data_2lox_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 2lox _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 ' 3' ' ' HIS . . . . . 0.403 ' HA ' HG22 ' A' ' 103' ' ' THR . 33.8 m80 . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.651 0.262 . . . . 0.0 111.164 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.521 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 11.3 p -161.2 152.24 18.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.281 0.563 . . . . 0.0 111.111 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.42 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 173.95 137.76 2.51 Favored Glycine 0 N--CA 1.448 -0.509 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.56 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -80.86 145.47 31.35 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -178.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 91' ' ' PHE . . . -151.98 171.18 18.23 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.358 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.491 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -103.54 122.01 55.63 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.652 -179.668 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.455 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 4.6 t80 -120.75 106.98 12.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.877 0.37 . . . . 0.0 111.201 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.424 ' HG2' ' CD1' ' A' ' 9' ' ' PHE . 41.9 mm-40 67.98 49.09 0.92 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.864 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.4 mttp 72.25 -3.76 2.2 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.417 HG11 ' CZ2' ' A' ' 29' ' ' TRP . 19.9 t -101.21 150.3 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 CA-C-O 121.074 0.464 . . . . 0.0 110.458 179.563 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 95.8 p -107.12 114.86 29.18 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.877 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -134.0 -155.98 7.77 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.028 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.56 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 16.6 mm -122.83 131.96 72.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.872 0.367 . . . . 0.0 111.375 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.47 HG23 ' O ' ' A' ' 16' ' ' ILE . 0.4 OUTLIER -100.94 113.67 37.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 177.752 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.521 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -122.18 116.61 24.48 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.553 0.692 . . . . 0.0 110.854 -179.177 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.515 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 17.5 mt -82.63 142.53 13.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 114.721 -1.127 . . . . 0.0 112.338 -178.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.489 ' O ' HG23 ' A' ' 22' ' ' VAL . 2.4 m120 -117.4 92.84 3.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.026 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.64 -0.3 46.51 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.353 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -83.38 1.3 42.02 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.442 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -100.87 -162.56 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.908 0.385 . . . . 0.0 110.988 -179.998 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 t -177.98 101.05 0.22 Allowed Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.168 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.412 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 15.7 Cg_exo -66.34 161.62 73.7 Favored 'Cis proline' 0 C--N 1.346 0.408 0 C-N-CA 123.46 -1.475 . . . . 0.0 112.608 0.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.421 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -55.29 -172.38 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.872 179.472 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -163.27 142.15 8.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.486 0.66 . . . . 0.0 112.352 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.675 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 3.0 tt -108.37 149.13 29.12 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.829 -1.078 . . . . 0.0 108.744 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -146.35 104.11 3.76 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -178.798 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.476 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 83.3 t90 -92.06 110.54 21.91 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.777 178.356 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.426 ' O ' ' N ' ' A' ' 15' ' ' ILE . 42.8 ttt180 -109.66 131.18 55.3 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.777 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.3 t -49.85 155.99 0.79 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.688 0.28 . . . . 0.0 110.597 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.6 m -74.08 -34.63 64.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.317 0.579 . . . . 0.0 109.843 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -87.12 -16.58 35.07 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.054 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.78 33.75 10.86 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.333 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -86.9 -25.02 24.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.673 0.273 . . . . 0.0 111.476 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.17 164.22 2.7 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.285 0.564 . . . . 0.0 111.491 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.476 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.7 OUTLIER -145.64 147.93 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.961 -178.851 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.428 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 58.2 m80 -122.72 120.76 34.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.654 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.46 145.06 26.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.77 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.675 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.1 t -128.49 139.03 52.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.624 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.421 ' O ' HG12 ' A' ' 45' ' ' ILE . 23.0 t -104.0 94.22 3.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 177.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.447 HD21 ' CG1' ' A' ' 40' ' ' VAL . 0.6 OUTLIER -42.22 -22.85 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.212 -0.449 . . . . 0.0 112.027 -178.783 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.412 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -76.79 -49.75 15.12 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.954 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 30.2 p -64.94 -28.22 69.38 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 178.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.573 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 31.3 mm -56.4 105.73 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.548 178.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -51.8 -31.72 28.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.188 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.406 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 3.2 pttt -172.61 166.94 5.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.574 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 11.9 tp -109.0 121.87 46.06 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.047 -179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.427 ' O ' ' N ' ' A' ' 61' ' ' ARG . 25.2 mm100 -110.41 138.34 46.93 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.289 179.495 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.472 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -156.85 140.27 15.75 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.61 0.243 . . . . 0.0 111.05 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 33.5 p . . . . . 0 CA--C 1.53 0.184 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.895 -179.941 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.879 0.371 . . . . 0.0 110.732 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.5 mpp? -149.64 138.65 21.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.656 -179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.475 HD21 ' HB2' ' A' ' 101' ' ' LYS . 39.0 mt -124.8 149.83 46.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.29 178.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.427 ' N ' ' O ' ' A' ' 49' ' ' GLN . 11.0 mtp180 -151.02 156.0 40.22 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.938 0.399 . . . . 0.0 111.604 -179.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.573 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.5 mp -127.9 118.72 24.15 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.106 178.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.406 ' HB ' ' HG2' ' A' ' 47' ' ' LYS . 6.6 mm -77.29 153.93 5.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.775 0.321 . . . . 0.0 111.049 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.298 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.494 180.0 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.486 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 13.3 p . . . . . 0 N--CA 1.457 -0.095 0 CA-C-O 120.897 0.38 . . . . 0.0 111.417 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -99.9 47.45 0.94 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.588 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -68.32 -11.39 59.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.478 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.3 m -53.98 -25.1 19.2 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.853 0.358 . . . . 0.0 111.087 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 42.3 mmtt -77.17 -70.18 0.48 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.668 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.9 ptmt 42.63 81.43 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.363 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.403 ' CD ' ' N ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -145.47 -174.16 4.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.052 -179.945 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.418 ' HG3' ' O ' ' A' ' 78' ' ' ASN . 6.2 mptt -102.8 -171.29 1.93 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.959 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -113.94 -36.51 4.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.017 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 167.89 -30.3 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.149 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -97.02 29.21 3.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.238 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 61.72 16.9 52.82 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.841 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.418 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 15.5 m-20 -67.2 -152.61 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -153.28 118.97 5.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.769 0.319 . . . . 0.0 110.826 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.2 t -94.38 -66.9 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.439 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.418 ' O ' HG12 ' A' ' 81' ' ' VAL . 5.0 p 33.15 80.2 0.26 Allowed Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.639 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -41.66 124.56 2.6 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 123.005 2.47 . . . . 0.0 112.844 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 31.4 mttt -73.21 159.9 83.94 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.908 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.486 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.3 Cg_exo . . . . . 0 N--CA 1.46 -0.484 0 C-N-CA 123.52 2.814 . . . . 0.0 112.384 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.746 0.308 . . . . 0.0 110.768 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.497 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 7.5 m-70 -92.04 111.57 23.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.401 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 12.2 ttt -98.99 134.26 42.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.148 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.47 ' HA ' ' O ' ' A' ' 8' ' ' ILE . 2.7 m-85 -136.04 122.36 20.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.792 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.8 114.28 26.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.884 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.42 ' CZ ' ' HB3' ' A' ' 7' ' ' ALA . 11.1 m-85 -91.35 145.18 24.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.88 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -99.24 34.83 2.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.605 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.433 ' CB ' HG23 ' A' ' 96' ' ' VAL . 1.1 m-20 -178.99 118.06 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.609 -179.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.416 ' HA ' ' CG ' ' A' ' 97' ' ' MET . 0.7 OUTLIER -60.06 -15.38 22.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.691 179.477 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.13 -43.07 58.88 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.066 0.46 . . . . 0.0 110.024 179.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.433 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -65.93 -51.76 57.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.295 179.061 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.416 ' CG ' ' HA ' ' A' ' 94' ' ' ARG . 0.5 OUTLIER -61.49 -36.32 80.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.285 179.372 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -66.59 -34.23 77.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.112 0.482 . . . . 0.0 110.086 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.418 ' O ' ' OG1' ' A' ' 103' ' ' THR . 53.4 m-20 -81.82 -26.43 34.34 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.531 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.444 HD13 HG23 ' A' ' 16' ' ' ILE . 2.2 mm -86.15 -59.79 2.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.088 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.475 ' HB2' HD21 ' A' ' 60' ' ' LEU . 9.9 ttmt -44.51 -30.32 0.86 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.168 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.411 ' HG3' ' N ' ' A' ' 103' ' ' THR . 19.8 ptp -78.86 -39.29 35.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.326 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.515 ' HB ' ' CD1' ' A' ' 18' ' ' ILE . 0.3 OUTLIER -58.4 -60.07 4.36 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.846 179.737 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.412 HD11 HG23 ' A' ' 100' ' ' ILE . 2.7 mt -48.0 -57.43 5.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.912 179.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.13 -41.43 79.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.969 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -54.67 -35.04 63.14 Favored 'General case' 0 C--O 1.231 0.132 0 CA-C-O 121.165 0.507 . . . . 0.0 110.337 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.581 HG23 ' OH ' ' A' ' 111' ' ' TYR . 11.9 mt -85.74 -51.03 13.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.468 179.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.626 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -42.45 -58.13 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.486 179.356 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -47.13 -27.52 1.44 Allowed 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.296 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.463 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 0.0 OUTLIER -73.38 -24.67 60.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.001 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.626 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.2 OUTLIER -74.59 -34.96 62.98 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.425 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.78 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.63 -43.32 17.11 Favored 'General case' 0 CA--C 1.504 -0.804 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 179.38 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.31 -32.06 72.75 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 113.973 -1.467 . . . . 0.0 108.99 178.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.463 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.383 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.64 178.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.5 m170 . . . . . 0 CA--C 1.528 0.119 0 CA-C-O 120.519 0.2 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.55 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 49.7 p -156.3 152.85 28.18 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.193 0.52 . . . . 0.0 111.503 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.524 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . -174.91 179.93 45.9 Favored Glycine 0 N--CA 1.448 -0.562 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.519 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -120.6 129.27 53.68 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 117.738 0.769 . . . . 0.0 111.459 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.434 ' HB3' ' CE1' ' A' ' 91' ' ' PHE . . . -141.41 171.15 14.45 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.889 -178.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.463 ' N ' ' CD1' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -100.61 121.92 51.98 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.018 179.853 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.468 ' CB ' ' CE2' ' A' ' 29' ' ' TRP . 0.7 OUTLIER -120.26 106.02 11.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.03 0.443 . . . . 0.0 111.86 179.531 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 68.16 52.71 0.65 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.562 178.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 71.19 -4.25 1.85 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.913 179.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.424 HG13 ' CZ2' ' A' ' 29' ' ' TRP . 25.2 t -103.52 148.56 8.34 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.566 0 CA-C-O 121.239 0.542 . . . . 0.0 110.527 179.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.444 ' HA ' HD13 ' A' ' 8' ' ' ILE . 1.0 OUTLIER -115.32 113.76 24.25 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.086 -179.962 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.435 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -133.63 -122.22 2.27 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.922 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.519 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 18.7 mm -141.74 136.58 31.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.766 0.317 . . . . 0.0 111.146 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.55 HG13 ' HD1' ' A' ' 29' ' ' TRP . 0.3 OUTLIER -100.82 141.76 16.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 106.301 -1.74 . . . . 0.0 106.301 176.543 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.55 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.32 115.73 5.09 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.393 -0.923 . . . . 0.0 111.55 -178.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.453 ' HA ' ' HA ' ' A' ' 27' ' ' LEU . 5.0 mt -86.68 132.3 32.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.908 -178.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.476 ' O ' HG21 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -110.72 92.82 4.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.265 179.45 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -81.39 0.51 37.06 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.517 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -82.55 0.69 41.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.259 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.476 HG21 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -101.9 -162.93 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.885 0.374 . . . . 0.0 110.88 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.3 p -174.75 101.51 0.27 Allowed Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.333 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.429 ' HB3' ' HB3' ' A' ' 43' ' ' SER . 11.3 Cg_exo -69.52 166.34 73.67 Favored 'Cis proline' 0 C--N 1.347 0.474 0 C-N-CA 123.604 -1.415 . . . . 0.0 112.562 0.467 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.07 176.67 0.4 Allowed 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.143 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.464 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.78 135.07 4.65 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.24 179.326 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.532 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.3 OUTLIER -107.96 129.43 55.11 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.88 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -113.36 110.41 20.29 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -178.653 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.55 ' HD1' HG13 ' A' ' 16' ' ' ILE . 72.7 t90 -91.77 113.56 25.86 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.472 ' O ' ' N ' ' A' ' 15' ' ' ILE . 2.6 ptm180 -114.21 134.61 54.8 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.914 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.435 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 0.2 OUTLIER -49.9 168.5 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.47 179.868 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 54.8 m -76.98 -39.08 51.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.347 0.594 . . . . 0.0 109.903 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -84.85 -14.91 46.49 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.178 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.81 33.89 12.09 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.383 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -83.19 -29.84 28.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.752 0.311 . . . . 0.0 111.332 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.0 157.54 18.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.344 0.592 . . . . 0.0 111.349 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.55 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.9 OUTLIER -145.73 130.34 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.718 -178.823 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.461 ' CB ' ' CE2' ' A' ' 9' ' ' PHE . 2.7 m80 -107.71 122.76 47.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.944 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.51 129.83 43.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.794 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.532 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -117.4 139.9 42.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.338 -179.649 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.406 ' O ' HG12 ' A' ' 45' ' ' ILE . 2.8 t -103.88 95.86 4.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 177.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.426 ' CB ' ' OH ' ' A' ' 111' ' ' TYR . 0.6 OUTLIER -42.13 -24.8 0.05 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.062 -178.919 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.429 ' HB3' ' HB3' ' A' ' 24' ' ' PRO . 3.1 p -74.94 -48.75 22.87 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 179.236 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.9 p -64.71 -28.01 69.31 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.531 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 33.8 mm -57.15 105.69 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.533 178.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.474 ' N ' ' O ' ' A' ' 63' ' ' ILE . 2.6 t0 -47.87 -33.55 7.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.805 0.336 . . . . 0.0 111.071 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -172.47 163.39 5.48 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.805 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.0 tp -109.11 124.85 51.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.01 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -119.99 144.93 47.23 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.611 179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.475 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -157.06 147.88 21.63 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.7 -0.227 . . . . 0.0 110.793 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 71.2 p . . . . . 0 C--N 1.333 -0.135 0 CA-C-O 120.741 0.305 . . . . 0.0 111.144 -179.636 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.417 ' HB2' ' HG2' ' A' ' 97' ' ' MET . 1.0 OUTLIER . . . . . 0 N--CA 1.463 0.185 0 CA-C-O 120.919 0.39 . . . . 0.0 111.698 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.403 ' HG2' ' HA ' ' A' ' 90' ' ' SER . 24.0 mtm -150.09 138.52 20.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.432 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.475 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 20.9 mt -117.8 142.19 47.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.225 178.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.445 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 13.8 ttm180 -142.51 150.01 39.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.984 0.421 . . . . 0.0 111.846 -179.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.531 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.5 mp -128.4 117.32 21.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.949 178.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.474 ' O ' ' N ' ' A' ' 46' ' ' ASP . 10.3 mm -76.47 146.07 9.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.764 -179.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.408 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.386 179.972 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 13.2 p . . . . . 0 N--CA 1.457 -0.113 0 CA-C-O 120.814 0.34 . . . . 0.0 111.258 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -101.13 39.39 1.41 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.772 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.41 -23.03 64.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.113 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.1 t -60.39 -20.41 59.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.105 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt -83.24 -67.32 0.8 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.867 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 28.3 mttt 60.17 92.35 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.764 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.74 -179.02 4.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.065 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.8 mttp -131.82 -167.2 1.83 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.708 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -136.86 -178.67 5.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.893 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -57.32 -22.09 39.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.408 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -108.73 34.8 3.48 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.855 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 55.22 25.22 39.23 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.558 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -67.42 -169.95 0.12 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.797 0.332 . . . . 0.0 110.903 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -136.62 122.01 19.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.637 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.6 t -91.1 -64.91 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.357 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.417 ' O ' HG12 ' A' ' 81' ' ' VAL . 4.4 p 34.85 78.09 0.35 Allowed Pre-proline 0 CA--C 1.531 0.212 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.958 179.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -42.73 125.31 3.79 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 123.125 2.55 . . . . 0.0 112.648 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -60.59 161.42 14.53 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.076 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 5.0 Cg_exo . . . . . 0 N--CA 1.461 -0.394 0 C-N-CA 123.578 2.852 . . . . 0.0 112.363 -179.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.601 0.238 . . . . 0.0 110.734 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.47 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 31.4 m-70 -96.87 112.56 24.26 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.09 119.17 32.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.97 0.414 . . . . 0.0 111.391 -179.236 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.468 ' CD1' ' CD1' ' A' ' 16' ' ' ILE . 89.7 m-85 -122.94 116.75 24.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.58 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.403 ' HA ' ' HG2' ' A' ' 59' ' ' MET . 0.4 OUTLIER -101.52 114.57 28.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.785 0.326 . . . . 0.0 110.628 179.936 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.434 ' CE1' ' HB3' ' A' ' 7' ' ' ALA . 30.7 m-85 -93.5 152.63 18.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.371 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -110.39 28.47 8.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.603 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.427 ' CB ' HG21 ' A' ' 96' ' ' VAL . 9.0 m-20 -171.59 112.16 0.33 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.635 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.417 ' O ' ' HG3' ' A' ' 97' ' ' MET . 2.5 ttp85 -55.87 -19.48 11.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.911 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.22 -47.35 61.81 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.684 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.434 HG12 ' HA3' ' A' ' 5' ' ' GLY . 0.2 OUTLIER -66.67 -46.1 86.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.959 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.456 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -63.27 -36.35 83.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.918 179.329 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.456 ' N ' ' HG3' ' A' ' 97' ' ' MET . 11.0 m-20 -62.6 -34.14 76.4 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.148 0.499 . . . . 0.0 110.047 179.19 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 45.1 m-20 -81.84 -35.06 29.8 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.527 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.445 HG21 HD12 ' A' ' 104' ' ' LEU . 9.4 mm -76.45 -59.83 2.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.717 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.471 ' HB2' HD21 ' A' ' 60' ' ' LEU . 5.8 ttmt -51.62 -29.69 18.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.148 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.405 ' HG3' ' N ' ' A' ' 103' ' ' THR . 9.4 ptp -82.49 -37.98 24.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.92 -179.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.426 HG22 HD12 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -70.29 -42.09 72.52 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.018 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.445 HD12 HG21 ' A' ' 100' ' ' ILE . 28.4 mt -55.14 -52.1 64.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.016 0.436 . . . . 0.0 110.017 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -46.22 91.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.26 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 -47.06 -34.14 5.55 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.12 0.485 . . . . 0.0 110.864 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.623 HG23 ' OH ' ' A' ' 111' ' ' TYR . 12.3 mt -85.62 -52.27 12.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.264 179.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.656 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.48 -57.65 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.497 179.323 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -47.55 -26.06 1.32 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.347 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.455 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 0.0 OUTLIER -75.69 -24.8 56.29 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.925 179.865 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.656 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.2 OUTLIER -73.69 -34.35 64.83 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 179.233 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.773 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.53 -43.24 17.37 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 179.058 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -62.01 -32.16 72.62 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 113.898 -1.501 . . . . 0.0 109.022 178.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.455 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.437 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.611 178.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.414 ' O ' ' N ' ' A' ' 18' ' ' ILE . 34.6 m170 . . . . . 0 CA--C 1.531 0.247 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.551 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 4.0 p -152.67 153.89 34.2 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.125 0.488 . . . . 0.0 111.333 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.482 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 172.07 138.93 2.67 Favored Glycine 0 C--O 1.225 -0.421 0 N-CA-C 110.731 -0.948 . . . . 0.0 110.731 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.573 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -83.13 145.98 28.91 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -178.5 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.417 ' CB ' ' HB3' ' A' ' 89' ' ' PHE . . . -157.5 171.27 20.67 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.162 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.516 HG12 ' HB2' ' A' ' 90' ' ' SER . 5.2 mm -101.24 127.58 54.37 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.477 ' CZ ' ' CD2' ' A' ' 38' ' ' HIS . 5.9 t80 -124.39 108.23 11.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.996 0.427 . . . . 0.0 111.041 178.046 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 6.8 mm-40 68.67 49.2 0.74 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.829 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp 72.82 -6.25 1.7 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.135 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.419 HG12 ' CZ2' ' A' ' 29' ' ' TRP . 14.3 t -101.04 144.91 12.21 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.497 0 CA-C-O 121.219 0.533 . . . . 0.0 110.562 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.45 ' HA ' ' CD1' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -99.16 114.18 26.81 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.938 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -136.46 -170.42 11.98 Favored Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.886 -0.673 . . . . 0.0 111.846 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.573 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 14.5 mm -105.76 136.11 41.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 120.788 0.327 . . . . 0.0 111.186 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.525 ' CD1' ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.51 140.62 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 176.962 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.551 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.3 117.9 5.74 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.716 -0.794 . . . . 0.0 111.554 -178.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.516 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 22.5 mt -82.02 142.81 13.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 114.461 -1.245 . . . . 0.0 112.184 -178.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.516 ' O ' HG22 ' A' ' 22' ' ' VAL . 1.6 t30 -118.2 92.82 3.92 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.972 179.14 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.29 -0.82 42.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.314 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -82.45 0.62 41.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.661 0.267 . . . . 0.0 111.184 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.516 HG22 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.46 -162.34 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 120.824 0.345 . . . . 0.0 110.654 179.994 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.1 t -176.29 101.6 0.24 Allowed Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.4 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.45 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 9.7 Cg_exo -70.98 161.37 89.87 Favored 'Cis proline' 0 C--N 1.347 0.492 0 C-N-CA 123.682 -1.382 . . . . 0.0 112.673 0.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.64 178.23 0.03 OUTLIER 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.498 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.484 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 7.9 pt-20 -163.63 135.18 4.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.135 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.577 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.3 OUTLIER -107.9 130.44 55.02 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.123 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 10.4 m -113.46 113.06 24.63 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.487 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 73.2 t90 -91.92 110.38 21.73 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.8 ttt180 -106.25 131.0 54.0 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.838 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.7 m -49.96 153.89 1.24 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.706 0.289 . . . . 0.0 110.562 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 18.8 m -72.97 -33.69 66.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.281 0.563 . . . . 0.0 109.7 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -87.96 -17.16 31.9 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.002 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.89 33.61 10.88 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.31 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -88.48 -24.39 22.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.645 0.259 . . . . 0.0 111.485 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.04 166.61 2.98 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.383 0.611 . . . . 0.0 111.465 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.484 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.6 OUTLIER -143.66 155.48 16.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.919 -178.865 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.477 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 37.8 m80 -130.15 119.39 22.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.695 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.43 129.05 43.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.763 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.577 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -116.78 139.72 42.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.379 -179.543 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.406 ' O ' HG12 ' A' ' 45' ' ' ILE . 25.3 t -103.97 95.37 3.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 177.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.435 ' CB ' ' OH ' ' A' ' 111' ' ' TYR . 0.5 OUTLIER -42.59 -23.95 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.953 -178.849 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.45 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.8 OUTLIER -76.42 -48.15 20.71 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 179.257 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.404 ' CG2' ' HB ' ' A' ' 41' ' ' VAL . 34.8 p -64.53 -27.84 69.24 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.527 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 48.0 mm -56.46 110.56 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.548 178.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 63' ' ' ILE . 9.0 t0 -54.34 -31.65 54.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.794 0.33 . . . . 0.0 110.935 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.8 pttt -172.66 164.34 5.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.827 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.8 tp -109.02 117.35 33.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.409 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -113.2 147.45 37.43 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.551 0.215 . . . . 0.0 110.691 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.501 ' HB3' HD23 ' A' ' 60' ' ' LEU . . . -157.2 152.01 25.68 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.662 -0.244 . . . . 0.0 111.162 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 17.7 p . . . . . 0 C--N 1.331 -0.209 0 CA-C-O 120.796 0.331 . . . . 0.0 111.168 -179.763 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.4 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 1.8 mpt? . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.774 0.321 . . . . 0.0 111.153 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 37.9 mtm -149.81 138.3 20.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.033 0.444 . . . . 0.0 111.73 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.501 HD23 ' HB3' ' A' ' 50' ' ' ALA . 17.2 mt -122.11 141.96 50.87 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.572 178.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 42.1 ttp180 -142.48 150.74 40.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.104 0.478 . . . . 0.0 112.284 -178.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.527 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.6 mp -128.15 115.51 18.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.565 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.431 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 7.8 mm -76.42 156.5 5.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.623 0.249 . . . . 0.0 111.046 -179.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.498 -179.934 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.454 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 13.1 p . . . . . 0 CA--C 1.528 0.097 0 CA-C-O 120.808 0.337 . . . . 0.0 110.994 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.6 p30 -130.31 51.55 2.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.697 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -64.63 -16.44 62.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.401 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.1 m -105.81 33.61 3.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.904 0.383 . . . . 0.0 110.793 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.76 -40.78 0.69 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.967 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.3 mttp 63.45 95.44 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.955 0.407 . . . . 0.0 110.771 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.39 133.84 40.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.984 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.407 ' CG ' ' HA2' ' A' ' 77' ' ' GLY . 0.0 OUTLIER -68.28 149.21 49.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.131 -179.856 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.403 ' O ' ' CB ' ' A' ' 75' ' ' ASN . 0.6 OUTLIER -94.37 -36.19 12.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.834 179.793 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . 0.403 ' CB ' ' O ' ' A' ' 74' ' ' ASP . 0.7 OUTLIER 165.41 -28.42 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.115 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -116.55 30.78 7.13 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.385 -179.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.407 ' HA2' ' CG ' ' A' ' 73' ' ' LYS . . . 54.93 29.4 51.03 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.569 -0.824 . . . . 0.0 112.576 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -78.48 -0.86 31.06 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 55.64 108.81 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.821 0.343 . . . . 0.0 111.625 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 7.6 t -115.24 142.38 28.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.386 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 96.3 t -112.41 83.96 5.79 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.467 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -44.36 142.62 4.24 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.714 2.276 . . . . 0.0 112.489 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.5 mttt -89.32 164.96 28.22 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.018 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.454 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 2.6 Cg_exo . . . . . 0 N--CA 1.462 -0.376 0 C-N-CA 123.624 2.882 . . . . 0.0 112.019 -179.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.627 0.251 . . . . 0.0 110.476 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.485 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 7.1 m-70 -95.9 111.65 23.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.783 0.325 . . . . 0.0 110.501 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 3.8 ttt -93.95 137.85 32.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.98 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.525 ' CD1' ' CD1' ' A' ' 16' ' ' ILE . 87.9 m-85 -136.26 116.88 13.89 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.938 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.516 ' HB2' HG12 ' A' ' 8' ' ' ILE . 1.1 m -91.0 114.74 27.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.827 0.346 . . . . 0.0 110.64 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.442 ' CE2' HG13 ' A' ' 100' ' ' ILE . 9.3 m-85 -92.62 135.78 33.79 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.569 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -101.75 31.03 4.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.475 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.417 ' CB ' HG21 ' A' ' 96' ' ' VAL . 4.6 m-20 -176.42 120.68 0.15 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.757 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.442 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -59.89 -16.66 31.06 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.67 179.544 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -74.37 -50.75 17.38 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 120.95 0.405 . . . . 0.0 110.402 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.417 HG21 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -66.22 -40.13 86.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.687 179.323 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.442 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -68.41 -37.97 80.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.038 179.531 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.435 ' N ' ' HG3' ' A' ' 97' ' ' MET . 17.8 t0 -65.9 -26.67 67.72 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.998 178.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.425 ' O ' ' OG1' ' A' ' 103' ' ' THR . 79.7 m-20 -81.66 -65.71 0.98 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.412 179.454 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.442 HG13 ' CE2' ' A' ' 91' ' ' PHE . 15.1 mm -48.28 -57.87 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-O 121.115 0.483 . . . . 0.0 110.623 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.45 ' HD2' ' HB2' ' A' ' 50' ' ' ALA . 17.2 ttpp -46.77 -39.18 11.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.983 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 30.3 mtm -78.01 -43.75 28.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.497 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.516 ' HB ' ' CD1' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -56.96 -53.61 56.03 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.084 -179.991 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.411 ' CD2' HD11 ' A' ' 42' ' ' LEU . 3.4 mt -49.99 -53.27 27.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.993 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -56.87 -46.28 81.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.007 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -49.9 -35.04 22.22 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 121.176 0.512 . . . . 0.0 110.3 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.605 HG22 ' OH ' ' A' ' 111' ' ' TYR . 10.2 mt -85.66 -51.83 12.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.379 179.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.653 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.28 -57.2 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.37 179.338 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -46.95 -28.22 1.54 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.253 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.516 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.0 OUTLIER -72.89 -24.89 60.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.28 179.896 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.653 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.2 OUTLIER -75.08 -34.79 61.82 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.665 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.774 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.47 -43.68 16.94 Favored 'General case' 0 CA--C 1.505 -0.752 0 N-CA-C 107.918 -1.142 . . . . 0.0 107.918 179.114 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -61.39 -31.36 71.27 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 113.883 -1.508 . . . . 0.0 109.027 178.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.456 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.449 -0.488 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.56 178.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.2 m170 . . . . . 0 CA--C 1.528 0.097 0 CA-C-O 120.599 0.238 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.519 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 8.1 p -161.52 159.76 28.27 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.199 0.523 . . . . 0.0 111.37 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . 168.32 136.84 2.12 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.109 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.563 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -80.83 142.48 33.64 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -178.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.479 ' HB1' ' CZ ' ' A' ' 91' ' ' PHE . . . -148.08 171.31 16.05 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.402 -179.145 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.49 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -104.1 122.64 57.17 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.439 -179.766 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.451 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 5.1 t80 -122.77 107.64 12.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.942 0.401 . . . . 0.0 111.153 178.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.425 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 8.0 mt-10 68.34 48.4 0.88 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.92 179.11 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.9 mttm 73.15 -4.73 2.11 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.42 HG12 ' CZ2' ' A' ' 29' ' ' TRP . 18.9 t -100.91 149.45 6.25 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 CA-C-O 121.094 0.473 . . . . 0.0 110.54 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.42 114.03 27.14 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.8 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -130.91 -138.19 4.23 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.206 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.563 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 15.4 mm -135.64 131.87 51.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.725 0.298 . . . . 0.0 111.551 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.474 HG23 ' CD1' ' A' ' 100' ' ' ILE . 0.3 OUTLIER -101.33 115.54 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 177.524 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.519 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -125.36 116.1 21.36 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.589 0.709 . . . . 0.0 110.936 -179.157 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 7.2 mt -82.25 142.74 13.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.824 -178.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.481 ' O ' HG23 ' A' ' 22' ' ' VAL . 2.4 m120 -117.66 93.92 4.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.368 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.402 ' CG ' HG12 ' A' ' 107' ' ' ILE . 1.2 tm-20 -81.61 -0.16 41.13 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.397 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -83.64 1.36 42.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.561 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -100.55 -162.48 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.959 0.409 . . . . 0.0 111.045 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.6 t -176.86 101.04 0.23 Allowed Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.32 179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.421 ' HG3' ' CB ' ' A' ' 43' ' ' SER . 38.1 Cg_endo -67.98 161.87 79.35 Favored 'Cis proline' 0 C--N 1.347 0.457 0 C-N-CA 123.349 -1.521 . . . . 0.0 112.422 0.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.48 -174.71 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.868 179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -161.23 144.09 12.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.564 0.697 . . . . 0.0 112.312 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.677 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 3.0 tt -108.25 149.14 29.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.753 -1.112 . . . . 0.0 108.541 178.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.1 m -147.42 104.65 3.66 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.168 -0.613 . . . . 0.0 112.557 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.487 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 84.9 t90 -92.02 110.44 21.81 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.727 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.402 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.5 ttm180 -110.69 130.59 55.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.925 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.3 t -49.86 156.81 0.67 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.66 0.267 . . . . 0.0 110.533 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.4 m -74.52 -35.71 63.18 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.438 0.637 . . . . 0.0 109.817 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -85.6 -16.01 40.69 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.119 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.62 34.22 12.03 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.358 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -87.37 -24.37 24.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.706 0.289 . . . . 0.0 111.54 -179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.27 163.01 2.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.293 0.568 . . . . 0.0 111.521 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.487 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.7 148.58 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.033 -178.864 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -123.58 120.08 31.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.61 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.49 146.42 24.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.856 0.36 . . . . 0.0 110.934 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.677 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.2 t -131.17 139.13 51.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.494 -179.373 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.4 t -103.95 95.91 4.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 177.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.508 ' CD1' HD21 ' A' ' 104' ' ' LEU . 1.1 mm? -42.46 -22.2 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.421 ' CB ' ' HG3' ' A' ' 24' ' ' PRO . 2.1 t -77.21 -48.26 18.05 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 43.2 p -64.95 -28.11 69.3 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.564 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 46.1 mm -56.6 108.63 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.648 178.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.428 ' N ' ' O ' ' A' ' 63' ' ' ILE . 1.6 t0 -54.15 -31.81 53.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.886 0.374 . . . . 0.0 110.971 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.414 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 0.7 OUTLIER -171.67 164.59 6.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.75 179.814 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.424 HD12 ' CD1' ' A' ' 104' ' ' LEU . 11.4 tp -109.05 118.22 36.22 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.874 -179.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.482 ' O ' ' N ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -108.75 139.12 44.01 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.299 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.488 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -156.86 143.92 18.7 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.759 0.314 . . . . 0.0 111.291 -179.551 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 7.0 p . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.414 -179.481 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.446 ' HG2' ' CA ' ' A' ' 94' ' ' ARG . 2.2 mpt? . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.898 0.38 . . . . 0.0 111.235 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.592 ' HG3' ' HA ' ' A' ' 90' ' ' SER . 0.0 OUTLIER -149.95 137.88 20.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.572 -179.859 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.488 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 29.6 mt -127.8 148.89 50.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.971 178.346 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.482 ' N ' ' O ' ' A' ' 49' ' ' GLN . 12.6 ttt180 -153.17 152.4 31.2 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -179.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.564 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.4 mp -128.21 116.73 20.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.717 178.224 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.438 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 19.0 mm -76.59 156.72 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.723 0.297 . . . . 0.0 111.257 -179.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.236 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.31 179.865 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.525 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 12.2 p . . . . . 0 N--CA 1.457 -0.108 0 CA-C-O 120.801 0.334 . . . . 0.0 111.319 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -122.29 53.2 1.25 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.661 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -62.95 -15.14 54.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.464 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.0 t -53.38 -25.04 13.93 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.948 0.404 . . . . 