ' ILE . 3.0 m-85 -85.45 134.09 34.07 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.62 -178.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.498 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 4.5 t70 -97.25 120.93 38.51 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 178.501 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 57.31 -138.65 47.62 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 119.767 -1.206 . . . . 0.0 110.889 -178.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.413 ' O ' ' ND2' ' A' ' 74' ' ' ASN . 7.4 Cg_exo -72.26 -18.67 26.55 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.351 2.034 . . . . 0.0 112.089 179.212 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' TRP . . . . . 0.405 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -113.95 -169.34 1.5 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.292 -178.921 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.719 ' HA ' ' HA ' ' A' ' 41' ' ' PHE . 8.4 tt -118.34 156.58 20.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 N-CA-C 112.643 0.608 . . . . 0.0 112.643 -179.155 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.436 ' N ' ' CG1' ' A' ' 46' ' ' ILE . . . -119.78 -36.46 3.3 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.763 -179.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.62 ' O ' HD11 ' A' ' 46' ' ' ILE . 6.4 ptp180 -140.07 153.44 46.76 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 120.501 -0.48 . . . . 0.0 111.406 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.472 ' HG3' ' HB2' ' A' ' 39' ' ' ALA . 30.8 tt0 -146.41 153.62 40.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.289 -179.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.489 ' HB3' ' HE2' ' A' ' 50' ' ' MET . 20.0 ttp -142.16 111.96 6.79 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.566 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -95.34 126.45 40.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.957 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.526 HD22 ' HE2' ' A' ' 38' ' ' TYR . 1.4 mp -123.41 113.77 19.25 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.775 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.446 ' HB2' ' HB2' ' A' ' 56' ' ' LYS . 0.7 OUTLIER -134.49 135.53 23.93 Favored Pre-proline 0 C--N 1.332 -0.194 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.974 179.994 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -52.56 -28.11 35.34 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.51 2.14 . . . . 0.0 112.319 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -102.31 -19.72 14.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.149 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.446 ' HB2' ' HB2' ' A' ' 53' ' ' HIS . 5.3 mmmt -117.82 122.32 30.76 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.727 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -52.89 164.92 1.38 Allowed 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.531 2.154 . . . . 0.0 112.237 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_exo -57.11 88.57 0.04 OUTLIER 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.641 2.227 . . . . 0.0 112.381 -179.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 9.2 mt -69.59 94.54 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 121.147 0.498 . . . . 0.0 110.496 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.594 HD23 ' CZ3' ' A' ' 97' ' ' TRP . 0.8 OUTLIER -84.42 107.36 16.64 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.978 -179.626 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 29.0 mt -107.68 161.0 15.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.94 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.522 HG21 HD21 ' A' ' 106' ' ' LEU . 12.9 p -153.31 139.84 12.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.085 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.53 137.4 48.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.165 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 100.98 -40.46 2.41 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.438 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.441 ' HG3' ' HB1' ' A' ' 109' ' ' ALA . 0.1 OUTLIER -102.87 -32.2 9.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.781 0.324 . . . . 0.0 110.853 -179.909 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -132.0 44.28 2.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.886 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -59.47 -30.56 68.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.911 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 2.4 mtp -84.91 -29.8 24.89 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.092 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -78.3 -55.74 5.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.962 -179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.6 ptm -59.81 -178.12 0.07 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.032 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.507 ' SG ' HG22 ' A' ' 78' ' ' THR . 2.2 t -62.29 118.25 7.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.759 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -98.91 6.41 46.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.459 -179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -102.74 -175.04 2.7 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.916 0.389 . . . . 0.0 111.114 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . 0.413 ' ND2' ' O ' ' A' ' 44' ' ' PRO . 21.0 t-20 -109.42 160.41 16.21 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.25 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.823 HD23 HG21 ' A' ' 81' ' ' THR . 0.2 OUTLIER -43.87 -37.4 2.81 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.506 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -70.77 -56.1 7.12 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.838 0.351 . . . . 0.0 111.73 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -71.37 -16.3 62.41 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -178.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.6 HG21 ' CE2' ' A' ' 41' ' ' PHE . 