0.0 111.24 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.7 mmtm -74.12 -69.1 0.47 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.693 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.1 ptpt 42.57 81.13 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.419 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.76 -175.94 5.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.16 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.405 ' HD2' ' N ' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -108.44 -173.14 2.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.898 -179.736 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -105.79 -41.19 5.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.987 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 168.17 -31.32 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.05 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -98.5 39.3 1.26 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.003 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 59.5 18.8 45.55 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.64 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -61.58 -156.45 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 110.46 -0.2 . . . . 0.0 110.46 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -162.22 114.43 1.69 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.803 0.335 . . . . 0.0 110.767 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 42.8 t -96.3 -69.94 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.494 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 4.1 p 35.46 70.55 0.97 Allowed Pre-proline 0 CA--C 1.53 0.203 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.584 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -40.18 128.79 2.25 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 123.435 2.757 . . . . 0.0 112.76 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.9 pttm -94.98 164.7 18.71 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.946 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.525 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 4.3 Cg_exo . . . . . 0 N--CA 1.461 -0.389 0 C-N-CA 123.603 2.869 . . . . 0.0 112.255 -179.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.602 0.239 . . . . 0.0 110.528 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.462 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 6.8 m-70 -93.7 111.21 22.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.343 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.403 ' HA ' ' HG3' ' A' ' 61' ' ' ARG . 0.1 OUTLIER -107.07 137.36 45.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.971 0.415 . . . . 0.0 111.149 -179.637 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.472 ' CD1' ' N ' ' A' ' 89' ' ' PHE . 1.1 m-85 -137.0 128.84 29.05 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.775 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.592 ' HA ' ' HG3' ' A' ' 59' ' ' MET . 0.9 OUTLIER -97.22 114.42 26.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.727 179.718 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.481 ' CE2' HG13 ' A' ' 100' ' ' ILE . 33.1 m-85 -91.12 145.58 24.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.109 0.48 . . . . 0.0 111.496 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -108.31 27.65 9.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.487 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -165.67 111.02 0.88 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.851 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.446 ' CA ' ' HG2' ' A' ' 58' ' ' MET . 0.0 OUTLIER -58.71 -23.62 59.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.429 179.696 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -72.95 -44.07 61.57 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.8 179.152 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 37.7 t -65.43 -51.96 57.49 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.445 178.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.416 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.1 OUTLIER -60.67 -36.0 77.63 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.853 179.209 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.416 ' N ' ' HG3' ' A' ' 97' ' ' MET . 4.0 m-20 -61.05 -33.75 73.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.089 179.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -81.64 -25.23 35.8 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.578 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.481 HG13 ' CE2' ' A' ' 91' ' ' PHE . 9.1 mm -84.87 -60.14 2.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.002 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.441 ' HB2' HD21 ' A' ' 60' ' ' LEU . 2.7 ttmm -53.31 -27.48 23.32 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.766 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.44 ' HG3' ' N ' ' A' ' 103' ' ' THR . 9.5 ptp -81.57 -39.96 23.79 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.75 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.44 ' N ' ' HG3' ' A' ' 102' ' ' MET . 0.9 OUTLIER -74.95 -32.91 61.86 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-O 120.984 0.421 . . . . 0.0 110.023 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.508 HD21 ' CD1' ' A' ' 42' ' ' LEU . 11.2 mt -60.71 -58.6 7.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.458 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.437 ' HA ' HG13 ' A' ' 108' ' ' ILE . 0.4 OUTLIER -68.34 -33.19 73.85 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.892 179.721 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -52.8 -34.72 54.93 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.273 0.559 . . . . 0.0 109.993 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.586 HG22 ' OH ' ' A' ' 111' ' ' TYR . 6.1 mt -84.95 -52.14 12.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.141 179.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.576 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.75 -57.81 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.334 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.091 178.961 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.04 -26.29 1.02 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.131 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 6.0 mtt-85 -73.05 -25.04 60.78 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.35 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.586 ' OH ' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -76.59 -36.15 57.7 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.735 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -79.68 -43.75 22.13 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.903 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -61.73 -31.01 71.15 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 113.913 -1.494 . . . . 0.0 108.99 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.453 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.447 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.698 178.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.418 ' O ' ' N ' ' A' ' 18' ' ' ILE . 37.1 m80 . . . . . 0 CA--C 1.53 0.204 0 N-CA-C 111.49 0.182 . . . . 0.0 111.49 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.552 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 4.9 p -152.26 153.07 33.02 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 121.205 0.526 . . . . 0.0 111.262 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.484 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 173.03 139.07 2.75 Favored Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 110.707 -0.957 . . . . 0.0 110.707 -179.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.562 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.84 142.51 31.46 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -178.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.42 ' HB3' ' CE1' ' A' ' 91' ' ' PHE . . . -151.81 171.1 18.26 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.179 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.468 ' N ' ' CD1' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.77 127.05 55.58 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.266 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.554 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.478 ' CZ ' ' CD2' ' A' ' 38' ' ' HIS . 7.2 t80 -128.08 110.53 12.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.957 0.408 . . . . 0.0 111.093 178.182 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 3.7 mm-40 67.46 50.09 0.96 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.892 179.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 69.83 -4.42 1.46 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.187 179.254 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.424 HG13 ' CZ2' ' A' ' 29' ' ' TRP . 17.9 t -101.38 149.05 6.66 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 CA-C-O 121.122 0.487 . . . . 0.0 110.561 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.401 ' HA ' HD13 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -111.85 113.49 25.86 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.033 179.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.402 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -131.98 -133.05 3.4 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.952 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.562 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 18.7 mm -135.89 136.11 50.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 120.688 0.28 . . . . 0.0 111.255 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.501 ' CD1' ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.68 140.52 19.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 106.425 -1.695 . . . . 0.0 106.425 176.7 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.552 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.54 118.01 5.68 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 119.629 -0.829 . . . . 0.0 111.591 -178.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.508 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 20.9 mt -81.52 142.88 13.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 114.501 -1.227 . . . . 0.0 112.164 -178.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.503 ' O ' HG22 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -119.5 92.7 3.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.914 179.034 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.68 -0.2 41.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.319 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -82.49 0.37 42.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.647 -0.251 . . . . 0.0 111.096 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.503 HG22 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.31 -163.01 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.823 0.344 . . . . 0.0 110.775 179.92 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.6 p -175.1 101.48 0.26 Allowed Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.369 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.441 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 12.4 Cg_exo -69.48 166.34 73.54 Favored 'Cis proline' 0 C--N 1.346 0.445 0 C-N-CA 123.612 -1.411 . . . . 0.0 112.704 0.348 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.53 178.57 0.15 Allowed 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.342 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.511 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.73 134.52 4.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.209 179.042 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.588 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.3 OUTLIER -107.93 129.12 55.12 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.904 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.402 ' CG2' ' CG2' ' A' ' 37' ' ' VAL . 6.8 m -112.33 113.41 25.61 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -178.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.523 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 76.3 t90 -91.79 110.36 21.7 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.261 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.466 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.5 ttt180 -109.41 130.33 55.5 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.727 0.298 . . . . 0.0 111.204 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 31.1 m -49.9 159.83 0.37 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.508 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.402 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 48.3 m -75.98 -37.58 58.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.333 0.587 . . . . 0.0 109.845 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -85.56 -12.91 50.46 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.155 -0.929 . . . . 0.0 111.233 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 83.73 35.4 16.41 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.361 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -87.56 -24.87 23.89 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.709 0.29 . . . . 0.0 111.383 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.75 163.94 2.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.321 0.581 . . . . 0.0 111.427 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.494 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.6 OUTLIER -143.77 155.45 16.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.981 -178.903 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.478 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 27.3 m80 -130.69 119.56 22.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.795 179.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.56 128.54 43.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.739 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.588 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -114.94 141.55 31.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.46 -179.629 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.419 ' O ' HG12 ' A' ' 45' ' ' ILE . 21.5 t -104.07 95.92 4.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 177.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.42 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 0.6 OUTLIER -44.18 -21.94 0.05 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.835 -179.114 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.441 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER -76.92 -47.14 21.89 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.083 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 51.5 p -64.52 -28.08 69.41 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.516 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 49.9 mm -56.68 103.57 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.411 178.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.416 ' N ' ' O ' ' A' ' 63' ' ' ILE . 24.2 t70 -58.26 -20.26 40.74 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.807 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.44 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 0.0 OUTLIER -172.6 160.18 4.59 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.105 0.478 . . . . 0.0 111.453 -179.877 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.442 HD13 HD22 ' A' ' 62' ' ' LEU . 12.2 tp -109.03 120.33 42.23 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.334 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.412 ' O ' ' N ' ' A' ' 61' ' ' ARG . 0.4 OUTLIER -122.52 145.59 48.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.63 0.252 . . . . 0.0 111.295 -179.641 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.464 ' HB3' HD23 ' A' ' 60' ' ' LEU . . . -157.3 149.86 23.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.667 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 43.3 p . . . . . 0 CA--C 1.53 0.179 0 C-N-CA 121.045 -0.262 . . . . 0.0 110.87 -179.96 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.77 0.319 . . . . 0.0 110.585 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.401 ' HG2' ' HA ' ' A' ' 90' ' ' SER . 23.8 mtm -143.97 142.93 30.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.861 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.464 HD23 ' HB3' ' A' ' 50' ' ' ALA . 17.9 mt -118.17 146.25 44.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.044 178.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.412 ' N ' ' O ' ' A' ' 49' ' ' GLN . 18.6 ttp180 -143.12 145.59 32.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.972 0.415 . . . . 0.0 112.119 -178.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.516 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.5 mp -128.19 109.07 11.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.889 178.231 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.454 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 7.8 mm -76.64 156.41 5.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.994 -0.282 . . . . 0.0 110.891 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.356 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.417 179.939 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.513 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 9.3 p . . . . . 0 CA--C 1.528 0.119 0 CA-C-O 120.707 0.289 . . . . 0.0 110.994 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -136.99 38.36 2.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.197 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 44.67 30.16 0.49 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.312 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 64.6 m -102.1 -22.76 14.17 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.215 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 30.7 mmtm -56.4 -82.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.971 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.7 mttm 55.09 89.81 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.865 0.364 . . . . 0.0 111.129 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.57 134.42 52.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.863 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.7 mmtt -73.51 148.52 43.02 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.776 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -103.93 -31.74 9.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.037 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 168.57 -31.38 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.101 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -105.11 20.46 18.82 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.327 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 53.84 36.93 56.49 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.532 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -83.6 2.97 34.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.701 0.286 . . . . 0.0 111.646 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 79' ' ' GLU . 9.5 pt-20 42.39 74.38 0.11 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.223 -0.444 . . . . 0.0 112.008 179.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 40.5 t -76.87 155.41 5.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.32 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 52.3 t -110.9 78.96 1.73 Allowed Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.341 179.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_exo -41.24 156.02 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.907 2.405 . . . . 0.0 112.795 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.9 ptpp? -44.69 164.94 0.16 Allowed Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.217 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.513 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.8 Cg_exo . . . . . 0 N--CA 1.462 -0.335 0 C-N-CA 123.543 2.828 . . . . 0.0 112.771 -178.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.61 0.243 . . . . 0.0 110.6 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.525 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 10.8 m-70 -93.13 111.18 22.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.73 0.3 . . . . 0.0 110.303 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 16.6 ttt -94.18 118.26 31.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.283 -179.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.501 ' CD1' ' CD1' ' A' ' 16' ' ' ILE . 92.8 m-85 -116.98 116.63 27.76 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.654 179.656 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.401 ' HA ' ' HG2' ' A' ' 59' ' ' MET . 0.4 OUTLIER -94.57 114.58 26.58 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.972 0.415 . . . . 0.0 110.545 179.931 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.45 ' CE2' ' HA ' ' A' ' 97' ' ' MET . 5.8 m-85 -89.63 147.32 23.97 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.394 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -109.47 29.14 7.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.0 179.133 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -174.97 117.69 0.18 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.585 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.441 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -59.47 -14.93 14.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.778 179.614 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.02 -50.83 18.02 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.025 0.44 . . . . 0.0 110.267 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -64.43 -43.71 97.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.658 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.45 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -64.38 -36.94 85.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.931 179.381 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -62.88 -28.73 70.24 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.817 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.436 ' O ' ' OG1' ' A' ' 103' ' ' THR . 5.4 m120 -81.69 -65.41 1.02 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.276 179.265 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.441 HG13 ' CE2' ' A' ' 91' ' ' PHE . 22.6 mm -47.32 -57.64 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.212 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.03 -35.46 24.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.733 -179.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.52 ' HG3' ' N ' ' A' ' 103' ' ' THR . 9.0 ptp -83.04 -41.49 18.6 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.647 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.52 ' N ' ' HG3' ' A' ' 102' ' ' MET . 0.2 OUTLIER -56.85 -50.76 71.47 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 120.822 0.344 . . . . 0.0 110.564 179.505 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.414 ' CD2' HD11 ' A' ' 42' ' ' LEU . 5.5 mt -52.73 -52.5 55.99 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 179.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.421 ' HG2' ' CD2' ' A' ' 48' ' ' LEU . 58.6 mm-40 -55.46 -47.76 75.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.017 179.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -49.62 -34.8 19.06 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 121.134 0.492 . . . . 0.0 110.607 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.525 HG21 ' OH ' ' A' ' 111' ' ' TYR . 9.2 mt -85.69 -52.07 12.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.49 179.42 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.639 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -42.52 -57.06 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.622 179.484 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.401 ' HA ' ' HG2' ' A' ' 112' ' ' LYS . 10.1 t -47.98 -26.95 1.96 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.942 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.452 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 11.7 mtp-105 -72.36 -25.03 61.37 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.022 179.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.639 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -75.54 -34.95 60.79 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.599 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.782 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.73 -43.17 17.12 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.987 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -61.3 -32.36 72.21 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 113.815 -1.539 . . . . 0.0 108.99 178.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.452 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.449 -0.481 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.727 178.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.418 ' CD2' ' HG2' ' A' ' 20' ' ' GLU . 16.4 m80 . . . . . 0 CA--C 1.529 0.17 0 CA-C-O 120.542 0.21 . . . . 0.0 111.249 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.526 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 6.5 p -156.54 136.96 13.03 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 121.196 0.522 . . . . 0.0 111.145 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.443 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . -171.73 138.54 4.89 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 110.751 -0.939 . . . . 0.0 110.751 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.565 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -81.29 142.75 32.81 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.409 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.425 ' HB2' ' CD1' ' A' ' 91' ' ' PHE . . . -155.74 170.98 20.79 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.364 -179.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.447 ' O ' ' HA ' ' A' ' 89' ' ' PHE . 0.4 OUTLIER -100.85 126.17 54.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.239 -179.826 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.507 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 58.4 t80 -117.25 108.6 15.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.047 0.451 . . . . 0.0 111.569 178.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 67.1 mt-10 58.49 55.55 4.82 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.84 178.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.4 mtmm 71.99 -6.66 1.44 Allowed 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.422 HG12 ' CZ2' ' A' ' 29' ' ' TRP . 34.0 t -101.73 150.16 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.549 0 CA-C-O 121.235 0.54 . . . . 0.0 110.545 179.383 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 90.4 p -106.1 144.76 32.35 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.003 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -171.67 -141.86 3.51 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.034 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.565 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 13.8 mm -132.38 136.19 56.66 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.475 0 CA-C-O 120.938 0.399 . . . . 0.0 111.465 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.47 HD12 HG22 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -100.76 141.37 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 N-CA-C 106.332 -1.729 . . . . 0.0 106.332 176.759 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.526 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.61 118.59 5.85 Favored 'General case' 0 C--N 1.313 -1.002 0 C-N-CA 119.663 -0.815 . . . . 0.0 111.478 -178.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.511 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 20.1 mt -82.0 142.99 12.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.255 -178.668 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.503 ' O ' HG22 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -119.8 92.51 3.8 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.872 178.871 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.418 ' HG2' ' CD2' ' A' ' 3' ' ' HIS . 0.7 OUTLIER -82.85 0.92 41.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.376 -179.651 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -82.79 0.81 42.06 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.06 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.503 HG22 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.39 -162.07 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.852 0.358 . . . . 0.0 110.709 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.6 p -175.01 101.23 0.26 Allowed Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.541 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.434 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 9.8 Cg_exo -70.98 165.94 78.69 Favored 'Cis proline' 0 C--N 1.348 0.504 0 C-N-CA 123.617 -1.41 . . . . 0.0 112.634 0.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.66 177.92 0.19 Allowed 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.406 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.515 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 6.7 pt-20 -163.68 137.15 5.55 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.003 179.077 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.566 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.3 OUTLIER -107.86 127.67 53.93 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 178.99 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.1 m -109.67 111.15 22.44 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 -178.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.507 ' CE2' ' HB3' ' A' ' 9' ' ' PHE . 65.6 t90 -91.95 113.68 26.02 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 116.233 -0.439 . . . . 0.0 109.868 178.651 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -106.91 133.52 51.43 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.658 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 27.3 m -49.72 166.49 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.251 -0.277 . . . . 0.0 110.251 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.0 m -76.8 -43.23 37.51 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.479 0.657 . . . . 0.0 109.894 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -83.96 -13.78 52.51 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.185 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.22 34.22 10.93 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.276 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.79 -23.08 29.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.684 0.278 . . . . 0.0 111.574 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.9 163.59 2.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.32 0.581 . . . . 0.0 111.422 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.469 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.6 146.03 19.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.985 -178.747 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.448 ' ND1' ' CZ ' ' A' ' 9' ' ' PHE . 1.4 m-70 -122.04 123.53 41.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.828 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.51 126.32 41.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.814 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.566 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -112.47 140.16 33.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.265 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.4 ' O ' HG12 ' A' ' 45' ' ' ILE . 23.3 t -104.01 96.49 4.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 177.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.462 ' CB ' ' OH ' ' A' ' 111' ' ' TYR . 0.6 OUTLIER -43.05 -24.28 0.07 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.774 -179.019 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.434 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.8 OUTLIER -74.95 -47.95 26.89 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.281 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 48.7 p -64.64 -28.11 69.39 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.535 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 41.8 mm -57.59 99.83 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.526 178.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.453 ' N ' ' O ' ' A' ' 63' ' ' ILE . 16.5 t70 -47.48 -28.72 2.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.7 0.286 . . . . 0.0 111.31 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.413 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 1.4 pttt -172.72 156.97 3.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.894 0.378 . . . . 0.0 110.741 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.464 HD22 ' HB2' ' A' ' 104' ' ' LEU . 3.6 tp -109.1 122.47 47.36 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.714 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -118.75 151.99 37.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.793 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.476 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -157.16 150.47 23.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.78 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 25.9 p . . . . . 0 C--N 1.332 -0.156 0 CA-C-O 120.63 0.252 . . . . 0.0 110.84 179.986 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.404 ' HG2' ' CB ' ' A' ' 94' ' ' ARG . 1.6 mpp? . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.764 0.316 . . . . 0.0 110.833 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 14.2 mtm -149.69 143.6 25.57 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.648 -179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.476 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 24.0 mt -120.27 140.15 51.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.084 178.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -135.42 148.84 49.45 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 120.917 0.389 . . . . 0.0 111.842 -179.169 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.535 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.4 mp -127.87 113.14 15.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.876 178.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.454 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 8.8 mm -76.66 145.53 10.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.649 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.381 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.558 -179.991 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.439 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 11.5 p . . . . . 0 N--CA 1.457 -0.122 0 CA-C-O 120.878 0.37 . . . . 0.0 111.318 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -123.01 43.49 2.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.762 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.1 -20.87 57.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.17 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.32 -21.98 51.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.073 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.1 mmtm -67.11 -65.82 0.63 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.881 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.1 ptmt 43.15 80.78 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.453 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.16 164.41 17.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.942 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.3 mttp -116.68 154.93 29.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.921 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -86.96 170.72 11.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.933 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -59.88 -20.4 56.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.244 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -98.15 31.8 2.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.938 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 59.35 24.63 59.34 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.488 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 12.7 m-20 -78.88 -167.62 1.18 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.727 0.298 . . . . 0.0 110.779 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -147.0 126.82 13.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.867 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 59.6 t -95.07 -65.54 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.373 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.415 HG11 ' O ' ' A' ' 81' ' ' VAL . 4.5 p 34.11 78.26 0.33 Allowed Pre-proline 0 CA--C 1.53 0.188 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.855 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -44.02 124.14 4.58 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.891 2.394 . . . . 0.0 112.676 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt -84.59 159.57 58.08 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.965 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.439 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 4.1 Cg_exo . . . . . 0 N--CA 1.46 -0.487 0 C-N-CA 123.533 2.822 . . . . 0.0 112.402 -179.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 37.4 mtt180 . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.565 0.222 . . . . 0.0 110.541 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.478 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 20.7 m-70 -97.32 111.32 23.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.69 0.281 . . . . 0.0 110.349 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 7.5 ttt -94.08 112.97 24.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.997 0.427 . . . . 0.0 111.175 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.464 ' CG ' ' CD1' ' A' ' 16' ' ' ILE . 90.8 m-85 -116.04 116.63 28.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.628 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -99.2 114.5 27.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.973 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.425 ' CD1' ' HB2' ' A' ' 7' ' ' ALA . 5.4 m-85 -95.04 133.66 38.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.149 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 37.5 m-20 -93.64 43.67 1.12 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.685 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.486 ' CB ' HG23 ' A' ' 96' ' ' VAL . 4.5 m-20 176.8 109.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.409 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.442 ' O ' ' HG3' ' A' ' 97' ' ' MET . 0.0 OUTLIER -52.96 -21.06 3.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.959 -179.995 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.34 -44.97 70.55 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 120.831 0.348 . . . . 0.0 110.633 179.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.486 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -66.17 -49.84 73.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.882 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.442 ' HG3' ' O ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -62.73 -36.57 83.43 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.351 179.5 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.458 ' O ' ' HG2' ' A' ' 102' ' ' MET . 8.6 t70 -67.6 -35.1 78.33 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.047 0.451 . . . . 0.0 110.053 179.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 68.6 m-20 -82.23 -29.58 31.25 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.712 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.429 HG21 ' CD1' ' A' ' 60' ' ' LEU . 1.2 mm -83.19 -59.91 2.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.471 -179.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 6.6 ttmt -44.41 -28.69 0.58 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.328 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.458 ' HG2' ' O ' ' A' ' 98' ' ' ASP . 6.3 ptm -79.85 -40.29 28.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.424 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.511 ' HB ' ' CD1' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -57.79 -58.89 6.38 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.715 179.563 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.464 ' HB2' HD22 ' A' ' 48' ' ' LEU . 4.7 mt -47.16 -50.48 20.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.76 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.456 ' HG2' ' CD2' ' A' ' 48' ' ' LEU . 49.9 mm-40 -56.65 -50.59 71.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.316 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -50.88 -31.3 17.02 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 121.022 0.439 . . . . 0.0 110.921 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.601 HG23 ' OH ' ' A' ' 111' ' ' TYR . 8.4 mt -85.61 -52.94 11.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.652 179.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.681 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.51 -56.78 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.808 179.614 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 41.2 t -47.83 -26.57 1.7 Allowed 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.264 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 0.0 OUTLIER -74.75 -24.84 58.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.715 179.816 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.681 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.2 OUTLIER -74.08 -34.2 63.91 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 179.154 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.78 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.76 -43.22 17.01 Favored 'General case' 0 CA--C 1.505 -0.753 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 179.059 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -61.67 -32.2 72.37 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.901 -1.5 . . . . 0.0 108.992 178.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.453 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.435 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.556 178.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.403 ' NE2' ' HB2' ' A' ' 20' ' ' GLU . 26.1 m170 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.777 0.323 . . . . 0.0 111.055 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.536 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 50.7 p -160.99 155.18 22.9 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.081 0.467 . . . . 0.0 111.087 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . 172.67 136.36 2.14 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.284 -179.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.563 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -79.79 138.08 37.16 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.102 0.477 . . . . 0.0 112.086 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.416 ' HB3' ' CZ ' ' A' ' 91' ' ' PHE . . . -147.11 171.6 15.06 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.535 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.465 ' N ' ' CD1' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.15 129.95 51.35 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.254 -179.884 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.504 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 62.2 t80 -124.34 109.81 13.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.979 0.418 . . . . 0.0 111.418 178.644 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 61.59 45.35 8.23 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.643 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.7 mtpp 78.19 -4.48 2.2 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 179.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.415 HG13 ' CZ2' ' A' ' 29' ' ' TRP . 28.2 t -99.94 150.82 5.19 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.466 0 CA-C-O 121.119 0.485 . . . . 0.0 110.369 179.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 90.5 p -105.69 116.0 31.19 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.127 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -138.54 -158.55 7.77 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.13 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.563 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 18.7 mm -119.8 131.82 71.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.765 0.317 . . . . 0.0 111.325 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.459 ' CD1' ' CG ' ' A' ' 89' ' ' PHE . 0.4 OUTLIER -101.19 114.02 39.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.536 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -123.1 115.89 22.57 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.582 0.706 . . . . 0.0 110.831 -179.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 15.7 mt -85.25 142.9 12.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 114.749 -1.114 . . . . 0.0 111.891 -178.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.492 ' O ' HG21 ' A' ' 22' ' ' VAL . 1.7 m120 -117.77 97.44 5.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.279 179.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.403 ' HB2' ' NE2' ' A' ' 3' ' ' HIS . 0.0 OUTLIER -84.1 -1.81 55.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.299 -179.757 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -82.92 1.37 39.94 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.486 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.492 HG21 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -98.35 -162.41 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.846 0.355 . . . . 0.0 110.943 180.0 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.0 p -173.97 99.98 0.3 Allowed Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.345 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.466 ' CG ' ' HB2' ' A' ' 43' ' ' SER . 56.6 Cg_endo -71.09 164.29 83.34 Favored 'Cis proline' 0 C--N 1.346 0.427 0 C-N-CA 123.605 -1.415 . . . . 0.0 112.867 0.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.99 -175.84 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.978 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -163.53 147.11 10.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.629 0.728 . . . . 0.0 112.482 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.663 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 2.8 tt -108.2 149.01 29.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.646 -1.161 . . . . 0.0 108.466 178.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.42 102.6 3.73 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -178.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.504 ' CE2' ' HB3' ' A' ' 9' ' ' PHE . 78.4 t90 -92.13 114.04 26.48 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.735 178.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 12.6 ptp180 -114.83 135.13 54.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.639 0.256 . . . . 0.0 110.534 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.5 m -49.81 158.24 0.5 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.717 0.294 . . . . 0.0 110.499 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 32.4 m -72.49 -36.0 68.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.416 0.627 . . . . 0.0 109.707 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -86.13 -18.26 32.78 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.024 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.76 32.56 9.94 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.439 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -85.79 -21.58 28.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.592 0.234 . . . . 0.0 111.52 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.1 158.71 2.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.356 0.598 . . . . 0.0 111.422 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.475 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.68 140.39 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.945 -178.72 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.496 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 0.6 OUTLIER -115.86 125.51 52.75 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.587 179.539 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.07 146.19 25.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.054 -179.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.663 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.2 t -129.91 136.7 58.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.144 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.408 ' O ' HG12 ' A' ' 45' ' ' ILE . 47.8 t -104.04 95.86 4.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.427 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.47 ' CB ' ' OH ' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -41.93 -24.97 0.05 Allowed 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.642 -178.81 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.466 ' HB2' ' CG ' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -72.99 -51.27 18.91 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 178.621 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 30.8 p -64.93 -28.41 69.51 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 178.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.53 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 42.1 mm -56.39 103.31 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.22 178.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 63' ' ' ILE . 16.9 t70 -54.53 -31.93 57.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.154 -0.476 . . . . 0.0 112.048 -179.19 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.427 ' O ' ' CG2' ' A' ' 45' ' ' ILE . 53.2 mtmt -157.6 162.97 38.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.539 0.685 . . . . 0.0 112.285 -179.463 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.445 HD22 ' HG2' ' A' ' 105' ' ' GLN . 9.0 tp -111.52 121.68 45.82 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.118 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.561 ' O ' ' N ' ' A' ' 61' ' ' ARG . 12.0 mt-30 -125.01 136.44 53.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.62 0.247 . . . . 0.0 111.181 -179.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.487 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -157.07 141.23 16.37 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.041 179.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 37.4 p . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.241 -179.789 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.413 ' HB2' ' HG2' ' A' ' 97' ' ' MET . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.085 0 CA-C-O 121.177 0.513 . . . . 0.0 111.351 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.429 ' HG3' ' HA ' ' A' ' 90' ' ' SER . 7.8 ttp -149.95 138.03 20.34 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.845 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.487 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 26.7 mt -119.51 150.18 40.68 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.117 178.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.561 ' N ' ' O ' ' A' ' 49' ' ' GLN . 2.3 ttt180 -150.91 148.18 28.11 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -178.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.53 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.3 mp -128.6 118.78 23.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.896 178.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.468 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 25.0 mm -76.53 156.45 5.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.649 0.262 . . . . 0.0 111.033 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.297 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.524 -179.848 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.499 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 12.9 p . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.767 0.318 . . . . 0.0 111.081 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -115.66 40.24 2.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.009 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -64.6 -21.06 66.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.058 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 41.5 t -88.69 -22.81 23.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.106 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.6 mmmt -83.97 -41.01 17.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.865 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.1 mtmt 61.98 93.23 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.028 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.408 ' N ' ' O ' ' A' ' 80' ' ' VAL . 0.0 OUTLIER -61.83 -176.46 0.09 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.708 179.862 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -141.75 -170.54 3.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.795 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -125.21 -68.08 0.86 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.12 0.486 . . . . 0.0 111.043 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 179.24 -33.36 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.105 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -95.95 38.47 1.18 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.931 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 72.13 8.24 69.17 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.768 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -60.02 -173.74 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.809 0.338 . . . . 0.0 110.924 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -154.11 137.12 15.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.864 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.408 ' O ' ' N ' ' A' ' 72' ' ' ARG . 2.1 t -128.35 145.13 35.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.35 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 81.5 t -123.46 69.96 43.89 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.129 179.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_exo -43.1 124.7 3.87 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.789 2.326 . . . . 0.0 112.724 -179.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.3 mmtt -59.56 164.32 5.56 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.094 0.473 . . . . 0.0 110.978 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.499 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 4.6 Cg_exo . . . . . 0 N--CA 1.46 -0.454 0 C-N-CA 123.601 2.867 . . . . 0.0 112.284 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 30.2 mtt180 . . . . . 0 C--O 1.232 0.163 0 N-CA-C 110.286 -0.265 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.479 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 15.2 m-70 -97.82 111.52 23.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.637 0.256 . . . . 0.0 110.558 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.85 122.45 42.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.941 0.401 . . . . 0.0 110.899 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.459 ' CG ' ' CD1' ' A' ' 16' ' ' ILE . 79.5 m-85 -125.58 116.87 22.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.775 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.429 ' HA ' ' HG3' ' A' ' 59' ' ' MET . 0.8 OUTLIER -95.83 114.55 26.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.145 -179.788 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.476 ' CE2' HG13 ' A' ' 100' ' ' ILE . 23.6 m-85 -91.42 158.63 16.4 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.169 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 -115.61 29.94 7.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.552 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.452 ' CB ' HG23 ' A' ' 96' ' ' VAL . 4.2 m-20 -173.43 115.84 0.25 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.532 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.409 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 10.4 ttp85 -58.95 -15.92 15.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.017 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.45 -43.7 54.99 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 121.03 0.443 . . . . 0.0 110.174 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.452 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -67.75 -48.48 75.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.437 179.102 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.43 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.1 OUTLIER -62.05 -36.08 80.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.998 179.153 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.43 ' N ' ' HG3' ' A' ' 97' ' ' MET . 2.0 m-20 -62.57 -33.87 75.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.255 179.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 16.6 m-20 -81.87 -30.44 32.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.613 179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.476 HG13 ' CE2' ' A' ' 91' ' ' PHE . 3.7 mm -79.53 -60.28 2.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.982 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.419 ' HB2' HD21 ' A' ' 60' ' ' LEU . 12.0 ttmt -51.85 -28.19 15.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.537 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 12.4 mtm -81.88 -29.39 32.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.941 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -82.42 -41.44 19.88 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.123 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.422 ' HB3' HD13 ' A' ' 48' ' ' LEU . 32.6 mt -56.81 -52.5 64.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.017 0.437 . . . . 0.0 109.855 179.131 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.445 ' HG2' HD22 ' A' ' 48' ' ' LEU . 5.3 mm-40 -61.98 -48.05 82.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.012 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -47.24 -33.06 5.07 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.985 0.422 . . . . 0.0 111.014 -179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.638 HG22 ' OH ' ' A' ' 111' ' ' TYR . 3.5 mt -85.77 -52.14 12.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.68 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.685 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.14 -59.34 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.63 179.758 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -47.08 -24.89 0.73 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.228 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.447 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 49.8 mtp85 -74.69 -25.31 59.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.385 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.685 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -76.18 -34.19 59.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.184 0.516 . . . . 0.0 109.611 179.656 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.754 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.21 -43.61 19.0 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 178.98 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -62.29 -31.67 72.3 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 113.737 -1.574 . . . . 0.0 109.07 178.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.447 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.449 -0.487 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.676 178.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 29.8 m170 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.571 0.224 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.545 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 3.5 p -152.65 155.28 37.0 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.046 0.451 . . . . 0.0 111.051 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 174.29 139.97 3.13 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 111.101 -0.799 . . . . 0.0 111.101 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.559 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -84.04 143.99 29.38 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.206 0.527 . . . . 0.0 112.333 -178.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.42 ' CB ' ' HB3' ' A' ' 89' ' ' PHE . . . -153.48 171.26 18.96 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.19 -179.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.485 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.99 123.49 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.563 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.44 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.6 t80 -123.85 109.55 13.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.978 0.418 . . . . 0.0 111.082 178.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 30.6 mt-10 67.84 51.27 0.79 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.735 179.087 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.8 mmtp 69.07 -2.74 1.69 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.264 -0.425 . . . . 0.0 112.12 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.424 HG12 ' CZ2' ' A' ' 29' ' ' TRP . 20.1 t -102.81 148.79 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.47 0 CA-C-O 121.096 0.474 . . . . 