0.4 OUTLIER -64.82 -62.15 1.74 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.79 0.329 . . . . 0.0 111.092 -179.524 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 122.0 -26.5 6.44 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.256 -179.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.919 HD22 ' HB2' ' A' ' 15' ' ' PHE . 0.7 OUTLIER -48.92 -42.67 37.96 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.993 0.425 . . . . 0.0 110.649 179.683 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.823 HG21 HD23 ' A' ' 75' ' ' LEU . 39.0 p -70.41 -28.32 64.97 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.372 179.228 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 8.0 mmm-85 -96.25 6.43 48.81 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.019 179.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.743 ' HB3' ' HB2' ' A' ' 86' ' ' ALA . 0.4 OUTLIER -93.81 31.25 1.63 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.695 0.284 . . . . 0.0 111.277 -179.754 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 55.02 72.84 0.45 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.974 0.416 . . . . 0.0 111.263 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 57.72 65.42 3.56 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.888 -0.673 . . . . 0.0 113.115 179.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.743 ' HB2' ' HB3' ' A' ' 83' ' ' LYS . . . -93.85 32.15 1.5 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.84 0.352 . . . . 0.0 111.009 179.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -86.87 147.36 25.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.975 -179.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.92 HD12 ' HD3' ' A' ' 16' ' ' ARG . 1.5 tt -130.01 159.44 42.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.802 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.733 HD12 ' HB2' ' A' ' 91' ' ' ARG . 0.4 OUTLIER -82.0 146.4 55.39 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.018 -179.908 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -62.51 -26.5 76.25 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.526 2.151 . . . . 0.0 112.508 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.733 ' HB2' HD12 ' A' ' 89' ' ' LEU . 0.0 OUTLIER -60.7 -50.5 73.22 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.918 -179.968 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.416 ' HA ' ' HB2' ' A' ' 95' ' ' GLU . 12.8 mm-40 -66.4 -41.52 89.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.943 0.401 . . . . 0.0 110.943 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -57.93 -53.75 54.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.739 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.37 -20.86 62.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.48 179.632 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.416 ' HB2' ' HA ' ' A' ' 92' ' ' GLN . 1.7 tm-20 -60.14 -50.29 74.27 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 178.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 18.5 mm -73.02 -33.28 42.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.307 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.594 ' CZ3' HD23 ' A' ' 60' ' ' LEU . 4.2 t-105 -54.79 -36.56 65.05 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.881 178.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.679 ' OE1' HD11 ' A' ' 103' ' ' ILE . 1.9 mp0 -85.41 -31.16 23.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.584 179.342 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.7 mtt180 -56.78 -54.61 44.38 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.584 -179.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' CYS . . . . . 0.464 ' SG ' HD11 ' A' ' 60' ' ' LEU . 42.3 t -82.37 -79.14 0.19 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.032 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 170.34 38.25 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.557 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.516 ' CA ' HD22 ' A' ' 60' ' ' LEU . . . -58.97 -50.77 64.21 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.575 -0.822 . . . . 0.0 112.182 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.818 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.3 mp -56.37 -53.07 44.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.842 0.354 . . . . 0.0 111.092 179.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -56.37 -39.84 73.57 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.994 0.426 . . . . 0.0 110.336 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -65.19 -45.36 85.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.062 179.172 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.906 HD22 HD11 ' A' ' 110' ' ' ILE . 0.4 OUTLIER -62.05 -43.31 99.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.261 179.488 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.513 ' HG2' HD23 ' A' ' 124' ' ' LEU . 1.4 mm-40 -63.31 -29.83 71.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.722 179.679 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 40.4 t -67.64 -50.53 57.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.705 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.441 ' HB1' ' HG3' ' A' ' 65' ' ' LYS . . . -72.81 -35.03 67.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.487 0.66 . . . . 0.0 109.503 178.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.906 HD11 HD22 ' A' ' 106' ' ' LEU . 13.4 mt -57.57 -49.49 80.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.456 179.285 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -72.34 -37.93 68.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.6 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 3.1 m -68.88 -13.39 62.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.073 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 77.26 30.81 0.51 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.902 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.1 mm-40 -100.75 -29.43 12.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.561 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . 0.61 ' HB1' ' CG2' ' A' ' 121' ' ' THR . . . -80.88 143.05 33.0 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.927 179.863 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -99.51 118.63 61.85 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.795 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.422 ' HB2' ' HG2' ' A' ' 5' ' ' GLU . 53.1 Cg_exo -55.62 88.68 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.529 2.153 . . . . 0.0 112.504 -179.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.764 ' O ' HG23 ' A' ' 6' ' ' ILE . 97.6 m -110.56 -70.3 0.82 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.557 179.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.455 ' CE2' ' HG2' ' A' ' 8' ' ' MET . 48.1 t80 -147.7 -53.54 0.21 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.745 179.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.453 ' HB2' ' HE ' ' A' ' 48' ' ' ARG . . . -62.78 -44.66 95.6 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.875 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.61 ' CG2' ' HB1' ' A' ' 115' ' ' ALA . 0.7 OUTLIER -60.72 -49.1 78.85 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.466 179.702 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.838 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -61.8 -48.03 82.48 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.367 0.603 . . . . 0.0 110.153 179.142 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' MET . . . . . 0.596 ' CE ' HD13 ' A' ' 127' ' ' LEU . 0.0 OUTLIER -55.57 -38.52 69.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.527 179.309 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.906 HD13 ' CD1' ' A' ' 106' ' ' LEU . 0.2 OUTLIER -65.67 -44.29 86.72 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 0.0 109.988 179.163 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -50.9 -39.59 54.62 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.924 179.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -81.44 -32.55 32.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.113 179.012 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.596 HD13 ' CE ' ' A' ' 123' ' ' MET . 1.7 tp -60.01 -19.74 54.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.489 179.131 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 19.4 mt -72.36 -28.7 63.2 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.032 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.941 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.754 0.312 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.921 ' O ' HD12 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -56.82 -59.72 4.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.794 179.94 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -55.22 -36.83 66.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.655 179.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.6 tp60 -59.09 -38.26 79.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.962 0.411 . . . . 0.0 110.611 179.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -71.27 -57.13 4.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.111 179.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.963 HG12 ' HB2' ' A' ' 122' ' ' ALA . 2.9 mp -55.32 -62.28 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.163 179.049 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.9 t0 42.6 81.75 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.878 -1.055 . . . . 0.0 111.503 -179.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 1.5 ptp -65.6 -19.27 65.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.309 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.8 mmtp -52.2 -28.71 19.34 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.186 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -63.68 154.57 32.64 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.878 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -70.24 130.34 41.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.072 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.462 ' HG3' ' CZ ' ' A' ' 119' ' ' TYR . 69.8 mm-40 -111.79 108.52 17.96 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.883 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.503 ' HB3' ' CZ ' ' A' ' 15' ' ' PHE . 13.1 mtp180 -109.8 130.52 55.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.905 0.384 . . . . 0.0 110.915 -179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . 0.515 ' CE2' ' CE1' ' A' ' 40' ' ' HIS . 0.8 OUTLIER -115.67 134.85 54.63 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.996 179.879 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.616 ' HE2' HD21 ' A' ' 75' ' ' LEU . 5.9 m-85 -139.58 155.62 47.36 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.404 0.621 . . . . 0.0 112.313 -178.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.581 ' HB3' HG21 ' A' ' 88' ' ' ILE . 0.4 OUTLIER -149.26 144.86 26.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.519 179.122 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.72 HD11 HD13 ' A' ' 80' ' ' LEU . 0.0 OUTLIER -136.13 125.58 15.94 Favored Pre-proline 0 C--N 1.327 -0.408 0 C-N-CA 120.893 -0.323 . . . . 0.0 111.834 -179.345 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.423 ' HB3' ' CD1' ' A' ' 36' ' ' TRP . 73.8 Cg_endo -89.2 96.92 0.34 Allowed 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.928 2.419 . . . . 0.0 111.664 179.337 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -119.17 153.81 34.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.973 0.416 . . . . 0.0 111.269 -179.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.618 HG21 ' HB2' ' A' ' 32' ' ' LYS . 11.2 mt -101.95 140.02 21.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.065 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.9 mtp180 -59.9 133.92 89.75 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.417 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.476 ' O ' ' CE2' ' A' ' 26' ' ' TYR . 50.2 Cg_exo -53.59 -52.05 9.46 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.533 2.155 . . . . 0.0 113.0 -179.