0.0 110.625 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -111.22 112.47 24.27 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.941 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -131.42 -134.62 3.63 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.829 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.559 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 18.0 mm -135.85 135.62 50.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.721 0.296 . . . . 0.0 111.332 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.503 ' CD1' ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.57 141.23 17.77 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.66 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 176.476 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.545 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -150.93 117.44 5.73 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 119.574 -0.851 . . . . 0.0 111.489 -178.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.492 ' HA ' ' HA ' ' A' ' 27' ' ' LEU . 6.2 mt -87.12 142.28 13.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 114.565 -1.198 . . . . 0.0 111.703 -178.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.499 ' O ' HG21 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -120.13 92.99 3.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.467 179.758 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -80.69 -0.05 36.54 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.411 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -82.93 0.53 43.97 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.289 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.499 HG21 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -101.59 -162.5 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.844 0.354 . . . . 0.0 110.853 179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.5 t -174.06 101.33 0.3 Allowed Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.504 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.426 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 61.1 Cg_endo -73.15 160.3 95.95 Favored 'Cis proline' 0 C--N 1.347 0.486 0 C-N-CA 123.455 -1.477 . . . . 0.0 112.758 0.367 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.15 175.39 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.52 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.434 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.65 136.31 5.24 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.14 179.343 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.545 ' CD1' ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.99 149.15 28.74 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.787 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.5 m -135.15 112.97 10.92 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.546 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 79.4 t90 -92.04 110.64 22.02 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 178.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 15' ' ' ILE . 4.2 ttt180 -110.4 131.23 55.24 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.972 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.7 t -49.83 158.86 0.44 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.475 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 46.1 m -74.74 -37.18 62.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.459 0.647 . . . . 0.0 109.773 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -84.37 -15.96 44.53 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.124 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.59 34.55 11.55 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.322 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -85.37 -26.8 26.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.742 0.306 . . . . 0.0 111.309 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.31 164.24 3.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.319 0.58 . . . . 0.0 111.441 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.511 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.64 147.0 18.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.041 -178.769 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.411 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 38.9 m80 -121.01 119.86 33.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.587 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.43 142.85 28.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.803 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.526 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.1 t -131.54 140.22 48.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.49 -179.437 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.4 ' O ' HG12 ' A' ' 45' ' ' ILE . 49.9 t -103.79 96.43 4.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 177.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.415 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.8 OUTLIER -41.94 -24.77 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.931 -178.819 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.426 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -74.54 -49.09 23.3 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.535 -0.542 . . . . 0.0 109.535 179.218 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 46.6 p -64.64 -27.82 69.19 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.532 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 43.2 mm -56.66 106.92 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.623 178.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.424 ' N ' ' O ' ' A' ' 63' ' ' ILE . 19.5 t70 -52.56 -30.88 33.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.119 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 11.0 pttt -172.49 163.8 5.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.97 179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 21.2 tp -108.95 116.68 32.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.56 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -110.92 144.14 40.46 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.61 0.243 . . . . 0.0 110.439 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.5 ' HB3' HD22 ' A' ' 60' ' ' LEU . . . -157.09 148.9 22.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.619 0.247 . . . . 0.0 111.277 -179.588 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 19.6 p . . . . . 0 C--N 1.331 -0.216 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.888 -179.928 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.805 0.336 . . . . 0.0 110.875 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -144.58 138.49 27.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.286 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.5 HD22 ' HB3' ' A' ' 50' ' ' ALA . 15.2 mt -118.71 140.37 50.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.313 178.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 25.5 ttp180 -141.33 150.42 42.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.076 0.465 . . . . 0.0 112.017 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.532 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.5 mp -128.41 114.13 16.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.836 178.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.481 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 6.7 mm -76.77 156.52 5.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.659 0.266 . . . . 0.0 111.043 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.509 -179.886 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 13.3 p . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.862 0.363 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -100.39 43.94 1.04 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.798 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.95 -12.07 61.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.308 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -55.0 -24.36 23.88 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.937 0.399 . . . . 0.0 111.115 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.6 mmmt -74.98 -69.36 0.47 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.687 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 42.97 82.31 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.241 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.33 168.01 16.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.277 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 18.0 mmtp -80.45 -166.91 1.17 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.699 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -109.42 -48.65 3.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.057 0.456 . . . . 0.0 110.931 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 168.87 -31.46 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.089 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -100.13 -16.57 17.78 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.324 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 135.54 -7.05 4.25 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.95 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -57.61 -166.11 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.734 0.302 . . . . 0.0 110.904 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -146.39 131.11 17.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.743 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.4 t -95.08 -66.51 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.5 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.423 HG11 ' O ' ' A' ' 81' ' ' VAL . 4.4 p 34.53 81.24 0.24 Allowed Pre-proline 0 CA--C 1.53 0.199 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.684 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_exo -42.11 128.25 4.16 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.954 2.436 . . . . 0.0 112.823 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.0 159.07 85.68 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.949 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo . . . . . 0 N--CA 1.461 -0.44 0 C-N-CA 123.492 2.795 . . . . 0.0 112.488 -179.125 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.459 ' HB3' ' HA ' ' A' ' 63' ' ' ILE . 23.2 ptt-85 . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.579 0.228 . . . . 0.0 110.798 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.524 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 5.1 m-70 -99.74 111.01 23.37 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 15.4 ttt -94.19 136.31 34.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.071 0.462 . . . . 0.0 111.818 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.503 ' CD2' ' CD1' ' A' ' 16' ' ' ILE . 19.3 m-85 -133.51 116.69 16.27 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.365 179.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.401 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.8 OUTLIER -87.1 115.94 24.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.968 0.413 . . . . 0.0 110.793 -179.959 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.453 ' CE2' ' HA ' ' A' ' 97' ' ' MET . 8.6 m-85 -91.1 137.54 32.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.592 -179.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -101.62 29.4 4.9 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.532 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.423 ' CB ' HG21 ' A' ' 96' ' ' VAL . 4.9 m-20 -175.97 119.95 0.16 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.432 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.431 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 10.7 ttp85 -60.98 -15.06 27.26 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.718 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -75.67 -47.57 25.71 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.954 0.407 . . . . 0.0 110.387 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.423 HG21 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -66.91 -42.86 89.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.722 179.286 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.453 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -65.76 -36.95 85.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.953 179.415 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.42 ' N ' ' HG3' ' A' ' 97' ' ' MET . 6.4 m-20 -65.25 -27.24 68.51 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.269 179.047 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.425 ' O ' ' HG2' ' A' ' 102' ' ' MET . 66.9 m-20 -81.74 -52.49 7.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.599 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.444 HG13 ' CE2' ' A' ' 91' ' ' PHE . 12.6 mm -63.16 -59.3 4.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.094 0.473 . . . . 0.0 110.488 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.434 ' HB2' HD22 ' A' ' 60' ' ' LEU . 6.4 ttmt -47.33 -36.31 9.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.415 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.425 ' HG2' ' O ' ' A' ' 99' ' ' ASN . 7.7 ptp -83.47 -37.78 22.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.726 -179.23 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.485 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 0.9 OUTLIER -70.9 -27.68 63.97 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.181 -178.954 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.432 ' O ' ' CG1' ' A' ' 108' ' ' ILE . 5.4 mt -71.22 -43.34 67.53 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -50.39 70.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.243 -0.889 . . . . 0.0 112.449 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.485 ' HG3' ' O ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -49.29 -30.29 7.17 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.072 0.463 . . . . 0.0 110.656 -179.295 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.55 HG23 ' OH ' ' A' ' 111' ' ' TYR . 9.0 mt -85.03 -52.72 12.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.412 179.314 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.64 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.39 -56.75 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.298 179.396 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -46.88 -28.15 1.49 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.295 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.521 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.0 OUTLIER -73.46 -25.01 60.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.177 179.73 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.64 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.2 OUTLIER -74.04 -35.22 64.32 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 179.576 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.763 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.28 -42.89 18.23 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 179.019 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -61.54 -32.03 72.08 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.014 -1.448 . . . . 0.0 108.957 178.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.444 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.449 -0.483 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.752 178.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.449 ' CD2' HG22 ' A' ' 18' ' ' ILE . 1.6 t-160 . . . . . 0 CA--C 1.528 0.099 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.427 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 0.5 OUTLIER -137.99 161.7 36.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.023 0.44 . . . . 0.0 110.875 179.881 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.49 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 171.54 138.76 2.61 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 111.168 -0.773 . . . . 0.0 111.168 -179.612 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.561 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -84.13 140.95 31.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.075 0.464 . . . . 0.0 112.228 -178.732 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -149.65 171.25 16.97 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.254 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.476 ' N ' ' CD1' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.93 125.12 56.12 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.707 -179.667 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.447 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.5 t80 -125.28 109.49 12.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.912 0.387 . . . . 0.0 111.12 178.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.416 ' HG3' ' CE1' ' A' ' 9' ' ' PHE . 47.1 mt-10 67.51 49.15 1.03 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.9 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 mmmt 71.76 -4.88 1.8 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.225 -0.443 . . . . 0.0 112.17 179.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.431 HG11 ' CZ2' ' A' ' 29' ' ' TRP . 17.1 t -100.91 148.72 6.75 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.458 0 CA-C-O 121.087 0.47 . . . . 0.0 110.526 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.402 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -111.6 113.09 25.27 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.898 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -131.4 -133.29 3.47 Favored Glycine 0 N--CA 1.445 -0.713 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.03 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.561 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 19.4 mm -136.31 135.9 49.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 120.648 0.261 . . . . 0.0 111.297 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.491 ' CD1' ' CD2' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.81 140.8 18.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 106.452 -1.684 . . . . 0.0 106.452 176.637 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.427 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.32 117.17 5.49 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 121.687 0.756 . . . . 0.0 111.244 -178.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.509 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 7.5 mt -81.73 143.22 12.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 114.481 -1.236 . . . . 0.0 112.578 -178.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -126.17 111.71 14.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.245 179.23 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.425 ' HG2' ' NE2' ' A' ' 3' ' ' HIS . 0.0 OUTLIER -100.41 -2.58 33.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.261 -179.541 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.87 -4.87 40.48 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.985 0.421 . . . . 0.0 110.241 178.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -92.29 -159.7 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.176 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.427 179.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.4 p -179.27 99.29 0.2 Allowed Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.545 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.451 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 10.6 Cg_exo -71.04 164.97 81.54 Favored 'Cis proline' 0 C--N 1.347 0.471 0 C-N-CA 123.697 -1.376 . . . . 0.0 112.625 0.322 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.14 176.15 0.08 Allowed 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.562 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.505 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.84 139.6 6.41 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.017 178.97 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.573 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.4 OUTLIER -107.71 146.37 32.19 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 178.722 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -128.49 112.93 14.87 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -178.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.526 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 78.5 t90 -92.13 110.63 22.01 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.467 ' O ' ' N ' ' A' ' 15' ' ' ILE . 18.9 ttm180 -110.6 131.55 54.95 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.67 0.271 . . . . 0.0 110.934 -179.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.3 m -49.97 159.33 0.42 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.489 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 42.5 m -74.91 -37.1 62.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.358 0.599 . . . . 0.0 109.737 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -84.91 -15.96 42.76 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.184 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.94 34.28 11.23 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.311 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -85.26 -26.22 26.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.722 0.296 . . . . 0.0 111.386 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.43 164.79 3.18 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.24 0.543 . . . . 0.0 111.546 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.503 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.35 146.89 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.051 -178.822 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.419 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 35.3 m80 -121.04 120.33 35.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.614 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.42 138.8 33.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.691 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.573 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -125.32 140.43 48.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.458 -179.623 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.433 ' O ' HG12 ' A' ' 45' ' ' ILE . 44.1 t -104.08 94.42 3.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 177.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.442 ' CB ' ' OH ' ' A' ' 111' ' ' TYR . 0.6 OUTLIER -42.1 -24.8 0.05 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.088 -0.506 . . . . 0.0 112.031 -178.864 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.451 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 1.2 t -76.02 -48.62 20.28 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.402 ' CG2' ' HB ' ' A' ' 41' ' ' VAL . 30.0 p -64.58 -27.88 69.25 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 178.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.531 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 44.8 mm -56.54 109.12 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.536 178.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 63' ' ' ILE . 24.3 t0 -53.22 -31.84 45.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.829 0.347 . . . . 0.0 110.933 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 11.2 pttt -172.66 164.65 5.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.836 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.434 HD23 ' HB2' ' A' ' 104' ' ' LEU . 8.2 tp -108.88 116.36 31.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.611 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -110.04 144.86 38.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.638 0.256 . . . . 0.0 110.542 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.474 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -156.98 145.74 19.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.634 0.254 . . . . 0.0 111.082 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 54.5 p . . . . . 0 C--N 1.332 -0.193 0 CA-C-O 120.724 0.297 . . . . 0.0 110.978 -179.903 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.2 mpp? . . . . . 0 C--O 1.23 0.057 0 CA-C-O 120.819 0.342 . . . . 0.0 110.771 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 29.8 mtm -149.5 142.31 24.67 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.637 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.474 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 18.7 mt -119.47 143.37 47.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.065 178.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' A' ' 87' ' ' HIS . 24.3 ttp180 -143.59 150.58 39.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.968 0.413 . . . . 0.0 111.699 -179.049 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.531 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.7 mp -128.02 115.18 18.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.776 178.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.468 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 6.4 mm -76.53 156.44 5.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.661 0.267 . . . . 0.0 110.89 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.356 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.484 -179.799 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.461 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 14.6 p . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.962 0.411 . . . . 0.0 111.313 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -108.01 55.62 0.64 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.877 -0.602 . . . . 0.0 109.857 179.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.95 41.45 1.0 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.371 -179.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 32.8 t -110.52 -19.68 12.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.082 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.9 mmtp -81.54 -55.43 4.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.857 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 61.34 93.07 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.899 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -95.37 -173.71 2.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.918 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.0 -176.63 3.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.712 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -106.09 -39.58 5.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.988 0.423 . . . . 0.0 110.81 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 165.14 -30.14 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.821 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -108.56 40.11 1.85 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.032 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 69.35 11.4 64.53 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.47 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -56.6 -165.69 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.108 0 CA-C-O 120.692 0.282 . . . . 0.0 110.84 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -135.54 120.88 19.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.858 0.361 . . . . 0.0 111.016 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 63.0 t -91.99 -63.52 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.494 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.503 ' O ' ' CG1' ' A' ' 81' ' ' VAL . 0.9 OUTLIER 40.7 94.21 0.05 OUTLIER Pre-proline 0 CA--C 1.535 0.38 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.093 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -50.66 134.11 39.8 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.515 2.144 . . . . 0.0 112.478 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.73 161.53 73.93 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.915 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.461 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 6.2 Cg_exo . . . . . 0 N--CA 1.461 -0.426 0 C-N-CA 123.563 2.842 . . . . 0.0 112.278 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.701 0.286 . . . . 0.0 110.761 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.506 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 4.3 m-70 -100.73 111.34 23.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.834 0.349 . . . . 0.0 110.262 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.3 142.14 27.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.149 0.5 . . . . 0.0 111.406 -179.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.491 ' CD2' ' CD1' ' A' ' 16' ' ' ILE . 61.0 m-85 -139.86 116.83 11.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.574 179.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -91.22 115.16 27.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.926 0.393 . . . . 0.0 110.596 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.444 ' CE2' ' HA ' ' A' ' 97' ' ' MET . 8.7 m-85 -91.05 136.85 32.8 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.533 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 20.2 m-20 -100.24 29.52 4.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.424 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.421 ' CB ' HG22 ' A' ' 96' ' ' VAL . 5.2 m-20 -175.58 116.74 0.15 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.541 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.438 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -57.2 -16.48 8.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.957 179.803 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.43 -49.75 21.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.852 0.358 . . . . 0.0 110.265 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.421 HG22 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -65.82 -41.52 90.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.637 179.26 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.444 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 0.0 OUTLIER -66.67 -37.94 85.8 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.955 179.472 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.436 ' N ' ' HG3' ' A' ' 97' ' ' MET . 20.1 m-20 -66.67 -24.64 66.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.112 0.482 . . . . 0.0 109.921 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -81.71 -63.24 1.43 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.358 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.48 HD13 HG22 ' A' ' 100' ' ' ILE . 14.3 mm -53.48 -53.85 22.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.579 179.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.41 ' HB2' HD23 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -51.4 -29.55 16.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.924 179.908 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 5.1 mtm -83.08 -48.11 10.94 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.132 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.509 ' HB ' ' CD1' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -53.38 -58.11 8.27 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.109 179.554 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.434 ' HB2' HD23 ' A' ' 48' ' ' LEU . 3.9 mt -46.34 -53.34 11.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.192 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.33 -45.58 87.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.167 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -51.34 -32.95 27.4 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.048 0.452 . . . . 0.0 110.287 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.6 HG21 ' OH ' ' A' ' 111' ' ' TYR . 10.3 mt -85.82 -52.11 12.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.51 179.217 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.663 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.14 -57.22 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.56 179.623 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.25 -27.05 1.37 Allowed 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.597 -0.728 . . . . 0.0 111.067 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.439 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 27.1 mtt180 -73.25 -25.08 60.57 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.359 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.663 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -75.68 -34.15 60.42 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.734 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.774 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.66 -43.35 17.02 Favored 'General case' 0 CA--C 1.507 -0.7 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.945 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -61.44 -32.07 72.03 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 113.858 -1.519 . . . . 0.0 108.987 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.439 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.454 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.666 178.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 29.6 m170 . . . . . 0 CA--C 1.529 0.148 0 N-CA-C 111.456 0.169 . . . . 0.0 111.456 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.54 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 2.6 p -154.0 150.41 28.24 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.303 0.573 . . . . 0.0 111.335 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.469 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 178.64 138.68 3.25 Favored Glycine 0 N--CA 1.448 -0.511 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 -179.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.561 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.58 145.74 29.55 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.484 ' HB3' ' CZ ' ' A' ' 91' ' ' PHE . . . -154.41 171.38 19.43 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.337 -179.11 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.483 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.63 122.58 55.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.82 -179.466 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.432 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 6.6 t80 -123.1 109.35 13.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.949 0.404 . . . . 0.0 111.237 178.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.42 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 24.8 mt-10 68.11 49.07 0.89 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.812 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 13.1 mttm 71.5 -3.82 2.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.237 -0.438 . . . . 0.0 112.137 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.434 HG13 ' CZ2' ' A' ' 29' ' ' TRP . 18.2 t -101.68 148.5 7.37 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.55 0 CA-C-O 121.123 0.487 . . . . 0.0 110.587 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.7 112.89 25.08 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.806 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -131.5 -135.12 3.69 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.006 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.561 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 18.2 mm -135.87 134.93 51.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.543 0 CA-C-O 120.608 0.242 . . . . 0.0 111.435 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.471 ' CD1' ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.43 141.71 16.85 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.649 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 176.388 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.54 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -150.87 118.62 6.15 Favored 'General case' 0 C--N 1.31 -1.117 0 C-N-CA 119.64 -0.824 . . . . 0.0 111.542 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.501 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 11.0 mt -86.71 142.02 13.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 114.697 -1.138 . . . . 0.0 111.887 -178.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.498 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.8 t30 -118.97 93.1 3.98 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.316 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -80.79 0.02 36.64 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.33 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -82.66 0.6 42.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.624 0.249 . . . . 0.0 111.304 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.498 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.04 -162.76 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.807 0.337 . . . . 0.0 110.832 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.4 t -175.97 101.75 0.25 Allowed Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.339 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.446 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 11.0 Cg_exo -69.95 161.46 86.7 Favored 'Cis proline' 0 C--N 1.347 0.483 0 C-N-CA 123.597 -1.418 . . . . 0.0 112.619 0.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.417 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -54.76 178.49 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.3 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.5 pp20? -163.67 133.92 4.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.331 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.573 ' CD1' ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.92 144.5 35.09 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 178.706 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.3 m -131.48 113.64 13.93 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.702 0.631 . . . . 0.0 112.702 -178.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.545 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 78.8 t90 -92.06 110.43 21.8 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 178.263 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.402 ' O ' ' N ' ' A' ' 15' ' ' ILE . 22.4 ttt-85 -110.2 131.11 55.35 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.674 0.274 . . . . 0.0 110.822 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.1 m -49.91 158.22 0.53 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.626 0.25 . . . . 0.0 110.493 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 44.7 m -74.1 -37.0 64.29 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.421 0.629 . . . . 0.0 109.751 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.48 -16.25 43.14 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.021 -0.991 . . . . 0.0 111.087 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.66 34.42 11.59 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.302 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -85.88 -25.76 26.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.688 0.28 . . . . 0.0 111.425 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.68 164.18 2.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.314 0.578 . . . . 0.0 111.35 -179.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.514 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.65 147.91 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.048 -178.767 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 50.0 m-70 -122.09 119.19 30.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.734 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.49 141.2 30.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.831 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.551 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -127.5 141.01 47.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.449 -179.511 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.434 ' O ' HG12 ' A' ' 45' ' ' ILE . 21.1 t -103.89 93.54 2.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 178.138 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.432 HD22 ' N ' ' A' ' 42' ' ' LEU . 0.6 OUTLIER -41.23 -25.12 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.09 -0.504 . . . . 0.0 112.11 -178.827 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.446 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER -74.66 -49.79 20.11 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 179.175 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 30.0 p -64.66 -27.51 68.98 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.53 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 34.5 mm -56.6 109.24 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.661 179.044 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.414 ' N ' ' O ' ' A' ' 63' ' ' ILE . 12.6 t70 -51.76 -34.01 37.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.137 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.43 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 0.7 OUTLIER -169.64 165.41 10.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.089 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.411 ' CD1' ' CD1' ' A' ' 104' ' ' LEU . 45.1 tp -108.77 118.3 36.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.499 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -115.76 147.22 41.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.602 0.239 . . . . 0.0 110.512 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.464 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -157.14 137.2 12.62 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.148 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 42.8 p . . . . . 0 CA--C 1.53 0.207 0 CA-C-O 120.58 0.229 . . . . 0.0 110.865 -179.833 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.645 0.26 . . . . 0.0 110.632 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 35.2 mtm -149.65 155.51 40.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.132 0.491 . . . . 0.0 111.983 -179.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.464 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 28.6 mt -123.38 149.76 44.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.165 178.419 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 28.4 ttp180 -146.18 150.87 36.67 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.916 0.389 . . . . 0.0 112.029 -179.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.53 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.3 mp -128.34 116.87 20.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.175 178.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.43 ' CG1' ' CG ' ' A' ' 47' ' ' LYS . 22.6 mm -76.64 156.47 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.683 0.277 . . . . 0.0 111.011 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.354 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.352 179.947 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.51 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 10.2 p . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.595 0.236 . . . . 0.0 110.613 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -128.02 35.75 4.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.757 0.313 . . . . 0.0 111.411 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 40.31 31.87 0.11 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.522 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.8 m -95.32 -26.61 15.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.877 0.37 . . . . 0.0 110.986 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.09 -77.74 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.751 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.6 mtpm? 56.15 89.95 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.002 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.99 123.15 48.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.823 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -75.38 159.93 30.85 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.851 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -97.32 -64.04 1.08 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.085 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -178.05 -34.71 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.172 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -92.0 40.8 1.05 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.115 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 59.43 18.01 42.02 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.777 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -90.97 118.21 30.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.746 0.307 . . . . 0.0 110.836 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -87.57 115.8 25.25 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.822 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 17.4 t -111.79 139.25 37.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.638 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.405 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 35.9 t -96.34 90.12 0.68 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.462 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 81' ' ' VAL . 1.4 Cg_endo -45.44 151.0 1.12 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.861 2.374 . . . . 0.0 112.759 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 18.1 mttt -46.47 166.34 0.17 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.543 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.51 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 7.8 Cg_exo . . . . . 0 N--CA 1.464 -0.22 0 C-N-CA 123.72 2.947 . . . . 0.0 112.294 -179.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.676 0.274 . . . . 0.0 110.776 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.47 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 5.6 m-70 -102.84 111.26 23.5 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 179.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 2.8 ttt -109.34 131.5 55.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.269 -179.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.53 ' CD1' ' N ' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -131.05 117.18 18.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.376 179.684 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.13 114.32 21.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.231 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.484 ' CZ ' ' HB3' ' A' ' 7' ' ' ALA . 7.8 m-85 -91.17 136.36 33.14 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.945 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 59.3 m-20 -93.52 43.46 1.12 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.789 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.478 ' CB ' HG22 ' A' ' 96' ' ' VAL . 1.8 m-20 175.2 113.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.229 -179.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.403 ' O ' ' HB2' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -56.16 -17.41 7.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.079 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.95 -45.66 56.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.1 0.476 . . . . 0.0 110.171 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.478 HG22 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -65.32 -49.57 77.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.396 179.087 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.401 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.1 OUTLIER -62.62 -37.09 84.92 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.727 179.731 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.405 ' HA ' ' HG2' ' A' ' 101' ' ' LYS . 69.1 m-20 -73.35 -31.08 63.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.029 0.442 . . . . 0.0 110.445 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -80.25 -27.92 38.57 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.291 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.419 HD11 ' N ' ' A' ' 5' ' ' GLY . 1.6 mm -85.13 -52.82 11.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.699 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.405 ' HG2' ' HA ' ' A' ' 98' ' ' ASP . 8.6 ptpt -48.59 -28.97 3.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.796 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -78.11 -39.81 40.19 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.081 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.501 ' HB ' ' CD1' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -59.05 -61.03 2.94 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.501 179.551 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.418 ' O ' ' CG1' ' A' ' 108' ' ' ILE . 7.3 mt -46.76 -56.09 6.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.715 179.397 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.67 -45.51 77.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.054 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -51.92 -35.36 45.42 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-O 121.168 0.508 . . . . 0.0 110.57 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.602 HG21 ' OH ' ' A' ' 111' ' ' TYR . 11.3 mt -85.75 -51.08 13.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.669 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.646 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -42.25 -57.03 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.585 179.654 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.15 -28.47 1.83 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.261 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.499 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 3.1 mtt180 -72.44 -24.89 61.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.28 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.646 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.2 OUTLIER -74.57 -36.11 63.05 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 179.77 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.766 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.46 -43.45 17.24 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 107.875 -1.158 . . . . 0.0 107.875 179.039 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -60.96 -30.35 70.19 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 113.93 -1.486 . . . . 0.0 108.922 178.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.456 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.438 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.594 178.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.414 ' CE1' ' HB2' ' A' ' 20' ' ' GLU . 30.5 m170 . . . . . 0 CA--C 1.528 0.123 0 N-CA-C 111.5 0.185 . . . . 0.0 111.5 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.543 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 2.7 p -151.85 154.69 36.66 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.222 0.534 . . . . 0.0 111.242 179.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.483 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 172.37 137.98 2.47 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 -179.522 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.574 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.94 144.34 30.08 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -178.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.423 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -155.38 171.38 19.97 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.062 -179.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.485 HG12 ' HB3' ' A' ' 90' ' ' SER . 4.8 mm -102.16 128.82 54.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.432 ' O ' ' HB2' ' A' ' 10' ' ' GLU . 6.8 t80 -127.29 109.38 11.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.0 0.429 . . . . 0.0 110.889 177.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 22.4 mt-10 69.0 50.38 0.59 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.747 179.242 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.6 mttt 69.77 -4.76 1.36 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.134 -0.484 . . . . 0.0 112.084 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.421 HG13 ' CZ2' ' A' ' 29' ' ' TRP . 13.8 t -101.55 144.24 13.39 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.476 0 CA-C-O 121.201 0.524 . . . . 0.0 110.745 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.434 ' CB ' HD12 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -99.25 113.83 26.31 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.898 179.957 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -136.04 -168.1 11.42 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.84 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.574 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 14.0 mm -107.59 136.21 43.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.76 0.314 . . . . 0.0 111.285 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.527 ' CD1' ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.73 141.37 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 176.808 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.543 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.52 117.25 5.44 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 119.634 -0.827 . . . . 0.0 111.469 -178.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.532 ' HA ' ' HA ' ' A' ' 27' ' ' LEU . 5.3 mt -85.63 142.75 12.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.629 -178.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.504 ' O ' HG22 ' A' ' 22' ' ' VAL . 2.6 t30 -119.45 96.37 5.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.609 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.414 ' HB2' ' CE1' ' A' ' 3' ' ' HIS . 1.5 mt-10 -79.86 -0.86 36.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.261 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -81.86 -0.06 41.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.612 0.244 . . . . 0.0 111.387 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.504 HG22 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -100.97 -162.45 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.82 0.343 . . . . 0.0 110.74 179.883 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 53.8 p -176.51 100.23 0.24 Allowed Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.37 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.435 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 13.4 Cg_exo -68.91 165.82 73.18 Favored 'Cis proline' 0 C--N 1.346 0.409 0 C-N-CA 123.626 -1.406 . . . . 0.0 112.723 0.36 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.425 ' HB1' HG23 ' A' ' 107' ' ' ILE . . . -56.79 178.03 0.07 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.153 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.409 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 9.1 mt-10 -163.4 133.49 4.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.429 179.458 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.554 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.3 OUTLIER -108.11 140.78 40.8 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.58 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.2 m -126.08 112.86 16.34 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -178.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.501 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 73.8 t90 -91.98 110.4 21.76 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.522 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.3 ttt180 -107.35 131.03 54.69 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.668 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 27.1 t -49.88 156.21 0.77 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.718 0.294 . . . . 0.0 110.654 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 21.4 m -73.77 -34.35 64.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.223 0.535 . . . . 0.0 109.832 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -87.36 -16.58 34.58 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.187 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.35 33.72 11.39 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.306 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -87.61 -25.83 23.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.694 0.283 . . . . 0.0 111.451 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.53 165.1 3.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.308 0.575 . . . . 0.0 111.537 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.484 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.5 OUTLIER -142.42 155.43 18.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.934 -178.853 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -130.03 119.33 22.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.709 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.48 138.9 33.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.599 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.554 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -126.16 141.12 46.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.5 -179.5 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.411 ' O ' HG12 ' A' ' 45' ' ' ILE . 41.7 t -103.87 94.39 3.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.057 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.412 HD13 ' CD2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -41.94 -25.49 0.06 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.836 -179.085 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.435 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -74.88 -49.2 21.24 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 179.236 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.406 ' CG2' ' HB ' ' A' ' 41' ' ' VAL . 30.3 p -64.7 -27.54 68.98 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.451 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.537 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 39.9 mm -56.32 104.44 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.357 178.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' A' ' 63' ' ' ILE . 31.5 t70 -47.98 -31.73 5.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.841 0.353 . . . . 0.0 111.297 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -172.54 162.13 5.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.792 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.403 ' CD1' HD13 ' A' ' 104' ' ' LEU . 10.6 tp -108.91 122.42 47.18 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.757 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.406 ' HB2' ' HB3' ' A' ' 61' ' ' ARG . 11.6 mt-30 -119.65 146.31 45.68 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.567 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.488 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -157.08 138.86 14.21 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.673 -0.239 . . . . 0.0 111.101 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 37.1 p . . . . . 0 C--N 1.332 -0.167 0 CA-C-O 120.643 0.259 . . . . 0.0 110.894 -179.903 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.674 0.273 . . . . 0.0 110.75 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 25.1 mtm -149.79 138.38 20.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.073 0.463 . . . . 0.0 112.012 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.488 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 22.3 mt -118.06 145.01 45.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.712 178.272 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.418 ' HG3' ' HA ' ' A' ' 88' ' ' MET . 10.5 ttm-85 -143.43 147.38 34.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.005 0.431 . . . . 0.0 112.131 -179.004 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.537 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.6 mp -128.3 115.05 17.7 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.662 178.436 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.473 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 6.8 mm -76.76 156.19 5.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 C-N-CA 121.02 -0.272 . . . . 0.0 111.016 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.242 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.551 -179.782 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.403 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 15.0 p . . . . . 0 N--CA 1.456 -0.148 0 CA-C-O 121.047 0.451 . . . . 0.0 111.431 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -109.19 57.22 0.61 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.82 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -88.25 33.67 0.74 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.555 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 67.8 p -81.88 -19.1 41.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.793 0.33 . . . . 0.0 111.067 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.3 mmtp -79.82 -78.33 0.16 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.855 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.2 mttt 58.89 91.84 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.765 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.21 -178.32 7.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.197 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.6 mmtt -82.43 -178.93 7.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.762 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -113.38 -37.34 4.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.032 0.444 . . . . 0.0 111.039 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 168.88 -32.3 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.019 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -105.68 38.56 1.96 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.926 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.26 16.31 57.84 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.651 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 36.2 m-20 -72.9 -166.19 0.28 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.705 0.288 . . . . 0.0 110.742 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -139.19 108.03 5.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.876 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.401 ' O ' ' C ' ' A' ' 81' ' ' VAL . 59.2 t -77.88 -66.05 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.283 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.428 HG11 ' O ' ' A' ' 81' ' ' VAL . 4.7 p 33.22 83.58 0.2 Allowed Pre-proline 0 CA--C 1.531 0.24 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.674 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -41.32 124.79 2.4 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.947 2.431 . . . . 0.0 112.869 -179.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 10.3 mtmt -78.05 162.33 67.58 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.051 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.403 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.1 Cg_exo . . . . . 0 N--CA 1.46 -0.476 0 C-N-CA 123.629 2.886 . . . . 0.0 112.388 -179.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.442 ' HB3' ' HA ' ' A' ' 63' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.527 0.085 0 CA-C-O 120.673 0.273 . . . . 0.0 110.747 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.507 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 10.5 m-70 -96.72 111.66 23.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.335 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.418 ' HA ' ' HG3' ' A' ' 61' ' ' ARG . 6.6 ttt -94.13 124.63 38.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.095 0.474 . . . . 0.0 111.282 -179.54 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.527 ' CD1' ' CD1' ' A' ' 16' ' ' ILE . 89.8 m-85 -122.93 116.85 24.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.551 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.485 ' HB3' HG12 ' A' ' 8' ' ' ILE . 0.3 OUTLIER -92.2 114.66 27.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.837 0.351 . . . . 0.0 110.849 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.468 ' CE2' HG13 ' A' ' 100' ' ' ILE . 31.1 m-85 -97.34 143.54 27.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.111 0.481 . . . . 0.0 111.399 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 20.1 m-20 -106.57 38.29 2.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.777 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.429 ' CB ' HG22 ' A' ' 96' ' ' VAL . 5.3 m-20 -179.87 122.92 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.991 -179.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.456 ' HA ' ' HG3' ' A' ' 97' ' ' MET . 20.0 tpt85 -65.83 -14.41 61.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.474 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.91 -43.07 56.28 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 121.211 0.529 . . . . 0.0 110.023 179.452 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.464 ' HB ' ' HD2' ' A' ' 91' ' ' PHE . 0.2 OUTLIER -62.6 -51.74 68.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.145 179.059 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.456 ' HG3' ' HA ' ' A' ' 94' ' ' ARG . 0.9 OUTLIER -51.87 -44.87 63.87 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.392 178.656 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.451 ' O ' ' HB2' ' A' ' 102' ' ' MET . 1.2 m-20 -53.41 -29.44 35.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.975 179.03 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.5 m-20 -82.48 -53.83 5.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.125 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.468 HG13 ' CE2' ' A' ' 91' ' ' PHE . 11.0 mm -70.88 -60.46 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.963 -179.318 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 10.6 ttmt -48.6 -35.38 13.45 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.516 -179.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.451 ' HB2' ' O ' ' A' ' 98' ' ' ASP . 33.3 mtm -83.45 -29.62 27.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.715 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.408 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -76.36 -45.35 32.41 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.485 -179.648 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.418 HD11 ' CG2' ' A' ' 100' ' ' ILE . 5.4 mt -53.53 -53.86 45.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.038 0.447 . . . . 0.0 109.923 179.32 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -56.7 -47.43 79.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.146 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -47.28 -36.01 8.59 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 121.26 0.552 . . . . 0.0 110.37 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.618 HG23 ' OH ' ' A' ' 111' ' ' TYR . 12.3 mt -85.75 -51.81 12.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.143 179.094 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.65 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.4 -59.19 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.34 179.129 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -46.76 -27.38 1.18 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.228 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.456 ' HB3' ' O ' ' A' ' 107' ' ' ILE . 0.0 OUTLIER -73.97 -24.79 59.67 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.88 179.964 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.65 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.2 OUTLIER -73.98 -37.08 64.57 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.265 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.738 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -80.23 -43.62 21.12 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 179.14 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -61.4 -30.78 70.77 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.886 -1.507 . . . . 0.0 109.051 178.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.452 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.393 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.631 178.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 25.6 m170 . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.617 0.246 . . . . 0.0 111.11 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.519 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 0.5 OUTLIER -160.09 160.57 33.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.206 0.526 . . . . 0.0 111.282 179.747 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.441 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . 166.73 135.73 1.91 Allowed Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -179.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.572 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -80.32 148.46 30.68 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.46 ' HB3' ' CZ ' ' A' ' 91' ' ' PHE . . . -154.52 171.23 19.75 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.462 -179.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.496 ' O ' ' HA ' ' A' ' 89' ' ' PHE . 0.4 OUTLIER -103.0 120.67 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.582 -179.644 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.473 ' CZ ' ' CD2' ' A' ' 38' ' ' HIS . 4.5 t80 -119.6 106.67 12.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.899 0.38 . . . . 0.0 111.361 178.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.42 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 16.6 mt-10 67.71 49.42 0.96 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.928 179.123 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.3 mtmt 72.64 -3.56 2.33 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 179.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 22.5 t -102.08 151.17 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 CA-C-O 121.066 0.46 . . . . 0.0 110.483 179.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -107.16 114.08 27.92 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.843 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -133.55 -158.55 8.72 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.061 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.572 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 17.0 mm -120.21 132.23 70.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.77 0.319 . . . . 0.0 111.38 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.521 HG22 HD11 ' A' ' 16' ' ' ILE . 0.3 OUTLIER -101.19 114.87 41.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 177.843 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.519 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -124.03 115.79 21.76 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.539 0.685 . . . . 0.0 110.784 -179.248 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 7.8 mt -82.47 142.75 13.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 114.709 -1.132 . . . . 0.0 112.031 -178.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.474 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.4 OUTLIER -118.45 93.12 4.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.201 179.294 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.07 0.5 44.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.414 -179.689 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -83.36 1.46 41.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.35 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -100.86 -162.46 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.864 0.364 . . . . 0.0 110.972 -179.828 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 94.1 p -176.15 100.36 0.25 Allowed Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.324 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_exo -66.81 165.06 67.43 Favored 'Cis proline' 0 C--N 1.347 0.475 0 C-N-CA 123.644 -1.398 . . . . 0.0 112.474 0.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.34 -171.83 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.663 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -163.36 141.75 7.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.443 0.64 . . . . 0.0 112.249 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.677 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 3.1 tt -108.17 149.05 29.04 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.984 -1.007 . . . . 0.0 108.574 178.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.3 m -146.9 104.19 3.69 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -178.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.485 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 82.2 t90 -92.13 110.59 21.97 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.683 178.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -108.75 130.33 55.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.852 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.8 m -49.96 154.44 1.11 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.696 0.284 . . . . 0.0 110.607 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 21.6 m -72.94 -34.42 66.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.354 0.597 . . . . 0.0 109.703 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -87.03 -16.9 34.27 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.123 179.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.01 34.08 11.34 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.338 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 57.7 m-20 -89.54 -22.63 22.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.644 0.259 . . . . 0.0 111.542 -179.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.96 162.66 2.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.38 0.61 . . . . 0.0 111.434 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.485 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.61 144.95 20.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.025 -178.871 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.473 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 21.9 m80 -118.92 120.2 36.58 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.613 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.51 144.43 26.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.724 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.677 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.2 t -128.75 138.76 53.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.559 -179.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.405 ' O ' HG12 ' A' ' 45' ' ' ILE . 21.7 t -103.86 94.3 3.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 177.568 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.461 ' CD1' HD21 ' A' ' 104' ' ' LEU . 0.9 OUTLIER -42.29 -22.88 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.226 -0.443 . . . . 0.0 112.171 -178.744 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.03 -49.93 16.2 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 29.6 p -65.15 -28.01 69.12 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.369 178.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.576 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 44.5 mm -56.46 109.92 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.591 179.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -53.76 -37.33 63.29 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.847 0.356 . . . . 0.0 110.835 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -167.37 168.57 13.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.834 179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.412 HD13 ' CD1' ' A' ' 104' ' ' LEU . 11.6 tp -109.01 115.62 30.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.706 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.481 ' O ' ' N ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -106.7 141.93 37.16 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 179.728 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.493 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -157.01 139.2 14.61 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.664 0.269 . . . . 0.0 111.308 -179.712 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 71.6 p . . . . . 0 C--N 1.331 -0.203 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.102 -179.81 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.413 ' HE1' ' CB ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.712 0.291 . . . . 0.0 110.85 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 35.2 mtm -149.78 151.66 33.94 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.005 0.431 . . . . 0.0 111.868 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.493 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 33.6 mt -123.95 152.46 42.46 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.3 178.544 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.481 ' N ' ' O ' ' A' ' 49' ' ' GLN . 24.0 ttm180 -151.9 151.56 31.42 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -179.357 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.576 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.4 mp -126.65 117.84 23.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.856 178.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.426 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 10.6 mm -76.62 156.52 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.765 0.317 . . . . 0.0 111.055 -179.571 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.293 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.434 179.979 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.509 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 13.9 p . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.836 0.35 . . . . 0.0 111.097 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -114.14 63.44 0.66 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.799 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -63.22 -17.73 62.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.294 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.9 t -58.4 -21.9 52.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.198 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.7 mmmp? -75.46 -68.44 0.56 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.907 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.4 mttt 55.89 89.59 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.966 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.01 -179.93 4.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.908 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 10.7 mttt -133.76 -168.44 2.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.779 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -135.04 -175.39 3.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.858 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -57.58 -22.09 42.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.316 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 -110.0 33.72 4.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.953 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.14 24.52 44.12 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.474 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -62.46 -169.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.848 0.356 . . . . 0.0 110.899 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -135.65 114.99 12.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.638 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 96.3 t -86.89 -60.6 2.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.39 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.418 HG11 ' O ' ' A' ' 81' ' ' VAL . 4.2 p 34.98 88.29 0.1 OUTLIER Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.854 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_exo -42.12 140.35 2.3 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.94 2.427 . . . . 0.0 112.775 -179.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 46.4 mmtt -93.56 163.87 22.99 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.036 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.509 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.7 Cg_exo . . . . . 0 N--CA 1.461 -0.399 0 C-N-CA 123.602 2.868 . . . . 0.0 112.311 -179.05 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 55.9 mtt180 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.784 0.326 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.468 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 7.1 m-70 -95.39 111.53 23.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.568 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 4.5 ttt -109.19 134.56 51.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.066 -179.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.496 ' HA ' ' O ' ' A' ' 8' ' ' ILE . 0.2 OUTLIER -135.08 116.81 15.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.77 179.821 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.69 114.42 23.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.871 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.46 ' CZ ' ' HB3' ' A' ' 7' ' ' ALA . 7.9 m-85 -91.17 140.92 29.35 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.12 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -97.2 38.54 1.24 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.775 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.471 ' CB ' HG23 ' A' ' 96' ' ' VAL . 1.3 m-20 178.41 116.08 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.553 -179.719 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.414 ' O ' ' CB ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -57.49 -18.14 17.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.674 179.584 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.17 -42.22 66.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.177 0.513 . . . . 0.0 110.122 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.471 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -66.26 -53.01 40.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.287 179.012 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.429 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.1 OUTLIER -61.2 -36.8 80.88 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.335 179.309 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.429 ' N ' ' HG3' ' A' ' 97' ' ' MET . 26.8 t70 -67.81 -32.56 73.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.097 0.475 . . . . 0.0 110.181 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 68.1 m-20 -81.63 -33.25 31.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.237 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.477 ' CD1' HG21 ' A' ' 16' ' ' ILE . 3.2 mm -79.39 -60.09 2.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.616 179.568 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.446 ' HB2' HD22 ' A' ' 60' ' ' LEU . 5.9 ttmt -49.0 -29.58 5.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.508 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 31.5 mtm -79.13 -32.02 44.32 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.701 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.499 ' HA ' ' HG2' ' A' ' 106' ' ' GLN . 0.9 OUTLIER -86.51 -22.98 26.08 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 120.983 0.42 . . . . 0.0 110.235 179.623 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.461 HD21 ' CD1' ' A' ' 42' ' ' LEU . 9.5 mt -73.26 -44.73 58.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.803 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.506 ' HA ' HG13 ' A' ' 108' ' ' ILE . 0.7 OUTLIER -80.63 -33.1 35.99 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -179.431 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.499 ' HG2' ' HA ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -55.71 -36.34 67.09 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 121.309 0.576 . . . . 0.0 110.122 179.832 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.62 HG22 ' OH ' ' A' ' 111' ' ' TYR . 17.7 mt -75.96 -52.05 18.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.441 179.164 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.523 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -43.86 -55.61 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.267 0.556 . . . . 0.0 111.142 179.09 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -46.85 -28.07 1.44 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.237 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.497 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.3 OUTLIER -73.19 -24.76 60.58 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.146 179.751 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.62 ' OH ' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -74.47 -36.53 63.32 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 179.68 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.752 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -80.6 -43.62 20.25 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 179.211 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -61.45 -31.25 71.19 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 113.887 -1.506 . . . . 0.0 108.955 178.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.452 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.454 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.638 178.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.404 ' O ' ' N ' ' A' ' 18' ' ' ILE . 18.8 m80 . . . . . 0 CA--C 1.529 0.155 0 CA-C-O 120.522 0.201 . . . . 0.0 111.45 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.566 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 7.5 p -156.48 151.06 25.7 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.222 0.534 . . . . 0.0 111.209 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.484 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 175.2 140.04 3.24 Favored Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 -179.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -83.03 136.09 34.62 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -178.431 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.419 ' HB3' ' CE1' ' A' ' 91' ' ' PHE . . . -144.79 171.24 14.69 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.011 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.463 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.84 127.81 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-O 120.696 0.284 . . . . 0.0 111.664 -179.672 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.496 ' CZ ' ' CD2' ' A' ' 38' ' ' HIS . 6.8 t80 -127.81 110.08 12.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.986 0.422 . . . . 0.0 111.288 178.382 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.411 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 59.7 mt-10 67.75 47.77 1.12 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.988 179.104 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp 72.29 -5.41 1.78 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.152 179.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.429 HG12 ' CZ2' ' A' ' 29' ' ' TRP . 14.3 t -99.75 148.14 6.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 CA-C-O 121.028 0.442 . . . . 0.0 110.424 179.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.47 113.1 25.47 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.023 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.405 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -131.67 -134.29 3.57 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.613 -0.722 . . . . 0.0 111.905 179.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.553 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 17.3 mm -135.82 135.86 50.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.584 0.23 . . . . 0.0 111.405 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.518 ' CD1' ' CD1' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.41 140.52 19.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 106.295 -1.742 . . . . 0.0 106.295 176.61 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.566 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.33 119.07 6.12 Favored 'General case' 0 C--N 1.313 -0.997 0 C-N-CA 119.591 -0.844 . . . . 0.0 111.915 -178.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.529 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 7.1 mt -82.59 142.82 13.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 114.57 -1.196 . . . . 0.0 112.142 -178.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.507 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -117.32 92.78 3.94 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.822 178.883 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.31 -0.85 42.89 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.348 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -82.7 0.56 42.81 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.132 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.87 -163.6 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.908 0.385 . . . . 0.0 110.694 179.939 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.8 t -175.08 102.29 0.26 Allowed Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.274 179.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.42 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 8.5 Cg_exo -70.48 162.41 86.21 Favored 'Cis proline' 0 C--N 1.345 0.38 0 C-N-CA 123.49 -1.462 . . . . 0.0 112.674 0.45 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.417 ' O ' ' CG ' ' A' ' 26' ' ' GLU . . . -54.3 178.47 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.376 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.436 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 20.4 mt-10 -163.12 135.41 5.3 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.011 179.195 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.575 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.3 OUTLIER -107.79 139.54 42.23 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 178.813 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.4 m -124.82 113.12 17.5 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -178.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.529 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 78.5 t90 -91.97 110.5 21.86 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 178.317 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.455 ' O ' ' N ' ' A' ' 15' ' ' ILE . 49.0 ttt180 -110.5 130.93 55.45 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.955 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.0 m -49.84 158.5 0.48 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.492 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.405 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 45.3 m -74.25 -37.05 63.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.371 0.605 . . . . 0.0 109.71 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -84.64 -16.03 43.36 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.992 -1.004 . . . . 0.0 111.114 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.51 34.5 11.79 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.315 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -85.51 -25.92 26.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.753 0.311 . . . . 0.0 111.408 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.5 164.22 3.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.352 0.596 . . . . 0.0 111.441 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.512 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.65 147.94 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.125 -178.793 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.496 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 15.5 m80 -123.16 121.19 35.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.825 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.51 139.98 31.81 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.838 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.575 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -127.07 140.43 49.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.467 -179.627 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.426 ' O ' HG12 ' A' ' 45' ' ' ILE . 21.9 t -103.83 95.76 4.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 177.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.448 ' CB ' ' OH ' ' A' ' 111' ' ' TYR . 0.6 OUTLIER -42.7 -23.78 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.85 -178.994 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.42 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -76.03 -48.81 19.49 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 179.242 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.6 p -64.47 -27.19 68.81 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.524 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 47.9 mm -56.36 107.38 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.472 178.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.434 ' N ' ' O ' ' A' ' 63' ' ' ILE . 15.6 t70 -53.25 -28.48 27.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.543 -179.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.441 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 0.0 OUTLIER -172.83 163.46 5.01 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.02 0.438 . . . . 0.0 110.963 179.852 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.454 ' CD2' ' HB2' ' A' ' 104' ' ' LEU . 15.0 tp -109.17 122.19 46.76 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.722 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.419 ' HB2' ' HB3' ' A' ' 61' ' ' ARG . 4.2 mt-30 -124.22 146.56 48.64 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-O 120.776 0.322 . . . . 0.0 111.177 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.479 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -157.16 145.1 19.16 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.61 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 72.4 p . . . . . 0 C--N 1.333 -0.124 0 CA-C-O 120.804 0.335 . . . . 0.0 111.182 -179.786 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.413 ' HB3' ' HG2' ' A' ' 97' ' ' MET . 3.0 mpp? . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.837 0.351 . . . . 0.0 111.457 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.0 mpp? -149.79 142.36 24.47 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.589 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.479 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 21.8 mt -116.63 145.64 43.26 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.032 178.525 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.419 ' HB3' ' HB2' ' A' ' 49' ' ' GLN . 10.2 ttm180 -143.6 148.82 36.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.092 0.472 . . . . 0.0 112.237 -179.098 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.524 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.5 mp -128.29 115.94 19.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.625 178.276 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.494 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 24.8 mm -76.41 156.5 5.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.807 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.372 0 C-N-CA 120.734 -0.745 . . . . 0.0 112.631 -179.784 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.466 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 14.8 p . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.759 0.314 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -112.28 75.87 0.94 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.767 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -62.79 -17.57 61.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.31 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.4 m -57.27 -22.77 43.85 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.144 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.9 mmtm -63.01 -65.38 0.69 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.79 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.7 mttp 58.23 92.25 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.851 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -110.32 166.98 10.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.873 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.2 mttp -133.95 -168.02 2.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.812 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -136.54 -176.69 4.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.879 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 -59.11 -20.86 57.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.326 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -105.86 29.07 6.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.016 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.31 26.08 35.5 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.551 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 26.8 m-20 -65.9 -163.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.699 0.285 . . . . 0.0 110.917 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -137.22 116.81 12.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.662 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.406 ' O ' ' O ' ' A' ' 81' ' ' VAL . 99.3 t -86.63 -60.67 2.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.613 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.492 ' O ' ' CG1' ' A' ' 81' ' ' VAL . 0.9 OUTLIER 43.6 98.84 0.03 OUTLIER Pre-proline 0 CA--C 1.537 0.452 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.109 179.868 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -45.01 149.64 1.17 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.591 2.194 . . . . 0.0 112.707 -179.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.1 mtpt -105.14 162.17 20.54 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.953 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.466 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.9 Cg_exo . . . . . 0 N--CA 1.461 -0.393 0 C-N-CA 123.598 2.865 . . . . 0.0 112.269 -179.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.3 mtt180 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.633 0.254 . . . . 0.0 110.585 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.478 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 27.6 m-70 -97.04 111.37 23.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.802 0.334 . . . . 0.0 110.216 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 3.1 mtp -94.3 126.36 39.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.339 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.518 ' CD1' ' CD1' ' A' ' 16' ' ' ILE . 88.8 m-85 -130.55 116.57 18.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.508 179.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.416 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -98.18 114.49 26.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.842 0.353 . . . . 0.0 110.661 179.863 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.477 ' CE2' HG13 ' A' ' 100' ' ' ILE . 43.0 m-85 -94.37 139.64 30.84 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.559 -179.632 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 -99.19 31.98 2.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.712 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.427 ' CB ' HG22 ' A' ' 96' ' ' VAL . 2.1 m-20 -175.41 113.68 0.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.722 -179.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.424 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 10.1 ttp85 -56.62 -19.28 15.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.784 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.62 -47.77 58.42 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-O 120.851 0.358 . . . . 0.0 110.752 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.427 HG22 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -67.0 -45.4 87.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 178.927 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.462 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -63.91 -37.24 86.67 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.755 179.202 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.462 ' N ' ' HG3' ' A' ' 97' ' ' MET . 9.3 m-20 -60.14 -30.18 69.13 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 121.179 0.514 . . . . 0.0 109.948 178.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -81.69 -63.26 1.43 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.169 179.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.477 HG13 ' CE2' ' A' ' 91' ' ' PHE . 9.0 mm -48.56 -59.89 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.948 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.421 ' HB2' HD21 ' A' ' 60' ' ' LEU . 0.6 OUTLIER -48.54 -30.69 5.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.648 -179.997 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 17.1 mtm -83.45 -45.68 13.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.405 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.529 ' HB ' ' CD1' ' A' ' 18' ' ' ILE . 0.3 OUTLIER -57.23 -53.05 62.53 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.756 179.747 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.454 ' HB2' ' CD2' ' A' ' 48' ' ' LEU . 6.4 mt -49.87 -53.61 24.67 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.176 0.512 . . . . 0.0 109.924 179.296 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.423 ' HG2' ' CD2' ' A' ' 48' ' ' LEU . 59.9 mm-40 -56.45 -47.56 78.87 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.963 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -49.82 -34.51 19.92 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-O 121.112 0.482 . . . . 0.0 110.494 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.615 HG21 ' OH ' ' A' ' 111' ' ' TYR . 3.4 mt -85.71 -51.73 13.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.374 179.337 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.675 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.48 -57.02 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.43 179.266 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 35.0 t -47.33 -28.54 2.06 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.209 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.502 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.7 OUTLIER -71.9 -24.99 61.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.12 179.879 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.675 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.2 OUTLIER -74.85 -35.04 62.36 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.526 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.778 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.77 -43.02 17.24 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 178.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -61.42 -32.02 71.97 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 113.898 -1.501 . . . . 0.0 108.957 178.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.456 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.428 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.616 178.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.9 m170 . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.602 0.239 . . . . 0.0 111.153 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.518 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 12.5 p -156.66 159.49 38.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.2 0.524 . . . . 0.0 111.107 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.446 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . 168.24 136.49 2.06 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.575 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.5 148.16 28.27 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -178.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.485 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -157.23 171.45 20.4 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.225 -179.076 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.526 ' O ' ' HA ' ' A' ' 89' ' ' PHE . 4.3 mm -101.7 122.77 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.982 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.478 ' CE1' ' CE1' ' A' ' 38' ' ' HIS . 3.7 t80 -118.44 105.27 11.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.951 0.405 . . . . 0.0 111.051 178.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 67.45 54.75 0.67 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.756 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.1 mttm 70.19 -4.66 1.49 Allowed 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 179.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.414 ' O ' ' HA ' ' A' ' 8' ' ' ILE . 21.7 t -104.04 146.7 11.17 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.501 0 CA-C-O 121.134 0.492 . . . . 0.0 110.806 179.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.431 ' HA ' ' CD1' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -98.48 114.81 27.33 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.459 179.705 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -133.97 -177.37 14.89 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.365 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.575 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 15.5 mm -105.38 130.5 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-O 120.815 0.341 . . . . 0.0 111.237 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.514 HG23 HD11 ' A' ' 16' ' ' ILE . 0.4 OUTLIER -101.14 113.63 37.83 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.967 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.518 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -122.47 114.7 21.05 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 121.452 0.644 . . . . 0.0 110.623 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 10.7 mt -82.41 142.82 13.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.906 -178.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.477 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -116.94 94.78 4.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.292 179.471 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.31 0.69 40.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.384 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -82.78 0.61 42.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.385 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -100.93 -161.94 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.884 0.373 . . . . 0.0 110.911 -179.957 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.0 t -178.84 100.57 0.2 Allowed Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.307 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -65.68 160.99 72.8 Favored 'Cis proline' 0 C--N 1.346 0.412 0 C-N-CA 123.526 -1.447 . . . . 0.0 112.585 0.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.454 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -55.77 -171.36 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.805 179.428 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -163.3 142.06 8.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.465 0.65 . . . . 0.0 112.193 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.678 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 2.7 tt -108.22 147.61 31.12 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.92 -1.036 . . . . 0.0 108.578 178.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.5 m -143.42 104.29 4.22 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.475 ' CH2' ' HB3' ' A' ' 9' ' ' PHE . 82.3 t90 -92.07 110.59 21.97 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.903 178.678 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -109.39 129.27 55.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.644 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.1 t -49.77 156.68 0.67 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.613 0.244 . . . . 0.0 110.514 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.0 m -72.28 -36.2 68.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.352 0.596 . . . . 0.0 109.75 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -82.27 -18.51 42.16 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.063 179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.58 34.81 15.18 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.435 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -93.03 -21.25 19.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.629 0.252 . . . . 0.0 111.62 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.24 161.24 6.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.341 0.591 . . . . 0.0 111.492 -179.774 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.468 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.64 148.95 16.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.107 -178.873 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.478 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 16.3 m80 -123.3 120.47 33.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.606 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.51 143.14 27.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.948 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.678 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.2 t -127.11 138.81 53.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.479 -179.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.427 ' O ' HG12 ' A' ' 45' ' ' ILE . 21.8 t -104.02 94.15 3.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 177.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.443 HD22 ' CG1' ' A' ' 40' ' ' VAL . 0.6 OUTLIER -41.31 -23.47 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.221 -178.698 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.403 ' N ' ' O ' ' A' ' 41' ' ' VAL . 1.2 t -77.34 -49.07 15.73 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.402 ' CG2' ' HB ' ' A' ' 41' ' ' VAL . 30.6 p -64.9 -27.73 69.06 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.488 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.556 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 40.6 mm -55.99 110.19 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.582 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -57.28 -29.56 63.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.519 -179.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.419 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 1.2 pttt -172.47 168.97 5.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.033 0.444 . . . . 0.0 111.09 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.55 HD11 HD22 ' A' ' 62' ' ' LEU . 1.1 tp -109.21 117.09 33.21 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.239 -179.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.527 ' O ' ' N ' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -111.17 138.85 47.1 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 179.033 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.479 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -156.84 141.44 16.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.71 0.29 . . . . 0.0 111.129 -179.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 43.9 p . . . . . 0 CA--C 1.531 0.215 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.95 -179.997 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.815 0.34 . . . . 0.0 110.621 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 32.8 mtm -149.59 146.6 27.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.484 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.534 HD23 ' HB2' ' A' ' 101' ' ' LYS . 32.1 mt -121.53 152.73 38.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.793 178.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.527 ' N ' ' O ' ' A' ' 49' ' ' GLN . 6.9 ttm180 -151.78 145.3 24.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.802 -179.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.556 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.2 mp -120.46 118.16 29.55 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 178.281 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.445 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 26.8 mm -76.48 156.48 5.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.596 0.236 . . . . 0.0 111.058 -179.581 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.298 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.548 179.975 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.466 ' HB ' ' CA ' ' A' ' 84' ' ' PRO . 12.0 p . . . . . 0 N--CA 1.457 -0.113 0 CA-C-O 120.817 0.341 . . . . 0.0 111.074 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -132.9 64.39 1.61 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.536 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -65.39 -14.79 61.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.561 -179.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.8 m -108.75 34.95 3.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.709 0.29 . . . . 0.0 110.987 -179.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.9 mmmm -122.97 -65.85 1.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.167 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 32.9 mttt 66.1 96.86 0.05 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.394 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.76 132.56 55.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.181 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.8 mmtp -82.32 159.94 22.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.853 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 51.6 p30 -112.45 -173.48 2.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.893 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -60.05 -20.36 57.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.329 -179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -101.05 24.13 9.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.126 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.21 21.89 34.4 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.731 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -89.79 117.07 28.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.697 0.284 . . . . 0.0 110.771 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -70.26 108.1 4.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.811 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.3 t -111.03 119.49 59.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.751 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.441 ' O ' ' CG1' ' A' ' 81' ' ' VAL . 14.6 p -99.72 100.71 11.6 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.86 178.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -38.58 143.66 0.23 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.829 2.353 . . . . 0.0 113.121 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 8.7 pttt -112.06 166.36 11.08 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.997 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.466 ' CA ' ' HB ' ' A' ' 66' ' ' VAL . 2.6 Cg_exo . . . . . 0 N--CA 1.462 -0.333 0 C-N-CA 123.621 2.881 . . . . 0.0 112.232 -179.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.415 ' HG2' ' CD1' ' A' ' 63' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.689 0.281 . . . . 0.0 110.835 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.489 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 4.3 m-70 -100.82 111.41 23.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.378 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.401 ' CA ' ' HG3' ' A' ' 61' ' ' ARG . 1.0 OUTLIER -104.88 139.03 40.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.179 -179.622 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.526 ' HA ' ' O ' ' A' ' 8' ' ' ILE . 0.2 OUTLIER -140.04 120.33 13.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.977 179.888 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.494 ' HB2' HG12 ' A' ' 8' ' ' ILE . 1.2 m -88.66 114.72 25.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.275 -179.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.485 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 6.8 m-85 -95.2 133.61 38.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.9 0.381 . . . . 0.0 111.094 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 24.3 m-20 -92.55 43.76 1.14 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.706 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.464 ' CB ' HG22 ' A' ' 96' ' ' VAL . 1.1 m-20 174.77 114.49 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.293 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.32 -16.95 10.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.933 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.62 -42.48 64.42 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.18 0.514 . . . . 0.0 109.906 179.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.464 HG22 ' CB ' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -65.82 -54.25 29.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.266 178.905 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -59.35 -35.96 74.84 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.438 179.388 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -67.08 -31.72 72.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.066 0.46 . . . . 0.0 110.428 179.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 90.3 m-20 -81.74 -30.03 32.63 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.335 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.454 HD11 ' CG2' ' A' ' 16' ' ' ILE . 4.5 mm -83.23 -59.97 2.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.817 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.534 ' HB2' HD23 ' A' ' 60' ' ' LEU . 17.8 ttpp -47.55 -38.3 13.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.644 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 41.6 mtm -79.94 -25.62 40.4 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.242 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -80.76 -40.74 24.66 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.126 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 13.2 mt -57.73 -53.01 63.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.267 -0.424 . . . . 0.0 109.993 179.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.456 ' NE2' ' CD2' ' A' ' 48' ' ' LEU . 4.6 mm-40 -60.59 -43.66 97.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.433 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -47.18 -36.44 8.7 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 121.22 0.533 . . . . 0.0 110.512 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.595 HG23 ' OH ' ' A' ' 111' ' ' TYR . 14.4 mt -85.88 -51.59 13.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.512 179.193 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.643 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.21 -60.49 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.681 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 6.6 t -46.96 -25.87 0.88 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.25 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.459 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 15.7 mtt180 -72.26 -25.07 61.47 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.942 179.5 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.643 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.2 OUTLIER -75.38 -36.7 60.87 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 179.698 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.741 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.59 -42.87 19.46 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.988 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -61.39 -30.24 70.42 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.007 -1.451 . . . . 0.0 108.967 177.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.459 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.456 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.54 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.403 ' CE1' ' HB2' ' A' ' 20' ' ' GLU . 25.2 m170 . . . . . 0 CA--C 1.529 0.158 0 CA-C-O 120.584 0.23 . . . . 0.0 111.119 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.545 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 8.9 p -156.33 142.31 18.05 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.139 0.495 . . . . 0.0 111.228 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.461 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . -175.45 140.27 5.13 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 110.746 -0.942 . . . . 0.0 110.746 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.555 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -81.94 139.73 34.44 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.415 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.418 ' HB1' ' CE1' ' A' ' 91' ' ' PHE . . . -148.92 171.23 16.66 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.043 -179.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.463 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.96 128.72 55.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-O 120.827 0.346 . . . . 0.0 111.791 -179.55 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.464 ' CZ ' ' CD2' ' A' ' 38' ' ' HIS . 7.1 t80 -129.19 110.62 12.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.111 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 5.6 mm-40 67.41 47.69 1.23 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.947 179.014 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.2 mmtm 72.25 -5.95 1.66 Allowed 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.435 HG13 ' CZ2' ' A' ' 29' ' ' TRP . 14.4 t -99.23 148.52 6.2 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 CA-C-O 121.034 0.445 . . . . 0.0 110.474 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -111.34 113.86 26.62 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.084 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -132.31 -133.91 3.48 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.877 -0.678 . . . . 0.0 112.112 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.555 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 17.5 mm -136.13 135.27 50.18 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.491 0 CA-C-O 120.81 0.338 . . . . 0.0 111.322 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.517 ' CD1' ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.32 139.99 20.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 176.669 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.545 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -150.1 118.56 6.47 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 119.489 -0.884 . . . . 0.0 111.68 -178.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.521 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 11.3 mt -81.57 142.92 13.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 114.469 -1.242 . . . . 0.0 112.053 -178.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.503 ' O ' HG21 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -119.98 92.59 3.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.045 179.052 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.403 ' HB2' ' CE1' ' A' ' 3' ' ' HIS . 1.2 tt0 -82.46 -0.39 46.12 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.33 -179.645 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -83.08 1.31 40.83 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.336 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.503 HG21 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -102.58 -162.72 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.842 0.354 . . . . 