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.561 ' HA ' ' CE1' ' A' ' 26' ' ' TYR . . . -53.64 -58.78 5.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.522 -179.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.543 ' HA ' ' HB2' ' A' ' 27' ' ' LYS . 3.4 m-20 -67.71 -28.71 67.9 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.88 -179.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.407 ' HB3' ' O ' ' A' ' 22' ' ' PRO . 0.1 OUTLIER -53.09 -57.34 10.73 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.599 -179.405 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.561 ' CE1' ' HA ' ' A' ' 23' ' ' ALA . 1.9 p90 -87.28 -17.19 33.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.562 -179.432 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.543 ' HB2' ' HA ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -58.53 -53.23 60.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.899 0.381 . . . . 0.0 110.813 179.684 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -159.75 143.75 10.78 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.17 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -73.2 -7.96 21.31 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.604 2.203 . . . . 0.0 112.724 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -110.48 -36.59 5.72 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.901 0.382 . . . . 0.0 110.873 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 30.4 m120 -99.59 32.07 2.95 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.854 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.618 ' HB2' HG21 ' A' ' 20' ' ' ILE . 0.0 OUTLIER -74.33 -30.04 61.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.935 -179.875 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 42.6 mmtt 58.21 100.9 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.979 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.433 ' HG2' HG12 ' A' ' 20' ' ' ILE . 0.2 OUTLIER -85.0 119.79 25.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.917 179.966 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.422 ' HA3' ' CE1' ' A' ' 53' ' ' HIS . . . -105.85 143.79 15.75 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.907 -179.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.423 ' CD1' ' HB3' ' A' ' 18' ' ' PRO . 7.3 m-90 -108.99 137.44 46.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.811 0.338 . . . . 0.0 110.907 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.557 ' HZ3' HD21 ' A' ' 80' ' ' LEU . 31.9 t90 -118.79 117.22 28.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.5 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.858 ' CE1' HD12 ' A' ' 52' ' ' LEU . 22.1 m-85 -111.61 149.29 31.69 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.778 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.443 ' HB1' ' CD1' ' A' ' 46' ' ' ILE . . . -170.37 124.85 0.73 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.088 0.471 . . . . 0.0 111.294 179.815 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.515 ' CE1' ' CE2' ' A' ' 14' ' ' PHE . 9.7 t-160 -95.27 103.78 15.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.673 179.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.686 ' CE2' HG21 ' A' ' 78' ' ' THR . 4.4 m-85 -89.58 128.84 36.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.164 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.427 ' H ' ' HA ' ' A' ' 46' ' ' ILE . 7.7 p-10 -96.65 114.43 26.07 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 178.623 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 58.23 -137.34 50.09 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.015 -1.088 . . . . 0.0 111.107 -178.505 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo -71.71 -16.46 29.95 Favored 'Trans proline' 0 CA--C 1.529 0.261 0 C-N-CA 122.503 2.135 . . . . 0.0 112.434 179.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' TRP . . . . . 0.408 ' CD1' ' N ' ' A' ' 45' ' ' TRP . 0.9 OUTLIER -114.73 -171.76 1.99 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.891 0.377 . . . . 0.0 111.804 -178.574 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.602 ' HB ' ' CD2' ' A' ' 41' ' ' PHE . 6.7 tt -131.24 153.86 39.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.875 -179.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.727 ' HA ' ' HB2' ' A' ' 63' ' ' ALA . . . -132.28 -20.59 2.39 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.811 -0.631 . . . . 0.0 112.317 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.745 ' NE ' ' HB2' ' A' ' 120' ' ' ALA . 4.6 mtm180 -129.03 136.26 50.06 Favored 'General case' 0 C--N 1.334 -0.079 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.052 -179.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.433 ' HB3' ' HB2' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -140.97 122.92 15.47 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.087 -179.958 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.557 ' SD ' HD11 ' A' ' 52' ' ' LEU . 5.2 ttm -125.07 112.59 16.69 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.7 179.732 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.506 ' CB ' ' HB ' ' A' ' 59' ' ' ILE . 0.0 OUTLIER -95.27 133.29 39.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.099 -179.774 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.858 HD12 ' CE1' ' A' ' 38' ' ' TYR . 30.3 mt -135.13 108.77 7.96 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.735 179.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.422 ' CE1' ' HA3' ' A' ' 35' ' ' GLY . 1.7 m-70 -128.39 135.78 28.08 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 120.699 0.285 . . . . 0.0 111.057 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -54.21 -23.46 29.83 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.534 2.156 . . . . 0.0 112.161 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -104.5 -21.42 13.45 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.04 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.417 ' HA ' ' HD2' ' A' ' 57' ' ' PRO . 1.2 mmmm -119.12 125.17 27.78 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.754 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 56' ' ' LYS . 