0.0 110.819 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.3 p -174.28 101.08 0.29 Allowed Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.366 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.427 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 58.4 Cg_endo -71.84 165.56 81.51 Favored 'Cis proline' 0 C--N 1.346 0.41 0 C-N-CA 123.518 -1.451 . . . . 0.0 112.765 0.466 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.403 ' HB1' HG22 ' A' ' 107' ' ' ILE . . . -58.32 175.72 0.21 Allowed 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.549 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.468 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 6.6 pt-20 -163.71 138.71 6.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.112 179.179 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.566 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.3 OUTLIER -107.72 143.92 35.55 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.861 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.2 m -127.52 113.55 16.28 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -178.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.525 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 77.9 t90 -92.0 110.33 21.69 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.73 130.97 55.43 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.68 0.276 . . . . 0.0 110.905 -179.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.3 t -49.84 158.52 0.48 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.561 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 48.1 m -73.76 -37.34 65.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.483 0.658 . . . . 0.0 109.69 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -84.2 -16.32 43.81 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.001 -1.0 . . . . 0.0 111.18 179.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.49 34.54 11.74 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.308 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -85.54 -25.61 26.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.677 0.275 . . . . 0.0 111.379 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.73 163.94 2.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.213 0.53 . . . . 0.0 111.423 -179.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.52 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.68 146.16 19.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.196 -178.729 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.464 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 37.4 m80 -119.84 120.75 37.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.664 179.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.53 137.42 35.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.063 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.566 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.1 t -126.53 139.31 52.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.221 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.417 ' O ' HG12 ' A' ' 45' ' ' ILE . 47.0 t -103.96 95.98 4.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 177.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.4 ' N ' ' CD2' ' A' ' 42' ' ' LEU . 0.9 OUTLIER -41.16 -25.52 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.12 -178.919 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.427 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 2.0 t -76.14 -48.51 20.33 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.465 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.408 ' CG2' ' HB ' ' A' ' 41' ' ' VAL . 30.9 p -64.69 -27.86 69.2 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 178.449 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.539 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 42.0 mm -56.48 107.14 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.512 178.619 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.407 ' N ' ' O ' ' A' ' 63' ' ' ILE . 8.2 t70 -47.89 -33.98 8.3 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.926 0.393 . . . . 0.0 111.011 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.405 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 1.8 pttt -172.44 164.02 5.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.72 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.402 ' CD1' ' CD1' ' A' ' 104' ' ' LEU . 15.1 tp -108.65 123.29 48.74 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.61 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -119.53 148.56 43.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.537 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.461 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -157.1 148.37 22.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.573 0.225 . . . . 0.0 111.043 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 35.7 p . . . . . 0 C--N 1.332 -0.18 0 CA-C-O 120.626 0.25 . . . . 0.0 110.985 -179.85 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.1 mpp? . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.671 0.272 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 31.9 mtm -149.7 143.19 25.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.632 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.461 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 25.4 mt -120.48 145.55 47.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.096 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.432 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 14.7 ttm-85 -141.9 151.3 42.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.949 0.404 . . . . 0.0 111.857 -179.058 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.539 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.5 mp -128.19 117.42 21.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.817 178.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.44 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 17.3 mm -76.6 156.52 5.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.792 0.329 . . . . 0.0 111.279 -179.354 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.284 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.447 179.998 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.462 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 7.6 p . . . . . 0 N--CA 1.455 -0.198 0 CA-C-O 120.794 0.331 . . . . 0.0 111.313 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -113.04 39.57 2.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.807 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.59 -21.91 65.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.187 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.2 m -80.02 -21.07 43.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.208 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.4 mmtp -79.63 -68.37 0.67 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.9 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.3 mtpt 60.04 89.25 0.07 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.818 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.28 -176.51 3.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.923 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 11.1 mttt -134.38 -167.74 2.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.674 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -135.91 -179.21 5.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.91 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -56.93 -22.32 36.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.347 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.73 33.49 4.04 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.989 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 55.5 26.17 44.35 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.51 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -66.8 -169.51 0.08 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.816 0.341 . . . . 0.0 111.001 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -135.58 119.39 17.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.568 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.2 t -89.28 -63.92 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.424 -179.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.424 HG11 ' O ' ' A' ' 81' ' ' VAL . 4.8 p 34.21 80.41 0.26 Allowed Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.849 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -45.51 124.69 6.85 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.848 2.365 . . . . 0.0 112.592 -179.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.09 161.62 77.9 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.018 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.462 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.5 Cg_exo . . . . . 0 N--CA 1.459 -0.519 0 C-N-CA 123.645 2.897 . . . . 0.0 112.42 -179.036 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.634 0.255 . . . . 0.0 110.568 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.479 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 17.3 m-70 -99.02 111.37 23.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.732 0.301 . . . . 0.0 110.372 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.81 121.04 35.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.008 0.432 . . . . 0.0 111.199 -179.532 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.517 ' CD1' ' CD1' ' A' ' 16' ' ' ILE . 92.9 m-85 -122.9 116.73 24.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.467 179.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.11 114.55 26.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.846 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.418 ' CE1' ' HB1' ' A' ' 7' ' ' ALA . 17.0 m-85 -94.66 137.14 34.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.182 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 24.6 m-20 -97.08 39.26 1.19 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.823 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.465 ' CB ' HG22 ' A' ' 96' ' ' VAL . 5.4 m-20 179.59 111.17 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.553 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.409 ' O ' ' HG3' ' A' ' 97' ' ' MET . 0.3 OUTLIER -53.41 -21.67 6.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.781 179.795 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.79 -47.3 66.49 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-O 120.891 0.377 . . . . 0.0 110.834 179.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.465 HG22 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -65.76 -47.22 86.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 178.873 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.457 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -64.52 -37.42 87.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.372 179.539 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.457 ' N ' ' HG3' ' A' ' 97' ' ' MET . 35.7 t0 -68.75 -33.88 74.65 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.095 0.474 . . . . 0.0 109.965 179.278 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.435 ' O ' ' OG1' ' A' ' 103' ' ' THR . 53.2 m-20 -81.88 -26.86 33.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.475 179.294 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.409 HG22 ' CD1' ' A' ' 60' ' ' LEU . 1.6 mm -86.4 -59.7 2.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.041 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.434 ' HB2' HD22 ' A' ' 60' ' ' LEU . 7.9 ttmt -44.15 -30.6 0.79 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.374 -179.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.77 -37.93 34.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.446 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.521 ' HB ' ' CD1' ' A' ' 18' ' ' ILE . 0.3 OUTLIER -59.33 -57.42 13.09 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.714 179.588 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.406 ' O ' ' CG1' ' A' ' 108' ' ' ILE . 5.7 mt -47.97 -56.03 8.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.892 179.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.37 -44.99 80.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.883 179.444 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -52.19 -34.44 45.3 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-O 121.168 0.509 . . . . 0.0 110.404 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.666 HG21 ' HE1' ' A' ' 111' ' ' TYR . 5.0 mt -85.64 -51.91 12.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.328 179.291 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.659 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -42.26 -57.58 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.501 179.396 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.7 m -46.92 -26.12 0.92 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.178 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.438 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 14.4 mtp85 -74.06 -25.02 59.61 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.282 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.666 ' HE1' HG21 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -76.32 -34.34 59.01 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.76 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.01 -43.51 17.88 Favored 'General case' 0 CA--C 1.505 -0.776 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 178.851 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -61.65 -31.56 71.67 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 113.867 -1.515 . . . . 0.0 109.099 178.112 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.438 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.449 -0.516 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.697 178.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 33.8 m170 . . . . . 0 CA--C 1.53 0.183 0 CA-C-O 120.477 0.18 . . . . 0.0 111.434 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.551 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 3.4 p -151.25 155.39 38.69 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.162 0.506 . . . . 0.0 111.328 179.543 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.489 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 173.62 138.02 2.55 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.866 -0.894 . . . . 0.0 110.866 -179.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.561 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.22 133.41 35.25 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -178.53 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.42 ' HB1' ' CE1' ' A' ' 91' ' ' PHE . . . -141.6 171.23 14.35 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.182 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.46 ' N ' ' CD1' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.66 127.99 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.827 -179.598 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.46 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 7.6 t80 -129.41 110.81 12.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.957 0.408 . . . . 0.0 111.155 178.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.419 ' HG3' ' CE1' ' A' ' 9' ' ' PHE . 36.8 mt-10 67.53 49.38 1.01 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.826 179.173 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 69.76 -4.69 1.37 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.214 179.412 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.435 HG11 ' CZ2' ' A' ' 29' ' ' TRP . 15.7 t -100.07 148.11 6.95 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.479 0 CA-C-O 121.108 0.48 . . . . 0.0 110.41 179.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -112.1 112.83 24.73 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.956 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.405 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -130.46 -128.97 3.04 Favored Glycine 0 N--CA 1.445 -0.71 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.958 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.561 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 19.4 mm -138.66 135.48 43.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 120.692 0.282 . . . . 0.0 111.313 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.508 ' CD1' ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.8 141.2 17.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 106.279 -1.748 . . . . 0.0 106.279 176.575 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.551 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.41 116.99 5.4 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 119.532 -0.867 . . . . 0.0 111.549 -178.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.47 ' HA ' ' HA ' ' A' ' 27' ' ' LEU . 4.7 mt -85.28 137.81 20.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 114.553 -1.203 . . . . 0.0 111.85 -178.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.499 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.7 OUTLIER -116.6 93.43 4.21 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.316 179.545 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -80.36 0.08 34.62 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.475 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -82.7 0.41 43.51 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.36 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -101.75 -162.27 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.873 0.368 . . . . 0.0 110.886 179.89 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 t -175.73 101.23 0.25 Allowed Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.427 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.428 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 57.5 Cg_endo -71.31 160.23 92.71 Favored 'Cis proline' 0 C--N 1.346 0.434 0 C-N-CA 123.471 -1.47 . . . . 0.0 112.784 0.409 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.41 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -53.64 176.97 0.03 OUTLIER 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.421 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.494 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.64 135.0 4.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.43 179.309 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.557 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.3 OUTLIER -108.08 130.57 55.09 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 178.736 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.4 m -114.52 113.44 24.44 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -178.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.526 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 78.1 t90 -91.94 110.58 21.94 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.246 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.505 ' O ' ' N ' ' A' ' 15' ' ' ILE . 1.5 ttt180 -110.83 131.27 55.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.199 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.1 m -49.91 160.6 0.31 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.424 179.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.405 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 45.9 m -75.66 -37.34 59.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.341 0.591 . . . . 0.0 109.751 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -85.42 -14.53 45.93 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.107 179.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.65 34.72 12.91 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.323 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.32 -26.1 26.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.812 0.339 . . . . 0.0 111.358 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.28 162.49 2.95 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.275 0.56 . . . . 0.0 111.411 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.515 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.61 145.63 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.035 -178.768 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 31.3 m-70 -120.03 120.99 37.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.779 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.51 128.52 43.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.708 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.557 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -114.72 140.25 36.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.522 -179.547 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 28.3 t -104.03 96.29 4.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 177.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.438 ' CB ' ' OH ' ' A' ' 111' ' ' TYR . 0.5 OUTLIER -42.81 -24.46 0.06 Allowed 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.874 -178.89 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.428 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 1.5 t -74.84 -48.02 27.36 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.255 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 48.4 p -64.66 -27.71 69.11 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 108.976 -0.749 . . . . 0.0 108.976 178.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.531 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 44.6 mm -56.58 108.06 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.645 178.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.444 ' N ' ' O ' ' A' ' 63' ' ' ILE . 14.9 t0 -55.27 -28.13 51.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.395 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.7 ptpt -172.45 161.97 5.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.901 0.381 . . . . 0.0 110.873 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.435 ' CD1' HD13 ' A' ' 104' ' ' LEU . 46.5 tp -109.09 118.94 38.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.975 -179.607 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.45 ' O ' ' N ' ' A' ' 61' ' ' ARG . 3.2 tt0 -117.6 145.68 44.15 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.788 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.477 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -157.1 145.92 19.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.997 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 72.7 p . . . . . 0 CA--C 1.53 0.173 0 CA-C-O 120.595 0.236 . . . . 0.0 110.954 179.977 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.835 0.35 . . . . 0.0 110.526 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 47.8 mtm -149.6 146.29 27.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.615 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.477 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 26.7 mt -119.8 148.75 43.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.596 178.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.45 ' N ' ' O ' ' A' ' 49' ' ' GLN . 1.7 ttt180 -144.52 147.19 32.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.879 0.371 . . . . 0.0 111.559 -179.621 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.531 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.6 mp -128.37 113.74 15.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.815 178.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.574 ' HA ' ' HB3' ' A' ' 86' ' ' ARG . 7.1 mm -76.7 156.48 5.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.747 0.308 . . . . 0.0 111.239 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.467 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.489 179.937 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.544 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 11.2 p . . . . . 0 N--CA 1.457 -0.101 0 CA-C-O 120.871 0.367 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -91.7 74.22 5.82 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.138 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 -54.29 -21.01 8.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.603 -179.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.7 m -48.53 -27.46 2.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.882 0.372 . . . . 0.0 111.317 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.8 mmmt -67.46 -65.83 0.64 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.757 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.3 mttt 60.93 93.01 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.022 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.57 124.46 34.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.754 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -76.18 167.49 21.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.944 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -104.43 -50.48 3.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.203 0.525 . . . . 0.0 111.168 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.3 t30 174.36 -31.54 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.198 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -93.37 40.78 1.07 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.091 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 58.33 19.16 38.9 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.645 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -80.38 174.23 11.81 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.821 0.343 . . . . 0.0 110.8 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -133.29 111.99 11.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.825 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 24.4 t -103.33 141.58 18.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.432 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 45.4 t -110.65 90.6 10.81 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.633 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -44.55 145.51 2.6 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.681 2.254 . . . . 0.0 112.57 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.443 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -54.06 154.44 7.72 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.156 -179.889 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.544 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 4.2 Cg_exo . . . . . 0 N--CA 1.46 -0.486 0 C-N-CA 123.513 2.808 . . . . 0.0 112.351 -179.193 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.574 ' HB3' ' HA ' ' A' ' 63' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.697 0.284 . . . . 0.0 111.056 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.523 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 14.4 m-70 -94.93 116.44 28.71 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.183 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.04 110.95 22.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.005 0.431 . . . . 0.0 111.186 -179.413 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.508 ' CD1' ' CD1' ' A' ' 16' ' ' ILE . 94.2 m-85 -110.93 116.61 31.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.501 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -100.79 114.39 28.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.884 0.373 . . . . 0.0 110.711 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.499 ' CE2' HG13 ' A' ' 100' ' ' ILE . 42.6 m-85 -93.41 150.69 20.26 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.426 -179.751 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 -107.98 31.54 5.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.404 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.447 ' CB ' HG22 ' A' ' 96' ' ' VAL . 2.1 m-20 -175.93 113.68 0.12 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.468 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 97' ' ' MET . 0.0 OUTLIER -56.57 -19.07 14.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 179.77 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.92 -45.07 64.92 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.735 179.764 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.447 HG22 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -67.81 -48.27 76.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.966 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.421 ' HG3' ' O ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -62.07 -35.56 79.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.865 179.165 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.409 ' N ' ' HG3' ' A' ' 97' ' ' MET . 7.3 m-20 -61.15 -31.47 71.19 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.217 179.111 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.9 m-80 -81.73 -51.76 7.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.42 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.499 HG13 ' CE2' ' A' ' 91' ' ' PHE . 10.7 mm -58.46 -59.77 3.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.623 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.456 ' HB2' HD21 ' A' ' 60' ' ' LEU . 5.3 ttmt -51.18 -31.75 21.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.912 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 14.1 mtm -83.34 -31.44 26.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.592 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.434 ' HA ' ' HG2' ' A' ' 106' ' ' GLN . 0.9 OUTLIER -82.32 -27.16 32.41 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.798 -179.568 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.464 ' O ' HG13 ' A' ' 108' ' ' ILE . 19.3 mt -67.69 -42.08 82.63 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 179.322 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.29 -48.72 69.48 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.603 -179.362 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.434 ' HG2' ' HA ' ' A' ' 103' ' ' THR . 11.1 pt20 -46.86 -33.39 4.48 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 121.087 0.47 . . . . 0.0 110.973 -178.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.65 HG21 ' OH ' ' A' ' 111' ' ' TYR . 11.3 mt -82.42 -53.36 11.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.603 179.278 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.652 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.24 -57.15 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.342 179.65 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -46.87 -26.92 1.08 Allowed 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.134 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.446 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 19.7 mtp180 -73.95 -25.05 59.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.29 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.652 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -76.1 -35.59 59.25 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.735 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.732 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -80.54 -43.78 20.14 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 178.911 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -61.54 -31.08 71.09 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 113.876 -1.511 . . . . 0.0 109.053 178.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.446 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.407 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.691 178.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.3 m170 . . . . . 0 CA--C 1.528 0.109 0 CA-C-O 120.567 0.222 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.552 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 3.9 p -155.79 157.58 36.73 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.122 0.487 . . . . 0.0 111.218 179.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.48 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 171.33 139.15 2.7 Favored Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 111.119 -0.792 . . . . 0.0 111.119 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.559 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.78 144.2 30.33 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -178.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -153.28 171.19 18.94 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.054 -179.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.478 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.79 125.74 55.85 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 CA-C-O 120.745 0.307 . . . . 0.0 111.721 -179.68 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.449 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.2 t80 -125.17 109.16 12.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.938 0.399 . . . . 0.0 111.194 178.498 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 49.9 mt-10 67.5 48.06 1.16 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.888 179.025 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.6 mttt 73.3 -5.84 1.87 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.2 0.445 . . . . 0.0 112.2 179.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.429 HG11 ' CZ2' ' A' ' 29' ' ' TRP . 16.8 t -100.21 148.68 6.49 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.496 0 CA-C-O 121.174 0.511 . . . . 0.0 110.448 179.639 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.8 113.18 25.56 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.97 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -131.9 -133.86 3.51 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.803 -0.713 . . . . 0.0 111.983 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.559 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 18.4 mm -135.93 135.68 50.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.682 0.277 . . . . 0.0 111.319 179.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.511 ' CD1' ' CD1' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.74 140.37 19.82 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 176.5 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.552 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -149.55 117.51 6.31 Favored 'General case' 0 C--N 1.31 -1.115 0 C-N-CA 119.607 -0.837 . . . . 0.0 111.614 -178.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.477 ' HA ' ' HA ' ' A' ' 27' ' ' LEU . 4.3 mt -85.39 142.77 12.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.738 -178.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.491 ' O ' HG21 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -121.26 92.83 3.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.399 179.634 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.18 0.42 36.57 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.487 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -82.67 0.65 42.26 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.295 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.491 HG21 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -102.24 -162.56 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.924 0.392 . . . . 0.0 110.858 -179.962 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.1 p -174.43 101.07 0.28 Allowed Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.437 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.44 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 56.4 Cg_endo -70.71 165.64 78.76 Favored 'Cis proline' 0 C--N 1.347 0.461 0 C-N-CA 123.438 -1.484 . . . . 0.0 112.807 0.278 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.25 176.74 0.15 Allowed 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.308 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.468 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.7 135.46 4.87 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.287 179.287 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.557 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.3 OUTLIER -107.85 147.37 31.01 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.786 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.2 m -132.73 113.65 13.22 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.431 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.543 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 79.7 t90 -91.96 110.5 21.86 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 178.331 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.406 ' O ' ' N ' ' A' ' 15' ' ' ILE . 8.8 ttt180 -110.51 131.0 55.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.961 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.5 m -49.87 158.92 0.44 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.53 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 48.4 m -74.42 -37.35 63.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.379 0.609 . . . . 0.0 109.674 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -84.21 -16.02 44.83 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.027 -0.988 . . . . 0.0 111.154 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.47 34.53 11.81 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.235 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.92 -25.53 26.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.638 0.256 . . . . 0.0 111.364 -179.665 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.78 163.75 2.86 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.31 0.576 . . . . 0.0 111.403 -179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.518 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.65 146.83 19.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.07 -178.757 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.43 ' ND1' ' CZ ' ' A' ' 9' ' ' PHE . 12.6 m-70 -120.48 120.18 35.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.698 179.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.43 141.45 29.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.805 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.557 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -129.98 139.83 50.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.413 -179.507 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.403 ' O ' HG12 ' A' ' 45' ' ' ILE . 30.7 t -103.87 96.32 4.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 177.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.411 HD12 ' CD2' ' A' ' 104' ' ' LEU . 0.6 OUTLIER -41.75 -24.21 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.127 -178.775 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.44 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 1.8 t -77.38 -48.59 16.9 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 179.388 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.7 p -64.49 -27.5 69.02 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.528 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 36.7 mm -56.48 112.59 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.595 178.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.418 ' N ' ' O ' ' A' ' 63' ' ' ILE . 1.4 t70 -52.37 -35.05 50.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.882 0.373 . . . . 0.0 111.034 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.6 pttt -172.34 167.44 5.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.813 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.433 ' CD1' HD13 ' A' ' 104' ' ' LEU . 15.1 tp -109.05 118.85 37.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.986 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -114.27 145.92 41.12 Favored 'General case' 0 C--O 1.225 -0.224 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.423 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.474 ' HB2' HD21 ' A' ' 60' ' ' LEU . . . -156.97 151.07 24.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.129 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.5 p . . . . . 0 C--N 1.331 -0.196 0 CA-C-O 120.657 0.265 . . . . 0.0 111.295 -179.576 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.418 ' HG2' ' CA ' ' A' ' 94' ' ' ARG . 3.0 mpp? . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.83 0.348 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 31.0 mtm -149.69 138.48 20.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.637 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.474 HD21 ' HB2' ' A' ' 50' ' ' ALA . 16.0 mt -117.68 143.54 46.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.054 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.406 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 0.3 OUTLIER -144.59 149.57 36.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.022 0.439 . . . . 0.0 112.023 -179.043 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.528 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.8 mp -128.08 118.05 22.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.819 178.533 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.418 ' O ' ' N ' ' A' ' 46' ' ' ASP . 10.0 mm -76.5 156.5 5.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.037 -179.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.284 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.53 -179.995 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.509 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 14.5 p . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.747 0.308 . . . . 0.0 111.174 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.0 p30 -101.71 73.11 1.41 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.623 179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -54.92 -23.99 21.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.256 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.6 m -63.44 -21.77 66.49 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.0 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -63.33 -62.88 1.39 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.795 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.8 mttm 62.77 94.47 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.819 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.6 128.74 45.02 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.857 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.48 153.96 37.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.913 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.46 -42.16 7.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.984 0.421 . . . . 0.0 111.007 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 167.76 -29.66 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.166 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -101.6 20.79 15.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.356 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.21 36.05 56.29 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.555 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -90.29 0.38 57.26 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 54.77 110.42 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.901 0.381 . . . . 0.0 111.661 179.423 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 7.1 t -113.44 133.54 59.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.619 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 42.5 t -106.17 85.78 1.79 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.605 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -43.85 139.9 5.19 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.954 2.436 . . . . 0.0 112.633 -179.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -58.82 165.08 3.53 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.122 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.509 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.3 Cg_exo . . . . . 0 N--CA 1.46 -0.442 0 C-N-CA 123.683 2.922 . . . . 0.0 112.33 -179.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.697 0.284 . . . . 0.0 110.751 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.502 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 10.0 m-70 -99.09 111.33 23.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.756 0.312 . . . . 0.0 110.164 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.404 ' HA ' ' HG3' ' A' ' 61' ' ' ARG . 9.0 ttt -94.74 134.7 37.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.065 0.46 . . . . 0.0 111.586 -179.19 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.511 ' CD1' ' CD1' ' A' ' 16' ' ' ILE . 51.5 m-85 -135.31 116.62 14.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.667 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.22 114.8 27.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.894 0.378 . . . . 0.0 110.491 179.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.456 ' CE2' ' HA ' ' A' ' 97' ' ' MET . 9.0 m-85 -89.74 136.33 33.1 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.733 -179.368 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -101.08 27.79 5.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.306 179.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.41 ' CB ' HG21 ' A' ' 96' ' ' VAL . 9.9 m-20 -175.24 112.76 0.13 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.556 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.418 ' CA ' ' HG2' ' A' ' 58' ' ' MET . 0.0 OUTLIER -55.79 -19.39 11.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.927 179.72 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.21 -47.95 59.25 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.796 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.41 HG21 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -66.83 -45.37 87.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.006 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.461 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -63.9 -37.02 85.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.766 179.31 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.461 ' N ' ' HG3' ' A' ' 97' ' ' MET . 14.1 m-20 -61.14 -31.95 71.66 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.093 0.473 . . . . 0.0 109.941 178.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 -81.97 -54.04 5.64 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.502 179.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.457 HD12 ' N ' ' A' ' 5' ' ' GLY . 15.3 mm -57.5 -60.01 2.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.896 179.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.404 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 0.4 OUTLIER -51.6 -37.3 49.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.269 -179.584 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.41 ' HB2' ' O ' ' A' ' 98' ' ' ASP . 39.1 mtm -81.35 -27.72 34.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.218 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.415 HG23 HD12 ' A' ' 18' ' ' ILE . 1.0 OUTLIER -81.49 -31.44 32.9 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.852 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.433 HD13 ' CD1' ' A' ' 48' ' ' LEU . 33.7 mt -64.8 -55.95 16.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.96 179.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.404 ' NE2' ' O ' ' A' ' 101' ' ' LYS . 0.5 OUTLIER -62.34 -35.9 80.54 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.926 179.64 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -50.39 -36.97 35.11 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-O 121.289 0.566 . . . . 0.0 109.811 179.287 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.573 HG23 ' OH ' ' A' ' 111' ' ' TYR . 12.4 mt -85.78 -52.08 12.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.02 178.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.639 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.53 -58.1 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.342 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.229 179.225 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.4 m -47.29 -25.98 1.11 Allowed 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.133 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.454 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 33.6 mtp180 -74.08 -25.04 59.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.214 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.639 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -75.41 -35.28 61.04 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.661 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.755 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.34 -43.46 19.03 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 178.873 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -61.66 -31.59 71.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 113.838 -1.528 . . . . 0.0 108.983 178.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.454 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.447 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.681 178.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.42 ' O ' ' N ' ' A' ' 18' ' ' ILE . 18.6 m80 . . . . . 0 CA--C 1.529 0.159 0 CA-C-O 120.62 0.248 . . . . 0.0 111.009 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.53 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 19.2 p -158.31 133.63 8.71 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 121.244 0.545 . . . . 0.0 111.212 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.431 ' O ' ' HB ' ' A' ' 16' ' ' ILE . . . -170.29 138.78 5.17 Favored Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.563 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -80.26 142.28 34.75 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -178.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.458 ' HB1' ' CZ ' ' A' ' 91' ' ' PHE . . . -154.66 171.19 19.9 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.326 -179.35 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.471 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -99.08 127.59 51.58 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.388 -179.782 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.471 ' CB ' ' CE2' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -127.19 107.18 9.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.994 0.426 . . . . 0.0 111.545 179.122 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 68.04 53.87 0.62 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.221 179.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.06 -0.7 1.64 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.91 179.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.405 HG11 ' CZ2' ' A' ' 29' ' ' TRP . 37.1 t -105.15 151.91 7.22 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.481 0 CA-C-O 121.201 0.524 . . . . 0.0 110.576 179.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.428 ' HA ' HD12 ' A' ' 8' ' ' ILE . 54.7 p -114.09 115.84 28.19 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.136 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.421 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -138.04 -139.27 3.83 Favored Glycine 0 N--CA 1.444 -0.804 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.94 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.563 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 15.9 mm -129.32 134.93 62.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.844 0.354 . . . . 0.0 111.219 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.503 HG23 HD11 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -100.36 140.62 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 176.703 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.53 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.46 118.1 5.74 Favored 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 119.537 -0.865 . . . . 0.0 111.507 -178.347 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.497 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 6.9 mt -80.79 142.96 13.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 114.385 -1.28 . . . . 0.0 112.254 -178.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.515 ' O ' HG22 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -119.39 92.65 3.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.96 179.057 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.26 -0.95 47.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.305 -179.76 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -83.0 1.07 41.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.57 -0.287 . . . . 0.0 111.241 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.515 HG22 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -102.91 -162.92 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.837 0.351 . . . . 0.0 110.758 179.998 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.9 p -174.42 101.07 0.28 Allowed Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.333 179.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.435 ' CG ' ' HB3' ' A' ' 43' ' ' SER . 58.5 Cg_endo -71.74 165.4 81.75 Favored 'Cis proline' 0 C--N 1.347 0.464 0 C-N-CA 123.569 -1.43 . . . . 0.0 112.905 0.396 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.55 176.57 0.13 Allowed 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.514 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.507 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 13.7 pt-20 -163.76 136.85 5.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.229 179.104 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.566 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.3 OUTLIER -107.92 129.06 55.12 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.954 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.7 m -111.67 113.18 25.39 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.478 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 75.4 t90 -91.99 110.63 22.0 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.737 178.668 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -107.98 126.84 53.18 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.912 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.4 t -49.77 156.53 0.69 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.378 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.421 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 54.4 m -71.69 -38.04 70.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.433 0.635 . . . . 0.0 109.415 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -78.75 -9.99 59.62 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 114.897 -1.047 . . . . 0.0 111.184 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 69.77 42.38 70.77 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.276 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -101.98 -23.18 14.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.729 0.299 . . . . 0.0 111.262 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -168.19 153.85 6.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.385 0.612 . . . . 0.0 111.487 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.445 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.5 OUTLIER -140.97 155.47 21.74 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.072 -178.634 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.415 ' HB2' ' CE2' ' A' ' 9' ' ' PHE . 10.7 m-70 -131.2 121.96 25.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.491 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.42 127.23 42.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.0 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.566 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -113.11 138.94 40.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.16 -179.915 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.422 ' O ' HG12 ' A' ' 45' ' ' ILE . 44.5 t -103.86 95.85 4.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.067 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.405 ' N ' ' CD2' ' A' ' 42' ' ' LEU . 0.7 OUTLIER -41.8 -25.09 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.123 -0.489 . . . . 0.0 112.008 -178.905 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.435 ' HB3' ' CG ' ' A' ' 24' ' ' PRO . 2.1 t -76.07 -48.64 20.06 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 179.352 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.401 ' CG2' ' HB ' ' A' ' 41' ' ' VAL . 31.0 p -64.68 -27.89 69.23 Favored 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.407 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.541 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 41.6 mm -56.43 108.15 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.471 178.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.423 ' N ' ' O ' ' A' ' 63' ' ' ILE . 50.5 t0 -48.74 -34.03 11.37 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.807 0.337 . . . . 0.0 111.143 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.414 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 2.3 pttt -172.56 165.02 5.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.853 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 8.3 tp -109.03 119.19 38.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.76 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -115.72 147.13 41.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.413 179.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.466 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -157.03 149.11 22.83 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.79 -0.187 . . . . 0.0 110.969 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.1 p . . . . . 0 CA--C 1.53 0.18 0 CA-C-O 120.628 0.251 . . . . 0.0 110.819 -179.968 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.799 0.333 . . . . 0.0 110.504 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 46.2 mtm -149.6 143.03 25.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.755 -179.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.466 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 24.8 mt -121.78 145.19 48.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.205 178.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.441 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 14.8 ttm-85 -140.29 150.71 44.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.937 0.399 . . . . 0.0 111.6 -179.373 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.541 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.4 mp -128.07 117.75 22.22 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.958 178.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.465 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 21.4 mm -76.54 156.51 5.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.857 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.614 -179.806 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.476 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 11.7 p . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.854 0.359 . . . . 0.0 111.287 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -98.06 48.16 1.0 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.806 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.38 -20.41 54.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.262 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.0 m -59.33 -21.45 59.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.163 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.7 mmmt -72.82 -67.66 0.54 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.856 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.5 mttm 62.12 94.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.767 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.58 170.29 8.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.839 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -133.01 -166.7 1.8 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.737 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -138.32 -170.16 2.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.993 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -58.78 -21.28 55.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.303 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -110.25 29.09 7.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.01 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.63 26.17 38.14 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.639 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -62.44 -164.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.798 0.332 . . . . 0.0 110.934 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -133.45 115.41 14.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.581 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 90.1 t -86.98 -61.16 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.558 -179.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.5 ' O ' ' CG1' ' A' ' 81' ' ' VAL . 0.9 OUTLIER 40.85 95.98 0.04 OUTLIER Pre-proline 0 CA--C 1.536 0.414 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.128 179.904 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.457 ' HD2' ' HA ' ' A' ' 81' ' ' VAL . 9.6 Cg_endo -52.05 139.08 52.66 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.599 2.199 . . . . 0.0 112.398 -179.301 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.4 mmmm -69.09 155.97 92.49 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.946 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.476 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 2.3 Cg_endo . . . . . 0 N--CA 1.459 -0.534 0 C-N-CA 123.528 2.818 . . . . 0.0 112.444 -179.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.405 ' HG3' ' HA ' ' A' ' 63' ' ' ILE . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.509 0.195 . . . . 0.0 110.815 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.459 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 40.9 m-70 -94.05 111.42 23.14 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 179.423 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.25 110.97 22.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.993 0.425 . . . . 0.0 111.241 -179.282 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.5 ' CD1' ' CD1' ' A' ' 16' ' ' ILE . 