9.4 Cg_endo -52.75 167.58 0.6 Allowed 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.49 2.126 . . . . 0.0 112.357 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.469 ' HA ' ' O ' ' A' ' 51' ' ' GLU . 20.0 Cg_endo -60.61 88.4 0.08 OUTLIER 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.718 2.279 . . . . 0.0 112.358 -179.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.506 ' HB ' ' CB ' ' A' ' 51' ' ' GLU . 58.3 mt -64.97 105.83 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.814 179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.678 HD21 ' N ' ' A' ' 102' ' ' GLY . 0.2 OUTLIER -82.11 122.74 28.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.02 -179.905 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.484 HD13 ' HB3' ' A' ' 69' ' ' GLU . 91.1 mt -134.83 151.25 50.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.93 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.8 p -154.2 148.16 13.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.071 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.727 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . . . -60.39 140.17 57.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.957 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.97 -46.78 1.56 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.381 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.568 ' HG3' ' HB2' ' A' ' 109' ' ' ALA . 0.1 OUTLIER -92.32 -55.91 3.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.876 0.369 . . . . 0.0 110.69 179.835 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.45 ' HB3' HD22 ' A' ' 61' ' ' LEU . 1.6 m-20 -109.74 37.63 2.6 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.775 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -54.14 -28.71 41.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.048 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -83.42 -28.91 28.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.84 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.484 ' HB3' HD13 ' A' ' 61' ' ' LEU . 1.6 mm-40 -77.45 -51.12 11.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.922 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.52 ' HE1' ' N ' ' A' ' 63' ' ' ALA . 4.1 ptp -50.18 175.87 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.832 0.349 . . . . 0.0 111.179 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.7 ' SG ' HG22 ' A' ' 78' ' ' THR . 0.9 OUTLIER -55.64 -49.21 73.49 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.049 -179.86 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.423 ' CB ' ' O ' ' A' ' 71' ' ' CYS . 20.1 tt0 83.47 -40.58 0.09 Allowed 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.345 -179.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.614 ' HB2' HG23 ' A' ' 78' ' ' THR . 4.2 mmtt -56.28 -168.74 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.007 0.432 . . . . 0.0 111.13 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -109.78 -174.99 2.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.969 179.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.616 HD21 ' HE2' ' A' ' 15' ' ' PHE . 0.1 OUTLIER -60.1 -53.96 51.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.708 0.289 . . . . 0.0 111.643 -179.406 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -71.03 -53.39 14.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.812 0.339 . . . . 0.0 111.846 -179.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -49.08 -36.8 19.45 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.186 -178.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' THR . . . . . 0.7 HG22 ' SG ' ' A' ' 71' ' ' CYS . 0.9 OUTLIER -62.26 -65.86 0.63 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.755 0.312 . . . . 0.0 111.22 -179.569 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 130.43 -5.47 5.92 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.901 -179.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.72 HD13 HD11 ' A' ' 17' ' ' ILE . 3.8 mm? -53.26 -40.32 64.55 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.142 0.496 . . . . 0.0 110.23 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' THR . . . . . 0.452 HG23 HD12 ' A' ' 75' ' ' LEU . 11.4 p -81.05 -33.09 33.74 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.599 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.0 mmp_? -56.06 -32.26 63.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.558 179.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.423 ' CD ' ' CG2' ' A' ' 17' ' ' ILE . 1.9 tttp -72.27 179.81 3.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.732 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -96.73 75.25 2.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.893 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 80.42 67.47 1.55 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.631 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.596 ' HB3' ' O ' ' A' ' 80' ' ' LEU . . . -97.93 20.15 12.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.771 0.32 . . . . 0.0 111.217 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -89.18 151.14 22.34 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.157 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.581 HG21 ' HB3' ' A' ' 16' ' ' ARG . 1.5 pt -133.83 159.44 42.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.11 179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.626 ' H ' HD23 ' A' ' 89' ' ' LEU . 0.7 OUTLIER -72.69 151.71 91.32 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.861 179.912 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -72.5 -24.72 18.7 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.765 2.31 . . . . 0.0 112.815 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.549 ' HB3' HD12 ' A' ' 89' ' ' LEU . 0.1 OUTLIER -64.72 -46.78 80.82 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.75 -179.809 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -67.68 -38.45 83.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.768 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -57.98 -53.23 60.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.817 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -72.28 -21.86 61.29 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.644 179.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.26 -50.49 73.82 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.061 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.41 ' HA ' ' HB2' ' A' ' 99' ' ' ARG . 17.2 mm -73.0 -33.73 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.168 178.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' TRP . . . . . 0.464 ' CD2' ' HA3' ' A' ' 102' ' ' GLY . 10.3 t-105 -53.78 -39.28 65.29 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.514 -0.767 . . . . 0.0 110.097 179.071 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -85.92 -27.2 25.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.8 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.41 ' HB2' ' HA ' ' A' ' 96' ' ' ILE . 5.8 mtm180 -56.59 -43.97 80.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.098 -179.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' CYS . . . . . . . . . . . . . 42.5 t -93.89 -79.61 0.41 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.871 -179.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.528 ' C ' HD21 ' A' ' 60' ' ' LEU . . . 176.12 36.77 0.05 OUTLIER Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.569 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.678 ' N ' HD21 ' A' ' 60' ' ' LEU . . . -59.33 -50.73 64.6 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.391 179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.809 ' HA ' HD11 ' A' ' 124' ' ' LEU . 3.3 mp -57.66 -50.01 78.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 120.761 0.315 . . . . 0.0 111.13 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -56.29 -44.41 79.81 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.933 0.397 . . . . 0.0 110.51 179.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 50.0 t80 -62.13 -46.29 89.68 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.14 179.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.952 HD13 HD13 ' A' ' 124' ' ' LEU . 0.5 OUTLIER -62.02 -40.48 95.84 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.338 179.486 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.485 ' HG2' HD23 ' A' ' 124' ' ' LEU . 0.1 OUTLIER -64.05 -29.75 70.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.687 179.545 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 35.7 t -69.28 -50.31 48.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.658 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.568 ' HB2' ' HG3' ' A' ' 65' ' ' LYS . . . -72.54 -35.33 68.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.452 0.644 . . . . 0.0 109.567 178.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.824 HD11 HD22 ' A' ' 106' ' ' LEU . 13.1 mt -58.26 -49.4 81.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.426 179.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -72.56 -38.6 67.91 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.597 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' SER . . . . . . . . . . . . . 1.7 m -66.6 -15.67 63.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.184 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 77.16 34.97 0.37 Allowed 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 120.972 0.415 . . . . 0.0 110.89 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 49.6 mm-40 -107.16 -28.19 10.11 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.626 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -74.67 151.25 39.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.029 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -107.38 108.98 62.49 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.95 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' PRO . . . . . 0.433 ' HA ' ' OG1' ' A' ' 121' ' ' THR . 81.8 Cg_exo -46.29 92.18 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.68 2.253 . . . . 0.0 112.699 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.701 HG21 ' HB2' ' A' ' 47' ' ' ALA . 14.2 m -112.72 -55.69 2.49 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.742 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' TYR . . . . . 0.466 ' HA ' HG23 ' A' ' 6' ' ' ILE . 51.0 t80 -166.55 -57.68 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.909 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.745 ' HB2' ' NE ' ' A' ' 48' ' ' ARG . . . -54.51 -43.08 71.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.054 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . 0.468 HG22 ' CD2' ' A' ' 106' ' ' LEU . 9.2 p -58.41 -49.0 78.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.425 179.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.963 ' HB2' HG12 ' A' ' 6' ' ' ILE . . . -60.98 -49.95 75.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.38 0.61 . . . . 0.0 109.6 178.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' MET . . . . . 0.709 ' HE1' HD13 ' A' ' 127' ' ' LEU . 2.2 tmm? -55.95 -30.85 62.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.069 178.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.952 HD13 HD13 ' A' ' 106' ' ' LEU . 0.2 OUTLIER -70.02 -46.52 64.91 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.852 178.979 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' GLN . . . . . . . . . . . . . 59.6 mm-40 -51.45 -38.65 54.79 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.027 179.142 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -77.82 -36.03 50.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.05 179.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.709 HD13 ' HE1' ' A' ' 123' ' ' MET . 0.4 OUTLIER -61.34 -18.2 57.51 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.408 178.937 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.603 ' O ' HD12 ' A' ' 128' ' ' LEU . 1.0 OUTLIER -140.64 80.33 1.75 Allowed 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.953 -179.949 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.25 1.111 0 CA-C-O 118.114 -0.946 . . . . 0.0 110.942 179.977 . . . . . . . . 1 1 . 1 stop_ save_