96.2 m-85 -115.16 116.6 28.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.537 179.755 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.63 114.53 28.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.637 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.458 ' CZ ' ' HB1' ' A' ' 7' ' ' ALA . 3.7 m-85 -94.35 137.27 33.71 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.077 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -94.0 41.06 1.08 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.707 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.452 ' CB ' HG22 ' A' ' 96' ' ' VAL . 1.6 m-20 177.97 115.41 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.333 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.2 -16.47 13.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.829 179.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -73.19 -45.31 57.1 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-O 121.099 0.476 . . . . 0.0 110.12 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.452 HG22 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -65.24 -49.93 76.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.42 179.031 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.69 -36.24 82.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.49 179.523 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -70.43 -35.01 73.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.076 0.465 . . . . 0.0 110.191 179.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.404 ' O ' ' OG1' ' A' ' 103' ' ' THR . 73.1 m-20 -81.75 -27.48 33.79 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.468 179.418 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.45 HD12 HG22 ' A' ' 16' ' ' ILE . 1.3 mm -86.21 -59.19 2.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.959 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.432 ' HB2' HD22 ' A' ' 60' ' ' LEU . 6.5 ttmt -43.98 -31.05 0.81 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.193 -179.55 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.403 ' HG3' ' N ' ' A' ' 103' ' ' THR . 19.8 ptp -77.83 -39.75 42.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.352 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.497 ' HB ' ' CD1' ' A' ' 18' ' ' ILE . 0.3 OUTLIER -60.13 -52.42 65.43 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.794 179.654 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 9.5 mt -51.5 -59.45 4.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.369 179.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.432 ' NE2' ' O ' ' A' ' 101' ' ' LYS . 0.8 OUTLIER -60.49 -34.26 73.8 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.87 179.601 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -56.09 -36.22 67.89 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.232 0.539 . . . . 0.0 109.856 179.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.556 HG22 ' OH ' ' A' ' 111' ' ' TYR . 8.3 mt -85.76 -50.61 14.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.367 179.104 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.644 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.13 -56.4 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.427 179.433 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -46.26 -28.23 1.23 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.047 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.468 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 29.2 mtt180 -72.77 -25.04 61.03 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.346 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.644 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -76.34 -35.12 58.91 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 179.884 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.748 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.17 -44.01 18.5 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 178.954 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 54.7 t0 -61.87 -31.24 71.5 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 113.822 -1.535 . . . . 0.0 109.148 178.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.468 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.417 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.85 178.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.427 ' NE2' ' HB2' ' A' ' 20' ' ' GLU . 22.3 m170 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.613 0.244 . . . . 0.0 110.934 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.555 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 2.6 p -158.49 156.15 29.75 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.205 0.526 . . . . 0.0 111.295 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.493 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 172.75 139.44 2.85 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 110.898 -0.881 . . . . 0.0 110.898 -179.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.554 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -84.0 143.17 29.96 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.424 ' HB3' ' CD1' ' A' ' 91' ' ' PHE . . . -152.46 171.15 18.52 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.079 -179.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.471 ' N ' ' CD1' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.67 126.48 56.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-O 120.786 0.327 . . . . 0.0 111.715 -179.613 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.476 ' CE1' ' CD2' ' A' ' 38' ' ' HIS . 6.6 t80 -126.63 109.81 12.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.917 0.389 . . . . 0.0 111.128 178.388 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 3.8 mm-40 67.73 50.43 0.87 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.828 179.214 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.1 mttt 69.23 -3.42 1.55 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 179.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.423 HG12 ' CZ2' ' A' ' 29' ' ' TRP . 17.0 t -101.38 148.58 7.13 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 CA-C-O 121.097 0.475 . . . . 0.0 110.564 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.0 p -111.12 114.62 28.01 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.024 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -134.18 -133.99 3.38 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.953 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.554 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 18.8 mm -136.35 136.49 48.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.683 0.278 . . . . 0.0 111.34 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.516 ' CD1' ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.84 141.47 17.5 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.63 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 176.436 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.555 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.4 118.39 5.86 Favored 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.534 -178.608 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.498 ' HA ' ' HA ' ' A' ' 27' ' ' LEU . 4.8 mt -85.33 142.73 12.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 114.537 -1.21 . . . . 0.0 111.796 -178.696 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.485 ' O ' HG22 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -121.65 93.07 3.89 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.419 179.596 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.427 ' HB2' ' NE2' ' A' ' 3' ' ' HIS . 0.1 OUTLIER -81.19 1.09 33.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.532 -179.777 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -81.86 0.47 39.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.122 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.485 HG22 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -101.75 -161.99 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.801 0.334 . . . . 0.0 110.838 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.6 p -175.24 100.93 0.26 Allowed Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.455 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.442 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 10.5 Cg_exo -70.11 166.04 76.04 Favored 'Cis proline' 0 C--N 1.347 0.471 0 C-N-CA 123.55 -1.437 . . . . 0.0 112.512 0.296 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.04 176.99 0.27 Allowed 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.248 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.443 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 6.9 pt-20 -163.78 138.19 5.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.141 179.177 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.566 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.3 OUTLIER -107.76 149.05 28.66 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.874 -0.788 . . . . 0.0 108.874 178.86 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.3 m -133.84 112.58 11.44 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -178.272 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.524 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 76.8 t90 -92.11 110.68 22.06 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.258 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.411 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.1 ptp180 -112.13 133.44 54.27 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.718 0.294 . . . . 0.0 110.761 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 25.4 m -49.82 161.02 0.26 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.593 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 53.5 m -74.22 -37.78 63.75 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.404 0.621 . . . . 0.0 109.659 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.72 -17.29 41.76 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.041 179.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.81 33.74 10.83 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.367 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -83.83 -27.85 28.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.714 0.292 . . . . 0.0 111.258 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.96 161.49 5.72 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.283 0.564 . . . . 0.0 111.348 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.524 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.69 140.82 22.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.036 -178.709 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.476 ' CD2' ' CE1' ' A' ' 9' ' ' PHE . 89.4 m-70 -114.58 121.25 42.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.683 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.54 140.94 30.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.842 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.566 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -127.79 140.47 49.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.329 -179.673 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.424 ' O ' HG12 ' A' ' 45' ' ' ILE . 41.1 t -103.95 95.94 4.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 177.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.401 ' CD1' HD21 ' A' ' 104' ' ' LEU . 0.7 OUTLIER -42.27 -23.83 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.972 -178.955 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.442 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -76.42 -48.32 20.13 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.255 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 38.9 p -64.53 -27.89 69.28 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 178.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.536 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 48.4 mm -56.9 108.49 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.582 178.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.414 ' N ' ' O ' ' A' ' 63' ' ' ILE . 8.3 t70 -51.93 -33.77 38.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.871 0.367 . . . . 0.0 110.819 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.8 pttt -171.23 165.04 7.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.703 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.415 ' CD1' HD13 ' A' ' 104' ' ' LEU . 16.6 tp -108.82 122.47 47.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.85 -179.554 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -115.49 141.56 47.89 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.473 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.477 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -157.06 141.15 16.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.075 -179.739 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 44.6 p . . . . . 0 CA--C 1.53 0.174 0 CA-C-N 116.607 -0.27 . . . . 0.0 111.09 -179.96 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.722 0.296 . . . . 0.0 110.857 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.1 mpp? -149.88 138.52 20.81 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.93 0.395 . . . . 0.0 111.996 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.477 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 15.5 mt -120.0 140.73 50.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.615 178.246 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.467 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 13.0 ttm180 -143.38 151.67 40.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.032 0.444 . . . . 0.0 112.126 -178.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.536 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.5 mp -128.52 117.63 21.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.95 178.491 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.485 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 14.2 mm -76.66 156.43 5.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.718 -0.219 . . . . 0.0 110.805 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.243 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.531 -179.977 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.515 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 9.8 p . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.584 0.23 . . . . 0.0 110.771 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -132.75 36.92 3.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.741 0.305 . . . . 0.0 111.44 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 43.08 29.89 0.23 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.323 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 36.3 m -94.26 -28.15 15.76 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.974 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.6 mmtm -57.06 -79.88 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.708 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.0 mtpt 55.37 89.82 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.2 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.77 121.19 40.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.589 179.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -74.39 150.59 39.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.068 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -97.58 -166.19 1.35 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.833 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -65.72 -15.44 62.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.346 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -113.11 14.22 19.47 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.685 -0.234 . . . . 0.0 111.399 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.91 40.46 72.73 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.501 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -84.65 3.09 38.66 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.844 0.312 . . . . 0.0 111.844 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 79' ' ' GLU . 10.3 pt-20 42.24 97.2 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.09 0.472 . . . . 0.0 112.022 179.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 13.9 t -109.83 157.66 10.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.721 -179.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 52.8 t -111.92 82.24 4.01 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.326 179.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -42.1 149.49 0.29 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.933 2.422 . . . . 0.0 112.954 -179.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -46.1 168.61 0.11 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.521 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.515 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 8.1 Cg_exo . . . . . 0 N--CA 1.464 -0.223 0 C-N-CA 123.705 2.937 . . . . 0.0 112.403 -178.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.411 ' CG ' ' CD1' ' A' ' 63' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.602 0.239 . . . . 0.0 111.028 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.479 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 37.8 m-70 -96.5 111.18 23.39 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.283 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.28 128.01 42.81 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.076 0.465 . . . . 0.0 111.637 -178.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.516 ' CD2' ' CD1' ' A' ' 16' ' ' ILE . 58.5 m-85 -132.15 116.57 17.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.481 179.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.447 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -91.61 115.04 27.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.953 0.406 . . . . 0.0 110.632 179.867 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.453 ' CD2' ' HB ' ' A' ' 96' ' ' VAL . 2.8 m-85 -91.53 137.72 32.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.162 -179.522 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 22.5 m-20 -102.04 34.87 2.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.743 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.425 ' HB3' ' CG2' ' A' ' 96' ' ' VAL . 10.3 t30 179.14 123.42 0.05 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.943 -179.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.522 ' HA ' ' HG3' ' A' ' 97' ' ' MET . 2.8 mmm-85 -61.85 -14.41 33.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.547 179.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -71.72 -51.14 24.38 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 121.029 0.442 . . . . 0.0 110.352 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.453 ' HB ' ' CD2' ' A' ' 91' ' ' PHE . 0.2 OUTLIER -56.94 -45.28 83.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.624 179.415 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.522 ' HG3' ' HA ' ' A' ' 94' ' ' ARG . 1.0 OUTLIER -57.14 -48.97 77.36 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.584 178.877 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.448 ' O ' ' HB2' ' A' ' 102' ' ' MET . 12.1 t70 -52.87 -32.94 47.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.378 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -82.52 -57.07 3.51 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.09 179.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.443 HD13 ' N ' ' A' ' 5' ' ' GLY . 11.3 mm -65.08 -60.45 2.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.958 -179.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.419 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 5.6 ttmt -50.18 -37.84 36.87 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.493 -178.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.448 ' HB2' ' O ' ' A' ' 98' ' ' ASP . 14.4 mtm -80.04 -27.16 39.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.037 -179.663 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -81.75 -31.71 31.83 Favored 'General case' 0 N--CA 1.443 -0.793 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.415 HD13 ' CD1' ' A' ' 48' ' ' LEU . 45.2 mt -65.1 -57.45 8.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.882 179.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.419 ' NE2' ' O ' ' A' ' 101' ' ' LYS . 0.1 OUTLIER -63.43 -34.06 76.92 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.932 179.562 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -52.31 -36.78 54.1 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.348 0.594 . . . . 0.0 109.829 179.332 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.582 HG21 ' OH ' ' A' ' 111' ' ' TYR . 12.1 mt -85.84 -51.71 12.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.049 178.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.63 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.63 -57.54 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.326 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.259 179.17 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 10.9 m -47.49 -26.29 1.34 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.027 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.451 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 73.5 mtt180 -73.64 -25.04 60.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.265 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.63 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -75.49 -34.9 60.9 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.734 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.766 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.47 -43.31 17.38 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 178.923 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -61.45 -31.54 71.5 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.875 -1.511 . . . . 0.0 109.092 178.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.451 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.44 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.611 178.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.454 ' O ' ' N ' ' A' ' 18' ' ' ILE . 30.6 m170 . . . . . 0 CA--C 1.53 0.193 0 N-CA-C 111.381 0.141 . . . . 0.0 111.381 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.464 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 2.0 p -143.73 158.4 43.7 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.982 0.42 . . . . 0.0 111.011 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 172.26 141.58 3.46 Favored Glycine 0 C--O 1.225 -0.435 0 N-CA-C 110.909 -0.876 . . . . 0.0 110.909 -179.467 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.556 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -84.87 147.06 26.98 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.639 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.435 ' CB ' ' HB3' ' A' ' 89' ' ' PHE . . . -156.14 171.13 20.69 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.202 -179.14 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.492 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.93 122.98 54.81 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 N-CA-C 111.817 0.302 . . . . 0.0 111.817 -179.556 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.483 ' CE1' ' CD2' ' A' ' 38' ' ' HIS . 5.7 t80 -121.86 108.65 13.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.983 0.421 . . . . 0.0 111.111 178.411 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 61.0 mt-10 67.43 48.95 1.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.911 179.016 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.7 mttm 73.28 -5.31 1.99 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 179.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.418 HG13 ' CZ2' ' A' ' 29' ' ' TRP . 18.6 t -101.13 148.67 6.9 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.514 0 CA-C-O 121.114 0.483 . . . . 0.0 110.534 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -111.76 112.71 24.59 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.067 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -131.57 -132.31 3.35 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.933 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.556 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 17.8 mm -136.64 136.4 48.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.708 0.289 . . . . 0.0 111.345 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.499 ' CD1' ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.86 140.95 18.47 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 N-CA-C 106.246 -1.761 . . . . 0.0 106.246 176.56 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . 0.464 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.6 118.18 5.72 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.565 -0.854 . . . . 0.0 111.695 -178.454 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.507 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 48.3 mt -84.06 142.94 12.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 114.623 -1.171 . . . . 0.0 112.155 -178.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.476 ' O ' HG22 ' A' ' 22' ' ' VAL . 2.4 t-20 -118.84 92.52 3.83 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.653 178.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -82.85 0.67 42.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.601 -179.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -82.53 1.57 37.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.76 0.314 . . . . 0.0 111.066 179.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.476 HG22 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -106.05 -163.03 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.825 -179.779 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.4 t -175.31 102.9 0.26 Allowed Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.32 179.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.45 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 9.4 Cg_exo -70.5 161.71 87.76 Favored 'Cis proline' 0 C--N 1.347 0.46 0 C-N-CA 123.614 -1.411 . . . . 0.0 112.678 0.348 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.4 179.4 0.05 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.403 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.46 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.58 135.89 5.13 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.174 179.091 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.56 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.3 OUTLIER -107.92 138.42 44.19 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.958 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.4 ' CG2' ' CG2' ' A' ' 37' ' ' VAL . 1.0 OUTLIER -123.14 112.31 17.57 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -178.263 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.525 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 77.9 t90 -91.97 110.7 22.06 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 178.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' A' ' 15' ' ' ILE . 8.4 ptm180 -112.25 132.87 54.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.751 0.31 . . . . 0.0 110.916 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 8.4 t -50.02 161.71 0.24 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.692 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 54.6 m -75.38 -37.81 60.36 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.322 0.582 . . . . 0.0 109.759 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -83.4 -16.06 47.36 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.125 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.66 34.34 11.74 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.303 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -85.28 -26.37 26.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.717 0.294 . . . . 0.0 111.398 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.36 162.11 5.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.327 0.584 . . . . 0.0 111.449 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.525 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.9 OUTLIER -145.65 140.45 21.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.811 -178.826 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.483 ' CD2' ' CE1' ' A' ' 9' ' ' PHE . 29.5 m-70 -116.2 120.58 39.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.785 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.45 135.62 38.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.851 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.56 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -122.76 140.74 45.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.349 -179.527 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.429 ' O ' HG12 ' A' ' 45' ' ' ILE . 21.4 t -103.98 95.45 3.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 177.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.429 ' CB ' ' OH ' ' A' ' 111' ' ' TYR . 0.7 OUTLIER -41.95 -23.76 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.882 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.45 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -76.97 -48.64 17.47 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.344 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 33.5 p -64.61 -26.82 68.56 Favored 'General case' 0 N--CA 1.441 -0.875 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 178.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.554 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 48.0 mm -56.57 108.66 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.602 178.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.426 ' N ' ' O ' ' A' ' 63' ' ' ILE . 3.7 t0 -53.32 -30.97 41.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.808 0.337 . . . . 0.0 111.011 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.423 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 5.1 ptpt -172.55 162.99 5.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.02 0.438 . . . . 0.0 110.878 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.437 HD23 ' HB2' ' A' ' 104' ' ' LEU . 12.0 tp -109.03 116.47 32.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.619 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.85 146.59 37.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.589 0.233 . . . . 0.0 110.627 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.475 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -157.05 148.57 22.28 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.116 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 37.2 p . . . . . 0 C--N 1.332 -0.18 0 CA-C-O 120.676 0.274 . . . . 0.0 111.117 -179.81 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.432 ' HB3' ' HG2' ' A' ' 97' ' ' MET . 2.4 mpp? . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.782 0.325 . . . . 0.0 111.175 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 53.7 mtm -149.91 142.35 24.35 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.999 0.428 . . . . 0.0 111.716 -179.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.475 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 20.6 mt -122.07 143.46 49.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.155 178.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.405 ' HG3' ' O ' ' A' ' 87' ' ' HIS . 53.3 ttp180 -143.61 152.71 41.72 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 -178.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.554 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.3 mp -127.95 116.24 19.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.637 178.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.451 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 23.2 mm -76.54 156.68 5.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.701 0.286 . . . . 0.0 111.38 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.274 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.301 179.913 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.473 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 13.5 p . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.824 0.345 . . . . 0.0 111.141 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.62 66.53 0.74 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.689 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -64.13 -16.2 61.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.416 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.2 m -101.03 29.53 4.59 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.767 0.318 . . . . 0.0 110.858 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.9 mmmt -115.21 -63.15 1.5 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.905 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.8 mttm 61.63 95.36 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.53 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.42 124.74 47.58 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.129 -179.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.1 mmtt -80.12 170.26 16.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.878 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -122.58 -172.16 2.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.879 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -68.01 -21.27 65.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.163 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -100.88 27.64 5.83 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.002 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.42 26.48 51.61 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.632 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 19.4 m-20 -93.59 115.16 27.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.815 0.341 . . . . 0.0 110.907 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -76.11 115.15 15.54 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.729 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 13.8 t -115.46 120.08 63.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.748 -179.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.472 ' O ' ' CG1' ' A' ' 81' ' ' VAL . 11.6 p -101.66 96.76 6.8 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.973 179.052 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -36.26 151.34 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.068 2.512 . . . . 0.0 113.257 -178.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.0 mttp -104.36 169.63 7.01 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.131 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.473 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 2.8 Cg_exo . . . . . 0 N--CA 1.461 -0.408 0 C-N-CA 123.694 2.929 . . . . 0.0 112.259 -178.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.637 0.256 . . . . 0.0 110.495 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.492 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 6.4 m-70 -95.39 111.0 22.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.798 0.332 . . . . 0.0 110.318 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -101.37 141.79 33.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.357 -179.369 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.499 ' CD2' ' CD1' ' A' ' 16' ' ' ILE . 5.1 m-85 -140.96 116.93 10.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.063 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.434 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -87.01 115.29 24.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.417 179.566 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.44 ' CE2' ' HA ' ' A' ' 97' ' ' MET . 8.9 m-85 -89.12 134.67 33.92 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.398 -179.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 22.4 m-20 -98.75 28.87 4.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.467 179.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -175.47 114.32 0.14 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.555 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.445 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.1 OUTLIER -56.52 -17.63 9.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.997 179.767 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -72.3 -50.32 27.9 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 120.887 0.375 . . . . 0.0 110.43 179.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -65.88 -41.95 91.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.675 179.241 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.469 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -66.74 -37.82 85.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.927 179.317 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.469 ' N ' ' HG3' ' A' ' 97' ' ' MET . 29.2 t70 -62.61 -29.48 70.63 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.858 178.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.434 ' O ' ' OG1' ' A' ' 103' ' ' THR . 9.0 m-80 -81.9 -65.58 0.99 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.363 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.457 HD13 ' N ' ' A' ' 5' ' ' GLY . 15.2 mm -46.53 -56.29 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 CA-C-O 121.148 0.499 . . . . 0.0 110.763 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.415 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 17.5 ttpp -48.07 -42.43 28.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.982 179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.472 ' HG2' ' N ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -75.18 -39.4 60.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.332 179.903 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.507 ' HB ' ' CD1' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -60.0 -50.73 72.61 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.815 179.785 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.437 ' HB2' HD23 ' A' ' 48' ' ' LEU . 6.4 mt -53.36 -59.07 5.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.258 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.415 ' NE2' ' O ' ' A' ' 101' ' ' LYS . 0.7 OUTLIER -60.22 -33.66 72.57 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.654 179.524 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -56.4 -36.48 68.95 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 121.338 0.59 . . . . 0.0 109.44 178.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.589 HG23 ' OH ' ' A' ' 111' ' ' TYR . 6.9 mt -85.79 -51.65 13.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.002 178.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.637 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.38 -57.41 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.138 179.187 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 75.4 m -47.09 -26.03 0.99 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.162 179.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.449 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 71.0 mtt-85 -74.26 -25.05 59.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.146 179.744 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.637 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -75.85 -35.09 60.05 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.875 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.753 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.18 -43.69 18.96 Favored 'General case' 0 CA--C 1.506 -0.744 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 179.027 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -61.78 -31.33 71.52 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 113.862 -1.517 . . . . 0.0 109.064 178.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . 0.449 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.457 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.64 178.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo . . . . . 0 N--CA 1.49 1.276 0 CA-C-O 121.17 0.404 . . . . 0.0 111.973 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.4 m -60.75 -31.36 70.7 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.901 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.403 ' HA ' HG22 ' A' ' 103' ' ' THR . 33.8 m80 -92.6 28.16 2.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.164 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.521 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 11.3 p -161.2 152.24 18.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.281 0.563 . . . . 0.0 111.111 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.42 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 173.95 137.76 2.51 Favored Glycine 0 N--CA 1.448 -0.509 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.56 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -80.86 145.47 31.35 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -178.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.42 ' HB3' ' CZ ' ' A' ' 91' ' ' PHE . . . -151.98 171.18 18.23 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.358 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.491 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -103.54 122.01 55.63 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.652 -179.668 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.455 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 4.6 t80 -120.75 106.98 12.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.877 0.37 . . . . 0.0 111.201 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.424 ' HG2' ' CD1' ' A' ' 9' ' ' PHE . 41.9 mm-40 67.98 49.09 0.92 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.864 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.4 mttp 72.25 -3.76 2.2 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.417 HG11 ' CZ2' ' A' ' 29' ' ' TRP . 19.9 t -101.21 150.3 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 CA-C-O 121.074 0.464 . . . . 0.0 110.458 179.563 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 95.8 p -107.12 114.86 29.18 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.877 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -134.0 -155.98 7.77 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.028 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.56 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 16.6 mm -122.83 131.96 72.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.872 0.367 . . . . 0.0 111.375 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.47 HG23 ' O ' ' A' ' 16' ' ' ILE . 0.4 OUTLIER -100.94 113.67 37.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 177.752 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.521 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -122.18 116.61 24.48 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.553 0.692 . . . . 0.0 110.854 -179.177 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.515 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 17.5 mt -82.63 142.53 13.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 114.721 -1.127 . . . . 0.0 112.338 -178.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.489 ' O ' HG23 ' A' ' 22' ' ' VAL . 2.4 m120 -117.4 92.84 3.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.026 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.64 -0.3 46.51 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.353 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -83.38 1.3 42.02 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.442 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.489 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -100.87 -162.56 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.908 0.385 . . . . 0.0 110.988 -179.998 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 t -177.98 101.05 0.22 Allowed Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.168 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.412 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 15.7 Cg_exo -66.34 161.62 73.7 Favored 'Cis proline' 0 C--N 1.346 0.408 0 C-N-CA 123.46 -1.475 . . . . 0.0 112.608 0.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.421 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -55.29 -172.38 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.872 179.472 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -163.27 142.15 8.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.486 0.66 . . . . 0.0 112.352 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.675 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 3.0 tt -108.37 149.13 29.12 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.829 -1.078 . . . . 0.0 108.744 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -146.35 104.11 3.76 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -178.798 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.476 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 83.3 t90 -92.06 110.54 21.91 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.777 178.356 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.426 ' O ' ' N ' ' A' ' 15' ' ' ILE . 42.8 ttt180 -109.66 131.18 55.3 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.777 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.3 t -49.85 155.99 0.79 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.688 0.28 . . . . 0.0 110.597 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.6 m -74.08 -34.63 64.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.317 0.579 . . . . 0.0 109.843 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -87.12 -16.58 35.07 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.054 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.78 33.75 10.86 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.333 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -86.9 -25.02 24.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.673 0.273 . . . . 0.0 111.476 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.17 164.22 2.7 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.285 0.564 . . . . 0.0 111.491 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.476 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.7 OUTLIER -145.64 147.93 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.961 -178.851 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.428 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 58.2 m80 -122.72 120.76 34.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.654 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.46 145.06 26.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.77 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.675 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.1 t -128.49 139.03 52.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.624 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.421 ' O ' HG12 ' A' ' 45' ' ' ILE . 23.0 t -104.0 94.22 3.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 177.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.447 HD21 ' CG1' ' A' ' 40' ' ' VAL . 0.6 OUTLIER -42.22 -22.85 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.212 -0.449 . . . . 0.0 112.027 -178.783 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.412 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -76.79 -49.75 15.12 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.954 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 30.2 p -64.94 -28.22 69.38 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 178.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.573 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 31.3 mm -56.4 105.73 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.548 178.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -51.8 -31.72 28.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.188 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.406 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 3.2 pttt -172.61 166.94 5.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.574 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 11.9 tp -109.0 121.87 46.06 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.047 -179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.427 ' O ' ' N ' ' A' ' 61' ' ' ARG . 25.2 mm100 -110.41 138.34 46.93 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.289 179.495 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.472 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -156.85 140.27 15.75 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.61 0.243 . . . . 0.0 111.05 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 33.5 p -50.16 140.36 17.05 Favored Pre-proline 0 CA--C 1.53 0.184 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.895 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -65.37 163.21 30.36 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.598 2.198 . . . . 0.0 112.53 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -71.63 -30.59 65.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.194 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.3 p -70.61 -21.86 62.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.913 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 70.0 m -97.03 119.17 35.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.868 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 21.0 mp0 -55.26 -18.99 7.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.499 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -55.17 125.51 20.91 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.894 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -109.51 93.3 4.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.732 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.412 ' HE1' ' CE1' ' B' ' 670' ' ' PHE . 3.5 mpp? -149.64 138.65 21.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.656 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.475 HD21 ' HB2' ' A' ' 101' ' ' LYS . 39.0 mt -124.8 149.83 46.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.29 178.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.427 ' N ' ' O ' ' A' ' 49' ' ' GLN . 11.0 mtp180 -151.02 156.0 40.22 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.938 0.399 . . . . 0.0 111.604 -179.533 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.573 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.5 mp -127.9 118.72 24.15 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.106 178.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.406 ' HB ' ' HG2' ' A' ' 47' ' ' LYS . 6.6 mm -77.29 153.93 5.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.775 0.321 . . . . 0.0 111.049 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -118.49 138.6 13.87 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.494 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.8 ptpm? -57.09 122.61 12.79 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.875 0.369 . . . . 0.0 110.903 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.486 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 13.3 p -99.93 159.76 3.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.417 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -99.9 47.45 0.94 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.588 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -68.32 -11.39 59.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.478 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.3 m -53.98 -25.1 19.2 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.853 0.358 . . . . 0.0 111.087 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 42.3 mmtt -77.17 -70.18 0.48 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.668 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.9 ptmt 42.63 81.43 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.363 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.403 ' CD ' ' N ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -145.47 -174.16 4.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.052 -179.945 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.418 ' HG3' ' O ' ' A' ' 78' ' ' ASN . 6.2 mptt -102.8 -171.29 1.93 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.959 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -113.94 -36.51 4.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.017 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 167.89 -30.3 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.149 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -97.02 29.21 3.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.238 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 61.72 16.9 52.82 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.841 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.418 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 15.5 m-20 -67.2 -152.61 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -153.28 118.97 5.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.769 0.319 . . . . 0.0 110.826 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.2 t -94.38 -66.9 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.439 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.418 ' O ' HG12 ' A' ' 81' ' ' VAL . 5.0 p 33.15 80.2 0.26 Allowed Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.639 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -41.66 124.56 2.6 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 123.005 2.47 . . . . 0.0 112.844 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 31.4 mttt -73.21 159.9 83.94 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.908 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.486 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.3 Cg_exo -83.26 149.77 13.41 Favored 'Trans proline' 0 N--CA 1.46 -0.484 0 C-N-CA 123.52 2.814 . . . . 0.0 112.384 -179.045 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -112.83 115.93 29.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.916 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -123.11 137.53 54.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.768 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.497 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 7.5 m-70 -92.04 111.57 23.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.401 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 12.2 ttt -98.99 134.26 42.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.148 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.47 ' HA ' ' O ' ' A' ' 8' ' ' ILE . 2.7 m-85 -136.04 122.36 20.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.792 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.8 114.28 26.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.884 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.42 ' CZ ' ' HB3' ' A' ' 7' ' ' ALA . 11.1 m-85 -91.35 145.18 24.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.88 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -99.24 34.83 2.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.605 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.433 ' CB ' HG23 ' A' ' 96' ' ' VAL . 1.1 m-20 -178.99 118.06 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.609 -179.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.416 ' HA ' ' CG ' ' A' ' 97' ' ' MET . 0.7 OUTLIER -60.06 -15.38 22.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.691 179.477 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.13 -43.07 58.88 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.066 0.46 . . . . 0.0 110.024 179.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.433 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -65.93 -51.76 57.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.295 179.061 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.416 ' CG ' ' HA ' ' A' ' 94' ' ' ARG . 0.5 OUTLIER -61.49 -36.32 80.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.285 179.372 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -66.59 -34.23 77.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.112 0.482 . . . . 0.0 110.086 179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.418 ' O ' ' OG1' ' A' ' 103' ' ' THR . 53.4 m-20 -81.82 -26.43 34.34 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.531 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.444 HD13 HG23 ' A' ' 16' ' ' ILE . 2.2 mm -86.15 -59.79 2.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.088 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.475 ' HB2' HD21 ' A' ' 60' ' ' LEU . 9.9 ttmt -44.51 -30.32 0.86 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.168 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.411 ' HG3' ' N ' ' A' ' 103' ' ' THR . 19.8 ptp -78.86 -39.29 35.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.326 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.515 ' HB ' ' CD1' ' A' ' 18' ' ' ILE . 0.3 OUTLIER -58.4 -60.07 4.36 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.846 179.737 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.412 HD11 HG23 ' A' ' 100' ' ' ILE . 2.7 mt -48.0 -57.43 5.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.912 179.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.13 -41.43 79.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.969 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -54.67 -35.04 63.14 Favored 'General case' 0 C--O 1.231 0.132 0 CA-C-O 121.165 0.507 . . . . 0.0 110.337 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.581 HG23 ' OH ' ' A' ' 111' ' ' TYR . 11.9 mt -85.74 -51.03 13.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.468 179.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.626 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -42.45 -58.13 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.486 179.356 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -47.13 -27.52 1.44 Allowed 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.296 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.463 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 0.0 OUTLIER -73.38 -24.67 60.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.001 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.626 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.2 OUTLIER -74.59 -34.96 62.98 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.425 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.78 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.63 -43.32 17.11 Favored 'General case' 0 CA--C 1.504 -0.804 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 179.38 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.31 -32.06 72.75 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 113.973 -1.467 . . . . 0.0 108.99 178.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.463 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.69 -18.16 23.34 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.64 178.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 36.1 t0 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.236 -0.888 . . . . 0.0 111.127 179.914 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 36.2 t70 . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.858 0.361 . . . . 0.0 111.17 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -115.09 -38.38 3.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.906 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -177.36 95.67 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.929 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 11.0 p -142.64 59.89 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.045 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 665' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -132.26 -165.61 1.62 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.88 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 666' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -169.45 92.78 0.26 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.776 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 667' ' ' GLU . . . . . 0.428 ' HA ' ' CD1' ' B' ' 670' ' ' PHE . 0.3 OUTLIER -94.1 19.09 9.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.18 0.514 . . . . 0.0 111.641 -179.947 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -105.83 -19.96 13.59 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.248 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.5 pp -100.28 19.9 15.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.311 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 670' ' ' PHE . . . . . 0.428 ' CD1' ' HA ' ' B' ' 667' ' ' GLU . 7.7 m-85 -78.75 140.63 38.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.861 0.362 . . . . 0.0 110.903 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -126.68 171.07 11.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.878 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 16.3 p-10 -104.14 131.93 50.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.918 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 673' ' ' VAL . . . . . 0.441 ' CG1' ' HB1' ' A' ' 50' ' ' ALA . 12.0 m -75.13 155.61 86.21 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.044 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -71.1 128.26 14.58 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.521 2.147 . . . . 0.0 112.605 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.06 126.25 21.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.566 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 10.7 mttm -48.34 155.97 0.45 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.213 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 49.6 m 61.58 155.25 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.915 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 52.3 mm-40 -148.06 85.84 1.55 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.876 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 3.9 mt -95.75 43.28 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.051 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 1.8 t . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.926 179.97 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo . . . . . 0 N--CA 1.488 1.193 0 CA-C-O 120.794 0.247 . . . . 0.0 111.638 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.4 p -96.39 -37.55 10.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.88 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.5 m170 -92.97 12.81 22.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.221 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.55 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 49.7 p -156.3 152.85 28.18 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.193 0.52 . . . . 0.0 111.503 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.524 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . -174.91 179.93 45.9 Favored Glycine 0 N--CA 1.448 -0.562 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.519 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -120.6 129.27 53.68 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 117.738 0.769 . . . . 0.0 111.459 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.434 ' HB3' ' CE1' ' A' ' 91' ' ' PHE . . . -141.41 171.15 14.45 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.889 -178.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.463 ' N ' ' CD1' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -100.61 121.92 51.98 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.018 179.853 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.468 ' CB ' ' CE2' ' A' ' 29' ' ' TRP . 0.7 OUTLIER -120.26 106.02 11.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.03 0.443 . . . . 0.0 111.86 179.531 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 68.16 52.71 0.65 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.562 178.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 71.19 -4.25 1.85 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.913 179.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.424 HG13 ' CZ2' ' A' ' 29' ' ' TRP . 25.2 t -103.52 148.56 8.34 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.566 0 CA-C-O 121.239 0.542 . . . . 0.0 110.527 179.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.444 ' HA ' HD13 ' A' ' 8' ' ' ILE . 1.0 OUTLIER -115.32 113.76 24.25 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.086 -179.962 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.435 ' HA3' ' HA ' ' A' ' 31' ' ' SER . . . -133.63 -122.22 2.27 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.922 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.519 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 18.7 mm -141.74 136.58 31.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.766 0.317 . . . . 0.0 111.146 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.55 HG13 ' HD1' ' A' ' 29' ' ' TRP . 0.3 OUTLIER -100.82 141.76 16.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 106.301 -1.74 . . . . 0.0 106.301 176.543 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.55 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.32 115.73 5.09 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.393 -0.923 . . . . 0.0 111.55 -178.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.453 ' HA ' ' HA ' ' A' ' 27' ' ' LEU . 5.0 mt -86.68 132.3 32.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.908 -178.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.476 ' O ' HG21 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -110.72 92.82 4.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.265 179.45 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -81.39 0.51 37.06 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.517 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -82.55 0.69 41.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.259 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.476 HG21 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -101.9 -162.93 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.885 0.374 . . . . 0.0 110.88 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.3 p -174.75 101.51 0.27 Allowed Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.333 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.429 ' HB3' ' HB3' ' A' ' 43' ' ' SER . 11.3 Cg_exo -69.52 166.34 73.67 Favored 'Cis proline' 0 C--N 1.347 0.474 0 C-N-CA 123.604 -1.415 . . . . 0.0 112.562 0.467 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -61.07 176.67 0.4 Allowed 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.143 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.464 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.78 135.07 4.65 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.24 179.326 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.532 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.3 OUTLIER -107.96 129.43 55.11 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.88 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -113.36 110.41 20.29 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -178.653 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.55 ' HD1' HG13 ' A' ' 16' ' ' ILE . 72.7 t90 -91.77 113.56 25.86 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.472 ' O ' ' N ' ' A' ' 15' ' ' ILE . 2.6 ptm180 -114.21 134.61 54.8 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.914 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.435 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 0.2 OUTLIER -49.9 168.5 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.47 179.868 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 54.8 m -76.98 -39.08 51.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.347 0.594 . . . . 0.0 109.903 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -84.85 -14.91 46.49 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.178 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.81 33.89 12.09 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.383 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -83.19 -29.84 28.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.752 0.311 . . . . 0.0 111.332 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.0 157.54 18.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.344 0.592 . . . . 0.0 111.349 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.55 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.9 OUTLIER -145.73 130.34 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.718 -178.823 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.461 ' CB ' ' CE2' ' A' ' 9' ' ' PHE . 2.7 m80 -107.71 122.76 47.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.944 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.51 129.83 43.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.794 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.532 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -117.4 139.9 42.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.338 -179.649 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.406 ' O ' HG12 ' A' ' 45' ' ' ILE . 2.8 t -103.88 95.86 4.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 177.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.426 ' CB ' ' OH ' ' A' ' 111' ' ' TYR . 0.6 OUTLIER -42.13 -24.8 0.05 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.062 -178.919 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.429 ' HB3' ' HB3' ' A' ' 24' ' ' PRO . 3.1 p -74.94 -48.75 22.87 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 179.236 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 44.9 p -64.71 -28.01 69.31 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.531 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 33.8 mm -57.15 105.69 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.533 178.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.474 ' N ' ' O ' ' A' ' 63' ' ' ILE . 2.6 t0 -47.87 -33.55 7.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.805 0.336 . . . . 0.0 111.071 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -172.47 163.39 5.48 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.805 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 14.0 tp -109.11 124.85 51.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.01 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 -119.99 144.93 47.23 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.611 179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.475 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -157.06 147.88 21.63 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.7 -0.227 . . . . 0.0 110.793 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 71.2 p -75.04 146.19 82.0 Favored Pre-proline 0 C--N 1.333 -0.135 0 CA-C-O 120.741 0.305 . . . . 0.0 111.144 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.3 163.35 32.62 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.681 2.254 . . . . 0.0 112.446 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -54.47 -23.93 18.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.419 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.7 t -70.69 -16.17 62.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.416 -0.357 . . . . 0.0 111.214 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 11.7 m -73.86 121.44 20.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.902 0.382 . . . . 0.0 110.995 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -63.87 -11.29 26.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.696 179.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.411 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -138.63 85.44 2.08 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.064 0.459 . . . . 0.0 111.174 179.825 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.417 ' HB2' ' HG2' ' A' ' 97' ' ' MET . 1.0 OUTLIER -47.52 134.89 11.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.698 -179.812 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.411 ' HG3' ' O ' ' A' ' 57' ' ' LYS . 24.0 mtm -150.09 138.52 20.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.432 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.475 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 20.9 mt -117.8 142.19 47.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.225 178.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.445 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 13.8 ttm180 -142.51 150.01 39.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.984 0.421 . . . . 0.0 111.846 -179.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.531 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.5 mp -128.4 117.32 21.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.949 178.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.474 ' O ' ' N ' ' A' ' 46' ' ' ASP . 10.3 mm -76.47 146.07 9.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.764 -179.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -108.7 148.59 16.86 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.386 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.5 mttt -58.01 114.74 2.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.873 0.368 . . . . 0.0 110.936 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 13.2 p -102.41 159.93 4.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.258 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -101.13 39.39 1.41 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.772 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.41 -23.03 64.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.113 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.1 t -60.39 -20.41 59.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.105 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt -83.24 -67.32 0.8 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.867 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 28.3 mttt 60.17 92.35 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.764 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.74 -179.02 4.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.065 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.8 mttp -131.82 -167.2 1.83 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.708 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -136.86 -178.67 5.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.893 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -57.32 -22.09 39.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.408 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -108.73 34.8 3.48 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.855 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 55.22 25.22 39.23 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.558 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -67.42 -169.95 0.12 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.797 0.332 . . . . 0.0 110.903 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -136.62 122.01 19.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.637 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.6 t -91.1 -64.91 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.357 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.417 ' O ' HG12 ' A' ' 81' ' ' VAL . 4.4 p 34.85 78.09 0.35 Allowed Pre-proline 0 CA--C 1.531 0.212 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.958 179.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -42.73 125.31 3.79 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 123.125 2.55 . . . . 0.0 112.648 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.408 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -60.59 161.42 14.53 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.076 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 5.0 Cg_exo -83.61 153.38 13.52 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 123.578 2.852 . . . . 0.0 112.363 -179.152 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -111.16 114.03 26.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.902 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.03 146.44 45.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.734 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.47 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 31.4 m-70 -96.87 112.56 24.26 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.447 ' CE ' ' CZ ' ' B' ' 670' ' ' PHE . 0.0 OUTLIER -94.09 119.17 32.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.97 0.414 . . . . 0.0 111.391 -179.236 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.468 ' CD1' ' CD1' ' A' ' 16' ' ' ILE . 89.7 m-85 -122.94 116.75 24.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.58 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.403 ' HA ' ' HG2' ' A' ' 59' ' ' MET . 0.4 OUTLIER -101.52 114.57 28.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.785 0.326 . . . . 0.0 110.628 179.936 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.434 ' CE1' ' HB3' ' A' ' 7' ' ' ALA . 30.7 m-85 -93.5 152.63 18.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.371 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -110.39 28.47 8.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.603 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.427 ' CB ' HG21 ' A' ' 96' ' ' VAL . 9.0 m-20 -171.59 112.16 0.33 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.635 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.417 ' O ' ' HG3' ' A' ' 97' ' ' MET . 2.5 ttp85 -55.87 -19.48 11.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.911 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.22 -47.35 61.81 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.684 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.434 HG12 ' HA3' ' A' ' 5' ' ' GLY . 0.2 OUTLIER -66.67 -46.1 86.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.959 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.456 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -63.27 -36.35 83.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.918 179.329 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.456 ' N ' ' HG3' ' A' ' 97' ' ' MET . 11.0 m-20 -62.6 -34.14 76.4 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.148 0.499 . . . . 0.0 110.047 179.19 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 45.1 m-20 -81.84 -35.06 29.8 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.527 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.445 HG21 HD12 ' A' ' 104' ' ' LEU . 9.4 mm -76.45 -59.83 2.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.717 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.471 ' HB2' HD21 ' A' ' 60' ' ' LEU . 5.8 ttmt -51.62 -29.69 18.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.148 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.405 ' HG3' ' N ' ' A' ' 103' ' ' THR . 9.4 ptp -82.49 -37.98 24.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.92 -179.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.426 HG22 HD12 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -70.29 -42.09 72.52 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.018 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.445 HD12 HG21 ' A' ' 100' ' ' ILE . 28.4 mt -55.14 -52.1 64.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.016 0.436 . . . . 0.0 110.017 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -46.22 91.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.26 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 -47.06 -34.14 5.55 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.12 0.485 . . . . 0.0 110.864 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.623 HG23 ' OH ' ' A' ' 111' ' ' TYR . 12.3 mt -85.62 -52.27 12.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.264 179.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.656 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.48 -57.65 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.497 179.323 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -47.55 -26.06 1.32 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.347 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.455 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 0.0 OUTLIER -75.69 -24.8 56.29 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.925 179.865 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.656 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.2 OUTLIER -73.69 -34.35 64.83 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 179.233 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.773 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.53 -43.24 17.37 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 179.058 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -62.01 -32.16 72.62 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 113.898 -1.501 . . . . 0.0 109.022 178.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.455 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.72 -18.61 22.75 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.611 178.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 38.2 t70 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.198 -0.906 . . . . 0.0 111.106 179.928 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.863 0.363 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -129.73 37.67 3.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.917 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -176.36 79.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.933 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 10.6 t 66.09 95.72 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.026 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 665' ' ' LEU . . . . . . . . . . . . . 1.2 tt -61.93 115.58 4.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.191 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 666' ' ' SER . . . . . . . . . . . . . 19.2 p 47.16 83.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.485 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -94.3 18.93 10.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.081 0.467 . . . . 0.0 111.398 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -106.03 -15.68 14.83 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.473 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 2.7 pp -120.28 19.83 12.07 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.637 0.256 . . . . 0.0 111.253 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 670' ' ' PHE . . . . . 0.447 ' CZ ' ' CE ' ' A' ' 88' ' ' MET . 1.1 m-85 -84.32 122.12 28.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.931 0.396 . . . . 0.0 110.967 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -94.02 159.56 15.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.853 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -113.67 101.52 9.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.859 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 673' ' ' VAL . . . . . 0.408 ' CG1' ' HB1' ' A' ' 50' ' ' ALA . 27.0 m -57.34 132.37 81.29 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.907 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.86 153.66 77.21 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.554 2.169 . . . . 0.0 112.681 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 12.5 p -139.01 116.89 11.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.834 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -179.35 165.98 1.45 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.967 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -94.36 179.91 5.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.903 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -177.96 89.83 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.884 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 2.7 mt 63.71 36.22 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.031 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.843 -179.948 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo . . . . . 0 N--CA 1.488 1.165 0 CA-C-O 120.843 0.268 . . . . 0.0 111.814 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -102.88 -37.51 7.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.915 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.414 ' O ' ' N ' ' A' ' 18' ' ' ILE . 34.6 m170 -81.49 17.91 1.29 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.529 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.551 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 4.0 p -152.67 153.89 34.2 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.125 0.488 . . . . 0.0 111.333 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.482 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 172.07 138.93 2.67 Favored Glycine 0 C--O 1.225 -0.421 0 N-CA-C 110.731 -0.948 . . . . 0.0 110.731 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.573 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -83.13 145.98 28.91 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -178.5 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.417 ' CB ' ' HB3' ' A' ' 89' ' ' PHE . . . -157.5 171.27 20.67 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.162 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.516 HG12 ' HB2' ' A' ' 90' ' ' SER . 5.2 mm -101.24 127.58 54.37 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.477 ' CZ ' ' CD2' ' A' ' 38' ' ' HIS . 5.9 t80 -124.39 108.23 11.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.996 0.427 . . . . 0.0 111.041 178.046 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 6.8 mm-40 68.67 49.2 0.74 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.829 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp 72.82 -6.25 1.7 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.135 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.419 HG12 ' CZ2' ' A' ' 29' ' ' TRP . 14.3 t -101.04 144.91 12.21 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.497 0 CA-C-O 121.219 0.533 . . . . 0.0 110.562 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.45 ' HA ' ' CD1' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -99.16 114.18 26.81 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.938 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -136.46 -170.42 11.98 Favored Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.886 -0.673 . . . . 0.0 111.846 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.573 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 14.5 mm -105.76 136.11 41.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 120.788 0.327 . . . . 0.0 111.186 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.525 ' CD1' ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.51 140.62 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 176.962 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.551 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.3 117.9 5.74 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.716 -0.794 . . . . 0.0 111.554 -178.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.516 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 22.5 mt -82.02 142.81 13.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 114.461 -1.245 . . . . 0.0 112.184 -178.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.516 ' O ' HG22 ' A' ' 22' ' ' VAL . 1.6 t30 -118.2 92.82 3.92 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.972 179.14 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.29 -0.82 42.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.314 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -82.45 0.62 41.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.661 0.267 . . . . 0.0 111.184 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.516 HG22 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.46 -162.34 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 120.824 0.345 . . . . 0.0 110.654 179.994 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.1 t -176.29 101.6 0.24 Allowed Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.4 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.45 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 9.7 Cg_exo -70.98 161.37 89.87 Favored 'Cis proline' 0 C--N 1.347 0.492 0 C-N-CA 123.682 -1.382 . . . . 0.0 112.673 0.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.64 178.23 0.03 OUTLIER 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.498 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.484 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 7.9 pt-20 -163.63 135.18 4.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.135 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.577 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.3 OUTLIER -107.9 130.44 55.02 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.123 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 10.4 m -113.46 113.06 24.63 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.487 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 73.2 t90 -91.92 110.38 21.73 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.8 ttt180 -106.25 131.0 54.0 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.838 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.7 m -49.96 153.89 1.24 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.706 0.289 . . . . 0.0 110.562 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 18.8 m -72.97 -33.69 66.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.281 0.563 . . . . 0.0 109.7 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -87.96 -17.16 31.9 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.002 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.89 33.61 10.88 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.31 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -88.48 -24.39 22.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.645 0.259 . . . . 0.0 111.485 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.04 166.61 2.98 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.383 0.611 . . . . 0.0 111.465 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.484 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.6 OUTLIER -143.66 155.48 16.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.919 -178.865 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.477 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 37.8 m80 -130.15 119.39 22.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.695 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.43 129.05 43.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.763 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.577 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -116.78 139.72 42.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.379 -179.543 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.406 ' O ' HG12 ' A' ' 45' ' ' ILE . 25.3 t -103.97 95.37 3.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 177.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.435 ' CB ' ' OH ' ' A' ' 111' ' ' TYR . 0.5 OUTLIER -42.59 -23.95 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.953 -178.849 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.45 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.8 OUTLIER -76.42 -48.15 20.71 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 179.257 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.404 ' CG2' ' HB ' ' A' ' 41' ' ' VAL . 34.8 p -64.53 -27.84 69.24 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.527 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 48.0 mm -56.46 110.56 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.548 178.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 63' ' ' ILE . 9.0 t0 -54.34 -31.65 54.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.794 0.33 . . . . 0.0 110.935 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.8 pttt -172.66 164.34 5.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.827 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.8 tp -109.02 117.35 33.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.409 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -113.2 147.45 37.43 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.551 0.215 . . . . 0.0 110.691 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.501 ' HB3' HD23 ' A' ' 60' ' ' LEU . . . -157.2 152.01 25.68 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.662 -0.244 . . . . 0.0 111.162 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.419 ' HB ' ' CB ' ' A' ' 55' ' ' SER . 17.7 p -70.89 154.81 94.07 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-O 120.796 0.331 . . . . 0.0 111.168 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.32 163.31 34.88 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.731 2.287 . . . . 0.0 112.514 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.08 -24.86 60.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.431 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.1 t -92.33 18.17 8.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.239 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.419 ' CB ' ' HB ' ' A' ' 51' ' ' THR . 19.9 t -80.06 124.18 28.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.946 0.403 . . . . 0.0 111.177 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -61.66 -14.97 35.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.383 179.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.401 ' O ' ' CD ' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -145.47 104.98 3.96 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.109 0.48 . . . . 0.0 111.131 179.597 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.4 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 1.8 mpt? -56.19 127.94 33.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.153 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 37.9 mtm -149.81 138.3 20.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.033 0.444 . . . . 0.0 111.73 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.501 HD23 ' HB3' ' A' ' 50' ' ' ALA . 17.2 mt -122.11 141.96 50.87 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.572 178.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 42.1 ttp180 -142.48 150.74 40.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.104 0.478 . . . . 0.0 112.284 -178.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.527 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.6 mp -128.15 115.51 18.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.565 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.431 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 7.8 mm -76.42 156.5 5.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.623 0.249 . . . . 0.0 111.046 -179.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -109.38 138.54 14.85 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.498 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.4 mttm -68.52 115.79 8.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.88 0.371 . . . . 0.0 110.94 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.454 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 13.1 p -87.21 162.44 2.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.994 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.6 p30 -130.31 51.55 2.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.697 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -64.63 -16.44 62.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.401 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.1 m -105.81 33.61 3.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.904 0.383 . . . . 0.0 110.793 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.76 -40.78 0.69 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.967 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.3 mttp 63.45 95.44 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.955 0.407 . . . . 0.0 110.771 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.39 133.84 40.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.984 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.407 ' CG ' ' HA2' ' A' ' 77' ' ' GLY . 0.0 OUTLIER -68.28 149.21 49.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.131 -179.856 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.403 ' O ' ' CB ' ' A' ' 75' ' ' ASN . 0.6 OUTLIER -94.37 -36.19 12.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.834 179.793 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . 0.403 ' CB ' ' O ' ' A' ' 74' ' ' ASP . 0.7 OUTLIER 165.41 -28.42 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.115 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -116.55 30.78 7.13 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.385 -179.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.407 ' HA2' ' CG ' ' A' ' 73' ' ' LYS . . . 54.93 29.4 51.03 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.569 -0.824 . . . . 0.0 112.576 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -78.48 -0.86 31.06 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 55.64 108.81 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.821 0.343 . . . . 0.0 111.625 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 7.6 t -115.24 142.38 28.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.386 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 96.3 t -112.41 83.96 5.79 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.467 179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -44.36 142.62 4.24 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.714 2.276 . . . . 0.0 112.489 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.5 mttt -89.32 164.96 28.22 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.018 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.454 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 2.6 Cg_exo -79.85 80.31 3.1 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 123.624 2.882 . . . . 0.0 112.019 -179.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -57.49 172.57 0.33 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.376 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.67 134.97 2.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.476 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.485 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 7.1 m-70 -95.9 111.65 23.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.783 0.325 . . . . 0.0 110.501 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.435 ' CE ' ' CZ ' ' B' ' 670' ' ' PHE . 3.8 ttt -93.95 137.85 32.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.98 -179.546 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.525 ' CD1' ' CD1' ' A' ' 16' ' ' ILE . 87.9 m-85 -136.26 116.88 13.89 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.938 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.516 ' HB2' HG12 ' A' ' 8' ' ' ILE . 1.1 m -91.0 114.74 27.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.827 0.346 . . . . 0.0 110.64 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.442 ' CE2' HG13 ' A' ' 100' ' ' ILE . 9.3 m-85 -92.62 135.78 33.79 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.569 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -101.75 31.03 4.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.475 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.417 ' CB ' HG21 ' A' ' 96' ' ' VAL . 4.6 m-20 -176.42 120.68 0.15 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.757 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.442 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -59.89 -16.66 31.06 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.67 179.544 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -74.37 -50.75 17.38 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 120.95 0.405 . . . . 0.0 110.402 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.417 HG21 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -66.22 -40.13 86.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.687 179.323 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.442 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -68.41 -37.97 80.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.038 179.531 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.435 ' N ' ' HG3' ' A' ' 97' ' ' MET . 17.8 t0 -65.9 -26.67 67.72 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.998 178.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.425 ' O ' ' OG1' ' A' ' 103' ' ' THR . 79.7 m-20 -81.66 -65.71 0.98 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.412 179.454 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.442 HG13 ' CE2' ' A' ' 91' ' ' PHE . 15.1 mm -48.28 -57.87 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-O 121.115 0.483 . . . . 0.0 110.623 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.45 ' HD2' ' HB2' ' A' ' 50' ' ' ALA . 17.2 ttpp -46.77 -39.18 11.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.983 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 30.3 mtm -78.01 -43.75 28.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.497 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.516 ' HB ' ' CD1' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -56.96 -53.61 56.03 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.084 -179.991 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.411 ' CD2' HD11 ' A' ' 42' ' ' LEU . 3.4 mt -49.99 -53.27 27.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.993 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -56.87 -46.28 81.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.007 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -49.9 -35.04 22.22 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 121.176 0.512 . . . . 0.0 110.3 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.605 HG22 ' OH ' ' A' ' 111' ' ' TYR . 10.2 mt -85.66 -51.83 12.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.379 179.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.653 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.28 -57.2 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.37 179.338 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -46.95 -28.22 1.54 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.253 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.516 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.0 OUTLIER -72.89 -24.89 60.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.28 179.896 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.653 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.2 OUTLIER -75.08 -34.79 61.82 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.665 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.774 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.47 -43.68 16.94 Favored 'General case' 0 CA--C 1.505 -0.752 0 N-CA-C 107.918 -1.142 . . . . 0.0 107.918 179.114 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -61.39 -31.36 71.27 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 113.883 -1.508 . . . . 0.0 109.027 178.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.456 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.6 -21.26 20.16 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.56 178.707 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.891 179.866 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.787 0.327 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 1.7 tp -173.99 87.53 0.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.87 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -176.89 95.49 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.963 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 16.6 t -150.88 40.59 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.071 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 665' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -131.25 175.84 8.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.845 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 666' ' ' SER . . . . . . . . . . . . . 1.4 t -177.61 96.6 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.721 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -94.09 19.16 9.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.179 0.514 . . . . 0.0 111.541 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -97.38 -4.81 37.7 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.318 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -120.28 20.0 12.04 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.136 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 670' ' ' PHE . . . . . 0.435 ' CZ ' ' CE ' ' A' ' 88' ' ' MET . 4.0 m-85 -81.45 122.13 27.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.802 0.334 . . . . 0.0 110.914 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -100.95 140.95 34.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.868 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -82.43 113.08 19.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.887 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 673' ' ' VAL . . . . . 0.413 ' CG1' ' HB2' ' A' ' 50' ' ' ALA . 34.2 m -57.53 153.93 26.83 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.086 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.44 128.2 13.36 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.581 2.187 . . . . 0.0 112.316 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 1.5 p -139.09 139.5 37.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.854 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 5.6 mmtt -55.5 166.12 0.69 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.149 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 8.7 t -170.26 -39.36 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.019 0.438 . . . . 0.0 111.021 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 63.38 127.53 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.956 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 4.3 mt -116.36 45.33 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.982 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 20.9 t . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.902 -179.985 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo . . . . . 0 N--CA 1.489 1.217 0 CA-C-O 120.881 0.284 . . . . 0.0 111.781 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -88.74 -30.23 19.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.944 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.2 m170 -94.62 24.7 4.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.156 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.519 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 8.1 p -161.52 159.76 28.27 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.199 0.523 . . . . 0.0 111.37 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . 168.32 136.84 2.12 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.109 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.563 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -80.83 142.48 33.64 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -178.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.479 ' HB1' ' CZ ' ' A' ' 91' ' ' PHE . . . -148.08 171.31 16.05 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.402 -179.145 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.49 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -104.1 122.64 57.17 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.439 -179.766 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.451 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 5.1 t80 -122.77 107.64 12.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.942 0.401 . . . . 0.0 111.153 178.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.425 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 8.0 mt-10 68.34 48.4 0.88 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.92 179.11 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.9 mttm 73.15 -4.73 2.11 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.42 HG12 ' CZ2' ' A' ' 29' ' ' TRP . 18.9 t -100.91 149.45 6.25 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 CA-C-O 121.094 0.473 . . . . 0.0 110.54 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.42 114.03 27.14 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.8 179.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -130.91 -138.19 4.23 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.206 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.563 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 15.4 mm -135.64 131.87 51.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.725 0.298 . . . . 0.0 111.551 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.474 HG23 ' CD1' ' A' ' 100' ' ' ILE . 0.3 OUTLIER -101.33 115.54 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 177.524 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.519 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -125.36 116.1 21.36 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.589 0.709 . . . . 0.0 110.936 -179.157 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 7.2 mt -82.25 142.74 13.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.824 -178.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.481 ' O ' HG23 ' A' ' 22' ' ' VAL . 2.4 m120 -117.66 93.92 4.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.368 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.402 ' CG ' HG12 ' A' ' 107' ' ' ILE . 1.2 tm-20 -81.61 -0.16 41.13 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.397 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -83.64 1.36 42.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.561 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -100.55 -162.48 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.959 0.409 . . . . 0.0 111.045 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.6 t -176.86 101.04 0.23 Allowed Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.32 179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.421 ' HG3' ' CB ' ' A' ' 43' ' ' SER . 38.1 Cg_endo -67.98 161.87 79.35 Favored 'Cis proline' 0 C--N 1.347 0.457 0 C-N-CA 123.349 -1.521 . . . . 0.0 112.422 0.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.48 -174.71 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.868 179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -161.23 144.09 12.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.564 0.697 . . . . 0.0 112.312 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.677 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 3.0 tt -108.25 149.14 29.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.753 -1.112 . . . . 0.0 108.541 178.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.1 m -147.42 104.65 3.66 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.168 -0.613 . . . . 0.0 112.557 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.487 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 84.9 t90 -92.02 110.44 21.81 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.727 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.402 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.5 ttm180 -110.69 130.59 55.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.925 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.3 t -49.86 156.81 0.67 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.66 0.267 . . . . 0.0 110.533 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.4 m -74.52 -35.71 63.18 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.438 0.637 . . . . 0.0 109.817 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -85.6 -16.01 40.69 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.119 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.62 34.22 12.03 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.358 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -87.37 -24.37 24.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.706 0.289 . . . . 0.0 111.54 -179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.27 163.01 2.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.293 0.568 . . . . 0.0 111.521 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.487 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.7 148.58 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.033 -178.864 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -123.58 120.08 31.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.61 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.49 146.42 24.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.856 0.36 . . . . 0.0 110.934 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.677 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.2 t -131.17 139.13 51.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.494 -179.373 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.4 t -103.95 95.91 4.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 177.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.508 ' CD1' HD21 ' A' ' 104' ' ' LEU . 1.1 mm? -42.46 -22.2 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.421 ' CB ' ' HG3' ' A' ' 24' ' ' PRO . 2.1 t -77.21 -48.26 18.05 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 43.2 p -64.95 -28.11 69.3 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.564 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 46.1 mm -56.6 108.63 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.648 178.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.428 ' N ' ' O ' ' A' ' 63' ' ' ILE . 1.6 t0 -54.15 -31.81 53.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.886 0.374 . . . . 0.0 110.971 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.414 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 0.7 OUTLIER -171.67 164.59 6.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.75 179.814 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.424 HD12 ' CD1' ' A' ' 104' ' ' LEU . 11.4 tp -109.05 118.22 36.22 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.874 -179.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.482 ' O ' ' N ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -108.75 139.12 44.01 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.299 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.488 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -156.86 143.92 18.7 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.759 0.314 . . . . 0.0 111.291 -179.551 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.403 ' HB ' ' CB ' ' A' ' 55' ' ' SER . 7.0 p -58.97 144.11 82.7 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.414 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -80.52 163.51 21.61 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.888 2.392 . . . . 0.0 112.433 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -54.98 -23.14 17.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.529 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.9 t -93.15 18.16 9.83 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.395 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.403 ' CB ' ' HB ' ' A' ' 51' ' ' THR . 2.0 t -84.04 125.42 32.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.867 0.365 . . . . 0.0 111.277 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -57.3 -18.73 18.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.077 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.44 166.08 25.65 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.758 179.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.446 ' HG2' ' CA ' ' A' ' 94' ' ' ARG . 2.2 mpt? -100.4 126.74 46.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.898 0.38 . . . . 0.0 111.235 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.592 ' HG3' ' HA ' ' A' ' 90' ' ' SER . 0.0 OUTLIER -149.95 137.88 20.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.572 -179.859 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.488 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 29.6 mt -127.8 148.89 50.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.971 178.346 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.482 ' N ' ' O ' ' A' ' 49' ' ' GLN . 12.6 ttt180 -153.17 152.4 31.2 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -179.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.564 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.4 mp -128.21 116.73 20.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.717 178.224 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.438 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 19.0 mm -76.59 156.72 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.723 0.297 . . . . 0.0 111.257 -179.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -123.38 127.72 6.71 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.31 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.401 ' N ' ' HB2' ' A' ' 46' ' ' ASP . 0.0 OUTLIER -57.29 125.77 24.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.91 0.386 . . . . 0.0 111.053 -179.785 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.525 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 12.2 p -102.52 161.29 4.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.319 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -122.29 53.2 1.25 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.661 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -62.95 -15.14 54.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.464 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.0 t -53.38 -25.04 13.93 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.948 0.404 . . . . 0.0 111.24 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.7 mmtm -74.12 -69.1 0.47 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.693 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.1 ptpt 42.57 81.13 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.419 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.76 -175.94 5.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.16 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.405 ' HD2' ' N ' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -108.44 -173.14 2.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.898 -179.736 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -105.79 -41.19 5.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.987 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 168.17 -31.32 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.05 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -98.5 39.3 1.26 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.003 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 59.5 18.8 45.55 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.64 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 16.5 m-80 -61.58 -156.45 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 110.46 -0.2 . . . . 0.0 110.46 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -162.22 114.43 1.69 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.803 0.335 . . . . 0.0 110.767 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 42.8 t -96.3 -69.94 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.494 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 4.1 p 35.46 70.55 0.97 Allowed Pre-proline 0 CA--C 1.53 0.203 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.584 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -40.18 128.79 2.25 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 123.435 2.757 . . . . 0.0 112.76 -179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.9 pttm -94.98 164.7 18.71 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.946 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.525 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 4.3 Cg_exo -81.07 111.54 2.45 Favored 'Trans proline' 0 N--CA 1.461 -0.389 0 C-N-CA 123.603 2.869 . . . . 0.0 112.255 -179.117 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.8 mt-30 -85.4 114.71 22.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.092 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -115.96 130.41 56.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.528 179.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.462 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 6.8 m-70 -93.7 111.21 22.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.343 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.403 ' HA ' ' HG3' ' A' ' 61' ' ' ARG . 0.1 OUTLIER -107.07 137.36 45.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.971 0.415 . . . . 0.0 111.149 -179.637 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.472 ' CD1' ' N ' ' A' ' 89' ' ' PHE . 1.1 m-85 -137.0 128.84 29.05 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.775 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.592 ' HA ' ' HG3' ' A' ' 59' ' ' MET . 0.9 OUTLIER -97.22 114.42 26.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.727 179.718 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.481 ' CE2' HG13 ' A' ' 100' ' ' ILE . 33.1 m-85 -91.12 145.58 24.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.109 0.48 . . . . 0.0 111.496 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -108.31 27.65 9.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.487 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -165.67 111.02 0.88 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.851 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.446 ' CA ' ' HG2' ' A' ' 58' ' ' MET . 0.0 OUTLIER -58.71 -23.62 59.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.429 179.696 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -72.95 -44.07 61.57 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.8 179.152 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 37.7 t -65.43 -51.96 57.49 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.445 178.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.416 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.1 OUTLIER -60.67 -36.0 77.63 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.853 179.209 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.416 ' N ' ' HG3' ' A' ' 97' ' ' MET . 4.0 m-20 -61.05 -33.75 73.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.089 179.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -81.64 -25.23 35.8 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.578 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.481 HG13 ' CE2' ' A' ' 91' ' ' PHE . 9.1 mm -84.87 -60.14 2.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.002 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.441 ' HB2' HD21 ' A' ' 60' ' ' LEU . 2.7 ttmm -53.31 -27.48 23.32 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.766 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.44 ' HG3' ' N ' ' A' ' 103' ' ' THR . 9.5 ptp -81.57 -39.96 23.79 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.75 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.44 ' N ' ' HG3' ' A' ' 102' ' ' MET . 0.9 OUTLIER -74.95 -32.91 61.86 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-O 120.984 0.421 . . . . 0.0 110.023 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.508 HD21 ' CD1' ' A' ' 42' ' ' LEU . 11.2 mt -60.71 -58.6 7.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.458 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.437 ' HA ' HG13 ' A' ' 108' ' ' ILE . 0.4 OUTLIER -68.34 -33.19 73.85 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.892 179.721 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -52.8 -34.72 54.93 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.273 0.559 . . . . 0.0 109.993 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.586 HG22 ' OH ' ' A' ' 111' ' ' TYR . 6.1 mt -84.95 -52.14 12.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.141 179.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.576 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.75 -57.81 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.334 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.091 178.961 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.04 -26.29 1.02 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.131 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 6.0 mtt-85 -73.05 -25.04 60.78 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.35 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.586 ' OH ' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -76.59 -36.15 57.7 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.735 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -79.68 -43.75 22.13 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.903 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -61.73 -31.01 71.15 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 113.913 -1.494 . . . . 0.0 108.99 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.453 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.61 -19.04 22.3 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.698 178.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 37.1 t70 . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.972 179.996 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.826 0.346 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 13.5 mt -153.24 84.41 1.2 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.91 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -176.54 70.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.894 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 17.5 t 59.16 42.64 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.128 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 665' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 61.71 -161.48 0.29 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.801 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 666' ' ' SER . . . . . . . . . . . . . 34.3 m -166.94 94.08 0.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.254 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 667' ' ' GLU . . . . . 0.441 ' O ' ' CE1' ' B' ' 670' ' ' PHE . 0.7 OUTLIER -83.78 18.86 1.83 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.072 -179.562 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -106.07 11.51 31.38 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.981 179.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 pp -120.34 -26.25 5.47 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 670' ' ' PHE . . . . . 0.441 ' CE1' ' O ' ' B' ' 667' ' ' GLU . 0.0 OUTLIER -76.51 164.38 26.01 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.985 0.422 . . . . 0.0 111.381 -179.28 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -109.89 171.1 7.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.078 -179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -107.24 120.38 41.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.075 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 673' ' ' VAL . . . . . 0.41 ' CG2' ' CD2' ' A' ' 48' ' ' LEU . 36.0 m -65.37 125.24 89.1 Favored Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.705 179.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.73 156.28 64.81 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.491 2.127 . . . . 0.0 112.671 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 52.7 p -136.81 116.63 13.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.763 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.88 130.21 0.09 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.916 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 2.3 m 62.09 148.29 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.06 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -168.6 128.81 1.2 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.911 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 679' ' ' ILE . . . . . 0.49 HD12 HG22 ' B' ' 679' ' ' ILE . 0.0 OUTLIER -177.21 96.16 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.958 179.956 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 2.5 m . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.905 -179.93 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo . . . . . 0 N--CA 1.487 1.123 0 CA-C-O 120.844 0.268 . . . . 0.0 111.865 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -101.55 -37.57 8.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.88 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.418 ' O ' ' N ' ' A' ' 18' ' ' ILE . 37.1 m80 -82.0 17.9 1.47 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.49 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.552 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 4.9 p -152.26 153.07 33.02 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 121.205 0.526 . . . . 0.0 111.262 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.484 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 173.03 139.07 2.75 Favored Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 110.707 -0.957 . . . . 0.0 110.707 -179.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.562 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.84 142.51 31.46 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -178.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.42 ' HB3' ' CE1' ' A' ' 91' ' ' PHE . . . -151.81 171.1 18.26 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.179 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.468 ' N ' ' CD1' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.77 127.05 55.58 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.266 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.554 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.478 ' CZ ' ' CD2' ' A' ' 38' ' ' HIS . 7.2 t80 -128.08 110.53 12.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.957 0.408 . . . . 0.0 111.093 178.182 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 3.7 mm-40 67.46 50.09 0.96 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.892 179.131 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 69.83 -4.42 1.46 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.187 179.254 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.424 HG13 ' CZ2' ' A' ' 29' ' ' TRP . 17.9 t -101.38 149.05 6.66 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 CA-C-O 121.122 0.487 . . . . 0.0 110.561 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.401 ' HA ' HD13 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -111.85 113.49 25.86 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.033 179.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.402 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -131.98 -133.05 3.4 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.952 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.562 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 18.7 mm -135.89 136.11 50.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 120.688 0.28 . . . . 0.0 111.255 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.501 ' CD1' ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.68 140.52 19.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 106.425 -1.695 . . . . 0.0 106.425 176.7 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.552 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.54 118.01 5.68 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 119.629 -0.829 . . . . 0.0 111.591 -178.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.508 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 20.9 mt -81.52 142.88 13.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 114.501 -1.227 . . . . 0.0 112.164 -178.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.503 ' O ' HG22 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -119.5 92.7 3.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.914 179.034 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.68 -0.2 41.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.319 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -82.49 0.37 42.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.647 -0.251 . . . . 0.0 111.096 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.503 HG22 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.31 -163.01 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.823 0.344 . . . . 0.0 110.775 179.92 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.6 p -175.1 101.48 0.26 Allowed Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.369 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.441 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 12.4 Cg_exo -69.48 166.34 73.54 Favored 'Cis proline' 0 C--N 1.346 0.445 0 C-N-CA 123.612 -1.411 . . . . 0.0 112.704 0.348 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.53 178.57 0.15 Allowed 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.342 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.511 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.73 134.52 4.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.209 179.042 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.588 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.3 OUTLIER -107.93 129.12 55.12 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.904 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.402 ' CG2' ' CG2' ' A' ' 37' ' ' VAL . 6.8 m -112.33 113.41 25.61 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -178.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.523 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 76.3 t90 -91.79 110.36 21.7 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.261 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.466 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.5 ttt180 -109.41 130.33 55.5 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.727 0.298 . . . . 0.0 111.204 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 31.1 m -49.9 159.83 0.37 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.508 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.402 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 48.3 m -75.98 -37.58 58.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.333 0.587 . . . . 0.0 109.845 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -85.56 -12.91 50.46 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.155 -0.929 . . . . 0.0 111.233 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 83.73 35.4 16.41 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.361 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -87.56 -24.87 23.89 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.709 0.29 . . . . 0.0 111.383 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.75 163.94 2.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.321 0.581 . . . . 0.0 111.427 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.494 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.6 OUTLIER -143.77 155.45 16.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.981 -178.903 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.478 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 27.3 m80 -130.69 119.56 22.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.795 179.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.56 128.54 43.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.739 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.588 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -114.94 141.55 31.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.46 -179.629 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.419 ' O ' HG12 ' A' ' 45' ' ' ILE . 21.5 t -104.07 95.92 4.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 177.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.42 ' HA ' ' CG1' ' A' ' 45' ' ' ILE . 0.6 OUTLIER -44.18 -21.94 0.05 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.835 -179.114 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.441 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER -76.92 -47.14 21.89 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.083 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 51.5 p -64.52 -28.08 69.41 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.516 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 49.9 mm -56.68 103.57 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.411 178.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.416 ' N ' ' O ' ' A' ' 63' ' ' ILE . 24.2 t70 -58.26 -20.26 40.74 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.807 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.44 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 0.0 OUTLIER -172.6 160.18 4.59 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.105 0.478 . . . . 0.0 111.453 -179.877 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.442 HD13 HD22 ' A' ' 62' ' ' LEU . 12.2 tp -109.03 120.33 42.23 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.334 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.412 ' O ' ' N ' ' A' ' 61' ' ' ARG . 0.4 OUTLIER -122.52 145.59 48.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.63 0.252 . . . . 0.0 111.295 -179.641 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.464 ' HB3' HD23 ' A' ' 60' ' ' LEU . . . -157.3 149.86 23.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.667 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 43.3 p -56.53 138.66 75.92 Favored Pre-proline 0 CA--C 1.53 0.179 0 C-N-CA 121.045 -0.262 . . . . 0.0 110.87 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -68.34 163.19 37.38 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.598 2.199 . . . . 0.0 112.391 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.27 -32.21 73.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.059 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.4 p -70.74 -20.87 62.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.079 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 79.1 p -91.57 116.51 28.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.894 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -56.51 -18.25 10.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.697 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.5 mmmt -73.16 126.84 30.98 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.851 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.54 97.58 7.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.585 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.405 ' HB2' ' CZ ' ' B' ' 670' ' ' PHE . 23.8 mtm -143.97 142.93 30.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.861 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.464 HD23 ' HB3' ' A' ' 50' ' ' ALA . 17.9 mt -118.17 146.25 44.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.044 178.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.412 ' N ' ' O ' ' A' ' 49' ' ' GLN . 18.6 ttp180 -143.12 145.59 32.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.972 0.415 . . . . 0.0 112.119 -178.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.516 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.5 mp -128.19 109.07 11.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.889 178.231 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.454 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 7.8 mm -76.64 156.41 5.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.994 -0.282 . . . . 0.0 110.891 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -111.18 -170.39 19.12 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.417 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.0 mttm -116.07 136.48 52.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.72 0.295 . . . . 0.0 111.034 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.513 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 9.3 p -102.14 160.41 4.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.994 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -136.99 38.36 2.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.197 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 44.67 30.16 0.49 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.312 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 64.6 m -102.1 -22.76 14.17 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.215 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 30.7 mmtm -56.4 -82.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.971 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.7 mttm 55.09 89.81 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.865 0.364 . . . . 0.0 111.129 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.57 134.42 52.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.863 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.7 mmtt -73.51 148.52 43.02 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.776 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -103.93 -31.74 9.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.037 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 168.57 -31.38 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.101 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -105.11 20.46 18.82 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.327 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 53.84 36.93 56.49 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.532 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -83.6 2.97 34.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.701 0.286 . . . . 0.0 111.646 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 79' ' ' GLU . 9.5 pt-20 42.39 74.38 0.11 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.223 -0.444 . . . . 0.0 112.008 179.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 40.5 t -76.87 155.41 5.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.32 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 52.3 t -110.9 78.96 1.73 Allowed Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.341 179.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_exo -41.24 156.02 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.907 2.405 . . . . 0.0 112.795 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.9 ptpp? -44.69 164.94 0.16 Allowed Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.217 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.513 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.8 Cg_exo -82.4 46.29 2.15 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 123.543 2.828 . . . . 0.0 112.771 -178.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 59.68 149.45 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.009 0.433 . . . . 0.0 111.081 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -166.99 128.39 1.63 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.6 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.525 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 10.8 m-70 -93.13 111.18 22.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.73 0.3 . . . . 0.0 110.303 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 16.6 ttt -94.18 118.26 31.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.283 -179.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.501 ' CD1' ' CD1' ' A' ' 16' ' ' ILE . 92.8 m-85 -116.98 116.63 27.76 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.654 179.656 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.401 ' HA ' ' HG2' ' A' ' 59' ' ' MET . 0.4 OUTLIER -94.57 114.58 26.58 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.972 0.415 . . . . 0.0 110.545 179.931 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.45 ' CE2' ' HA ' ' A' ' 97' ' ' MET . 5.8 m-85 -89.63 147.32 23.97 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.394 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -109.47 29.14 7.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.0 179.133 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -174.97 117.69 0.18 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.585 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.441 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -59.47 -14.93 14.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.778 179.614 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.02 -50.83 18.02 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.025 0.44 . . . . 0.0 110.267 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -64.43 -43.71 97.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.658 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.45 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -64.38 -36.94 85.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.931 179.381 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -62.88 -28.73 70.24 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.817 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.436 ' O ' ' OG1' ' A' ' 103' ' ' THR . 5.4 m120 -81.69 -65.41 1.02 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.276 179.265 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.441 HG13 ' CE2' ' A' ' 91' ' ' PHE . 22.6 mm -47.32 -57.64 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.212 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.03 -35.46 24.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.733 -179.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.52 ' HG3' ' N ' ' A' ' 103' ' ' THR . 9.0 ptp -83.04 -41.49 18.6 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.647 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.52 ' N ' ' HG3' ' A' ' 102' ' ' MET . 0.2 OUTLIER -56.85 -50.76 71.47 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 120.822 0.344 . . . . 0.0 110.564 179.505 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.414 ' CD2' HD11 ' A' ' 42' ' ' LEU . 5.5 mt -52.73 -52.5 55.99 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 179.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.421 ' HG2' ' CD2' ' A' ' 48' ' ' LEU . 58.6 mm-40 -55.46 -47.76 75.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.017 179.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -49.62 -34.8 19.06 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 121.134 0.492 . . . . 0.0 110.607 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.525 HG21 ' OH ' ' A' ' 111' ' ' TYR . 9.2 mt -85.69 -52.07 12.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.49 179.42 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.639 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -42.52 -57.06 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.622 179.484 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.401 ' HA ' ' HG2' ' A' ' 112' ' ' LYS . 10.1 t -47.98 -26.95 1.96 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.942 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.452 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 11.7 mtp-105 -72.36 -25.03 61.37 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.022 179.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.639 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -75.54 -34.95 60.79 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.599 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.782 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.73 -43.17 17.12 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.987 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -61.3 -32.36 72.21 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 113.815 -1.539 . . . . 0.0 108.99 178.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.452 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.59 -18.91 22.48 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.727 178.628 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 33.5 t70 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.092 179.898 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.806 0.336 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 662' ' ' LEU . . . . . 0.459 ' CD1' ' N ' ' B' ' 662' ' ' LEU . 0.0 OUTLIER -117.74 -21.12 8.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.35 179.985 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER 56.67 85.88 0.07 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.725 0.298 . . . . 0.0 111.079 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 14.2 p 43.1 44.86 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.177 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.677 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 665' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 63.46 142.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.869 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 666' ' ' SER . . . . . . . . . . . . . 1.8 t -111.06 64.01 0.61 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.836 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -94.14 19.15 9.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.59 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -86.96 5.3 37.87 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.394 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.31 19.89 12.04 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.726 0.298 . . . . 0.0 111.168 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 670' ' ' PHE . . . . . 0.405 ' CZ ' ' HB2' ' A' ' 59' ' ' MET . 5.4 m-85 -63.37 122.81 17.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.856 0.36 . . . . 0.0 110.927 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -100.2 145.29 28.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.845 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -84.17 115.36 22.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.048 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 673' ' ' VAL . . . . . 0.413 ' CG1' ' NE2' ' A' ' 105' ' ' GLN . 25.5 t -60.47 136.39 92.08 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.892 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -65.45 128.33 20.01 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.429 2.086 . . . . 0.0 112.284 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 675' ' ' THR . . . . . 0.433 HG21 HG22 ' A' ' 108' ' ' ILE . 0.7 OUTLIER -122.13 159.58 26.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.873 -179.989 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 33.7 tttt -81.0 162.79 23.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.879 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 1.6 t -176.66 -170.37 0.33 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.942 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -82.17 -172.94 4.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.908 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 3.5 mp -114.14 31.81 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.111 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 3.2 m . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.875 -179.974 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo . . . . . 0 N--CA 1.488 1.164 0 CA-C-O 120.89 0.287 . . . . 0.0 111.822 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -106.39 -37.55 6.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.849 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.418 ' CD2' ' HG2' ' A' ' 20' ' ' GLU . 16.4 m80 -87.45 20.43 2.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.249 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.526 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 6.5 p -156.54 136.96 13.03 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 121.196 0.522 . . . . 0.0 111.145 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.443 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . -171.73 138.54 4.89 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 110.751 -0.939 . . . . 0.0 110.751 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.565 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -81.29 142.75 32.81 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.409 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.425 ' HB2' ' CD1' ' A' ' 91' ' ' PHE . . . -155.74 170.98 20.79 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.364 -179.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.447 ' O ' ' HA ' ' A' ' 89' ' ' PHE . 0.4 OUTLIER -100.85 126.17 54.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.239 -179.826 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.507 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 58.4 t80 -117.25 108.6 15.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.047 0.451 . . . . 0.0 111.569 178.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 67.1 mt-10 58.49 55.55 4.82 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.84 178.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.4 mtmm 71.99 -6.66 1.44 Allowed 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.422 HG12 ' CZ2' ' A' ' 29' ' ' TRP . 34.0 t -101.73 150.16 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.549 0 CA-C-O 121.235 0.54 . . . . 0.0 110.545 179.383 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 90.4 p -106.1 144.76 32.35 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.003 -179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -171.67 -141.86 3.51 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.034 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.565 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 13.8 mm -132.38 136.19 56.66 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.475 0 CA-C-O 120.938 0.399 . . . . 0.0 111.465 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.47 HD12 HG22 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -100.76 141.37 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 N-CA-C 106.332 -1.729 . . . . 0.0 106.332 176.759 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.526 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.61 118.59 5.85 Favored 'General case' 0 C--N 1.313 -1.002 0 C-N-CA 119.663 -0.815 . . . . 0.0 111.478 -178.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.511 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 20.1 mt -82.0 142.99 12.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.255 -178.668 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.503 ' O ' HG22 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -119.8 92.51 3.8 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.872 178.871 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.418 ' HG2' ' CD2' ' A' ' 3' ' ' HIS . 0.7 OUTLIER -82.85 0.92 41.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.376 -179.651 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -82.79 0.81 42.06 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.06 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.503 HG22 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.39 -162.07 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.852 0.358 . . . . 0.0 110.709 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.6 p -175.01 101.23 0.26 Allowed Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.541 179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.434 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 9.8 Cg_exo -70.98 165.94 78.69 Favored 'Cis proline' 0 C--N 1.348 0.504 0 C-N-CA 123.617 -1.41 . . . . 0.0 112.634 0.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.66 177.92 0.19 Allowed 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.406 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.515 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 6.7 pt-20 -163.68 137.15 5.55 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.003 179.077 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.566 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.3 OUTLIER -107.86 127.67 53.93 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 178.99 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.1 m -109.67 111.15 22.44 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 -178.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.507 ' CE2' ' HB3' ' A' ' 9' ' ' PHE . 65.6 t90 -91.95 113.68 26.02 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 116.233 -0.439 . . . . 0.0 109.868 178.651 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.5 ttt180 -106.91 133.52 51.43 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.658 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 27.3 m -49.72 166.49 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.251 -0.277 . . . . 0.0 110.251 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.0 m -76.8 -43.23 37.51 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.479 0.657 . . . . 0.0 109.894 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -83.96 -13.78 52.51 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.185 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.22 34.22 10.93 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.276 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.79 -23.08 29.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.684 0.278 . . . . 0.0 111.574 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.9 163.59 2.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.32 0.581 . . . . 0.0 111.422 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.469 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.6 146.03 19.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.985 -178.747 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.448 ' ND1' ' CZ ' ' A' ' 9' ' ' PHE . 1.4 m-70 -122.04 123.53 41.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.828 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.51 126.32 41.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.814 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.566 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -112.47 140.16 33.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.265 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.4 ' O ' HG12 ' A' ' 45' ' ' ILE . 23.3 t -104.01 96.49 4.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 177.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.462 ' CB ' ' OH ' ' A' ' 111' ' ' TYR . 0.6 OUTLIER -43.05 -24.28 0.07 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.774 -179.019 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.434 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.8 OUTLIER -74.95 -47.95 26.89 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.281 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 48.7 p -64.64 -28.11 69.39 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.535 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 41.8 mm -57.59 99.83 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.526 178.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.453 ' N ' ' O ' ' A' ' 63' ' ' ILE . 16.5 t70 -47.48 -28.72 2.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.7 0.286 . . . . 0.0 111.31 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.413 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 1.4 pttt -172.72 156.97 3.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.894 0.378 . . . . 0.0 110.741 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.464 HD22 ' HB2' ' A' ' 104' ' ' LEU . 3.6 tp -109.1 122.47 47.36 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.714 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -118.75 151.99 37.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.793 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.476 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -157.16 150.47 23.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.78 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 25.9 p -57.12 142.2 75.21 Favored Pre-proline 0 C--N 1.332 -0.156 0 CA-C-O 120.63 0.252 . . . . 0.0 110.84 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.73 163.27 39.64 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.522 2.148 . . . . 0.0 112.553 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.41 -30.6 68.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.223 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.65 -21.79 62.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.935 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 57.8 m -94.03 117.08 29.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.834 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -54.78 -19.85 7.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.53 179.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -70.25 121.71 18.13 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.758 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.404 ' HG2' ' CB ' ' A' ' 94' ' ' ARG . 1.6 mpp? -106.1 104.06 13.68 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.833 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 14.2 mtm -149.69 143.6 25.57 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.648 -179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.476 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 24.0 mt -120.27 140.15 51.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.084 178.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -135.42 148.84 49.45 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 120.917 0.389 . . . . 0.0 111.842 -179.169 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.535 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.4 mp -127.87 113.14 15.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.876 178.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.454 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 8.8 mm -76.66 145.53 10.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.649 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -104.72 144.87 15.86 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.558 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -56.92 118.24 4.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.816 0.341 . . . . 0.0 110.901 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.439 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 11.5 p -101.21 159.75 3.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.318 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -123.01 43.49 2.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.762 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.1 -20.87 57.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.17 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.32 -21.98 51.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.073 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.1 mmtm -67.11 -65.82 0.63 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.881 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.1 ptmt 43.15 80.78 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.453 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.16 164.41 17.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.942 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.3 mttp -116.68 154.93 29.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.921 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -86.96 170.72 11.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.933 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -59.88 -20.4 56.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.244 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -98.15 31.8 2.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.938 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 59.35 24.63 59.34 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.488 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 12.7 m-20 -78.88 -167.62 1.18 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.727 0.298 . . . . 0.0 110.779 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -147.0 126.82 13.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.867 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 59.6 t -95.07 -65.54 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.373 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.415 HG11 ' O ' ' A' ' 81' ' ' VAL . 4.5 p 34.11 78.26 0.33 Allowed Pre-proline 0 CA--C 1.53 0.188 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.855 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -44.02 124.14 4.58 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.891 2.394 . . . . 0.0 112.676 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt -84.59 159.57 58.08 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.965 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.439 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 4.1 Cg_exo -83.84 127.86 4.32 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 123.533 2.822 . . . . 0.0 112.402 -179.101 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -97.95 154.87 17.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.822 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 37.4 mtt180 -153.12 142.0 21.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.541 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.478 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 20.7 m-70 -97.32 111.32 23.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.69 0.281 . . . . 0.0 110.349 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 7.5 ttt -94.08 112.97 24.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.997 0.427 . . . . 0.0 111.175 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.464 ' CG ' ' CD1' ' A' ' 16' ' ' ILE . 90.8 m-85 -116.04 116.63 28.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.628 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -99.2 114.5 27.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.973 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.425 ' CD1' ' HB2' ' A' ' 7' ' ' ALA . 5.4 m-85 -95.04 133.66 38.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.149 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 37.5 m-20 -93.64 43.67 1.12 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.685 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.486 ' CB ' HG23 ' A' ' 96' ' ' VAL . 4.5 m-20 176.8 109.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.409 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.442 ' O ' ' HG3' ' A' ' 97' ' ' MET . 0.0 OUTLIER -52.96 -21.06 3.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.959 -179.995 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.34 -44.97 70.55 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 120.831 0.348 . . . . 0.0 110.633 179.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.486 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -66.17 -49.84 73.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.882 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.442 ' HG3' ' O ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -62.73 -36.57 83.43 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.351 179.5 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.458 ' O ' ' HG2' ' A' ' 102' ' ' MET . 8.6 t70 -67.6 -35.1 78.33 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.047 0.451 . . . . 0.0 110.053 179.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 68.6 m-20 -82.23 -29.58 31.25 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.712 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.429 HG21 ' CD1' ' A' ' 60' ' ' LEU . 1.2 mm -83.19 -59.91 2.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.471 -179.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 6.6 ttmt -44.41 -28.69 0.58 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.328 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.458 ' HG2' ' O ' ' A' ' 98' ' ' ASP . 6.3 ptm -79.85 -40.29 28.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.424 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.511 ' HB ' ' CD1' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -57.79 -58.89 6.38 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.715 179.563 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.464 ' HB2' HD22 ' A' ' 48' ' ' LEU . 4.7 mt -47.16 -50.48 20.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.76 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.456 ' HG2' ' CD2' ' A' ' 48' ' ' LEU . 49.9 mm-40 -56.65 -50.59 71.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.316 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -50.88 -31.3 17.02 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 121.022 0.439 . . . . 0.0 110.921 -179.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.601 HG23 ' OH ' ' A' ' 111' ' ' TYR . 8.4 mt -85.61 -52.94 11.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.652 179.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.681 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.51 -56.78 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.808 179.614 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 41.2 t -47.83 -26.57 1.7 Allowed 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.264 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 0.0 OUTLIER -74.75 -24.84 58.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.715 179.816 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.681 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.2 OUTLIER -74.08 -34.2 63.91 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 179.154 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.78 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.76 -43.22 17.01 Favored 'General case' 0 CA--C 1.505 -0.753 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 179.059 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -61.67 -32.2 72.37 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.901 -1.5 . . . . 0.0 108.992 178.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.453 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.68 -18.73 22.63 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.556 178.702 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 27.2 t0 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.209 -0.9 . . . . 0.0 111.131 179.97 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.836 0.351 . . . . 0.0 111.161 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -92.01 -31.48 15.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.906 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -176.95 95.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.862 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 21.6 t 62.93 83.01 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.072 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 665' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -143.82 147.09 33.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.858 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 666' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -167.42 91.46 0.37 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.854 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 667' ' ' GLU . . . . . 0.416 ' HA ' ' CD1' ' B' ' 670' ' ' PHE . 3.9 pm0 -94.18 19.14 9.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.134 0.492 . . . . 0.0 111.568 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -102.7 -20.88 14.21 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.103 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.93 19.86 19.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.129 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 670' ' ' PHE . . . . . 0.416 ' CD1' ' HA ' ' B' ' 667' ' ' GLU . 2.2 m-85 -68.46 126.39 29.48 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.877 0.37 . . . . 0.0 110.83 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -100.97 171.08 7.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.876 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -110.94 118.57 36.45 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.946 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 673' ' ' VAL . . . . . 0.453 ' CG2' ' HB2' ' A' ' 50' ' ' ALA . 4.1 t -66.24 135.23 94.89 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.843 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.71 128.36 15.06 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.443 2.095 . . . . 0.0 112.406 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 675' ' ' THR . . . . . 0.407 HG22 ' CG2' ' A' ' 108' ' ' ILE . 0.0 OUTLIER -125.04 153.7 42.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.724 179.848 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.73 146.16 37.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.967 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 3.9 m -173.81 103.09 0.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.896 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -99.7 172.28 7.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.892 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 679' ' ' ILE . . . . . 0.458 HG22 HD12 ' B' ' 679' ' ' ILE . 0.2 OUTLIER -151.02 30.98 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.15 -179.963 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 1.7 m . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.228 -0.892 . . . . 0.0 110.884 -179.986 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo . . . . . 0 N--CA 1.487 1.109 0 CA-C-O 121.01 0.337 . . . . 0.0 111.894 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -79.32 -34.56 42.2 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.912 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.403 ' NE2' ' HB2' ' A' ' 20' ' ' GLU . 26.1 m170 -97.32 26.26 4.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.055 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.536 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 50.7 p -160.99 155.18 22.9 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.081 0.467 . . . . 0.0 111.087 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . 172.67 136.36 2.14 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.284 -179.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.563 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -79.79 138.08 37.16 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.102 0.477 . . . . 0.0 112.086 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.416 ' HB3' ' CZ ' ' A' ' 91' ' ' PHE . . . -147.11 171.6 15.06 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.535 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.465 ' N ' ' CD1' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.15 129.95 51.35 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.254 -179.884 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.504 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 62.2 t80 -124.34 109.81 13.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.979 0.418 . . . . 0.0 111.418 178.644 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 61.59 45.35 8.23 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.643 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.7 mtpp 78.19 -4.48 2.2 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 179.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.415 HG13 ' CZ2' ' A' ' 29' ' ' TRP . 28.2 t -99.94 150.82 5.19 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.466 0 CA-C-O 121.119 0.485 . . . . 0.0 110.369 179.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 90.5 p -105.69 116.0 31.19 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.127 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -138.54 -158.55 7.77 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.13 179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.563 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 18.7 mm -119.8 131.82 71.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.765 0.317 . . . . 0.0 111.325 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.459 ' CD1' ' CG ' ' A' ' 89' ' ' PHE . 0.4 OUTLIER -101.19 114.02 39.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.536 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -123.1 115.89 22.57 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.582 0.706 . . . . 0.0 110.831 -179.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 15.7 mt -85.25 142.9 12.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 114.749 -1.114 . . . . 0.0 111.891 -178.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.492 ' O ' HG21 ' A' ' 22' ' ' VAL . 1.7 m120 -117.77 97.44 5.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.279 179.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.403 ' HB2' ' NE2' ' A' ' 3' ' ' HIS . 0.0 OUTLIER -84.1 -1.81 55.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.299 -179.757 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -82.92 1.37 39.94 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.486 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.492 HG21 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -98.35 -162.41 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.846 0.355 . . . . 0.0 110.943 180.0 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.0 p -173.97 99.98 0.3 Allowed Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.345 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.466 ' CG ' ' HB2' ' A' ' 43' ' ' SER . 56.6 Cg_endo -71.09 164.29 83.34 Favored 'Cis proline' 0 C--N 1.346 0.427 0 C-N-CA 123.605 -1.415 . . . . 0.0 112.867 0.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -54.99 -175.84 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.978 179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -163.53 147.11 10.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.629 0.728 . . . . 0.0 112.482 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.663 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 2.8 tt -108.2 149.01 29.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.646 -1.161 . . . . 0.0 108.466 178.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.42 102.6 3.73 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -178.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.504 ' CE2' ' HB3' ' A' ' 9' ' ' PHE . 78.4 t90 -92.13 114.04 26.48 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.735 178.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 12.6 ptp180 -114.83 135.13 54.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.639 0.256 . . . . 0.0 110.534 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.5 m -49.81 158.24 0.5 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.717 0.294 . . . . 0.0 110.499 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 32.4 m -72.49 -36.0 68.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.416 0.627 . . . . 0.0 109.707 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -86.13 -18.26 32.78 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.024 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.76 32.56 9.94 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.439 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -85.79 -21.58 28.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.592 0.234 . . . . 0.0 111.52 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.1 158.71 2.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.356 0.598 . . . . 0.0 111.422 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.475 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.68 140.39 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.945 -178.72 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.496 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 0.6 OUTLIER -115.86 125.51 52.75 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.587 179.539 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.07 146.19 25.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.054 -179.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.663 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.2 t -129.91 136.7 58.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.144 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.408 ' O ' HG12 ' A' ' 45' ' ' ILE . 47.8 t -104.04 95.86 4.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.427 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.47 ' CB ' ' OH ' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -41.93 -24.97 0.05 Allowed 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.642 -178.81 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.466 ' HB2' ' CG ' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -72.99 -51.27 18.91 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 178.621 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 30.8 p -64.93 -28.41 69.51 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 178.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.53 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 42.1 mm -56.39 103.31 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.22 178.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 63' ' ' ILE . 16.9 t70 -54.53 -31.93 57.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.154 -0.476 . . . . 0.0 112.048 -179.19 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.427 ' O ' ' CG2' ' A' ' 45' ' ' ILE . 53.2 mtmt -157.6 162.97 38.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.539 0.685 . . . . 0.0 112.285 -179.463 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.445 HD22 ' HG2' ' A' ' 105' ' ' GLN . 9.0 tp -111.52 121.68 45.82 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.118 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.561 ' O ' ' N ' ' A' ' 61' ' ' ARG . 12.0 mt-30 -125.01 136.44 53.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.62 0.247 . . . . 0.0 111.181 -179.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.487 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -157.07 141.23 16.37 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.041 179.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 37.4 p -60.34 149.42 76.65 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.241 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -78.27 163.31 27.72 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.707 2.271 . . . . 0.0 112.361 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.11 -28.82 70.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.287 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.84 -17.07 62.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.194 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 47.3 t -71.14 122.05 19.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.033 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.02 -17.45 10.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.369 179.009 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.97 167.62 11.57 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.235 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.413 ' HB2' ' HG2' ' A' ' 97' ' ' MET . 0.9 OUTLIER -127.33 129.36 47.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.177 0.513 . . . . 0.0 111.351 -179.8 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.429 ' HG3' ' HA ' ' A' ' 90' ' ' SER . 7.8 ttp -149.95 138.03 20.34 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.845 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.487 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 26.7 mt -119.51 150.18 40.68 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.117 178.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.561 ' N ' ' O ' ' A' ' 49' ' ' GLN . 2.3 ttt180 -150.91 148.18 28.11 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -178.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.53 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.3 mp -128.6 118.78 23.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.896 178.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.468 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 25.0 mm -76.53 156.45 5.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.649 0.262 . . . . 0.0 111.033 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -117.36 146.09 18.7 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.524 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 32.2 mttt -65.0 119.96 11.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.802 0.334 . . . . 0.0 110.829 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.499 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 12.9 p -98.2 160.5 3.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.081 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -115.66 40.24 2.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.009 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -64.6 -21.06 66.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.058 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 41.5 t -88.69 -22.81 23.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.106 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.6 mmmt -83.97 -41.01 17.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.865 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.1 mtmt 61.98 93.23 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.028 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.408 ' N ' ' O ' ' A' ' 80' ' ' VAL . 0.0 OUTLIER -61.83 -176.46 0.09 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.708 179.862 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -141.75 -170.54 3.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.795 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -125.21 -68.08 0.86 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.12 0.486 . . . . 0.0 111.043 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 179.24 -33.36 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.105 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -95.95 38.47 1.18 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.931 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 72.13 8.24 69.17 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.768 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -60.02 -173.74 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.809 0.338 . . . . 0.0 110.924 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -154.11 137.12 15.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.864 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.408 ' O ' ' N ' ' A' ' 72' ' ' ARG . 2.1 t -128.35 145.13 35.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.35 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 81.5 t -123.46 69.96 43.89 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.129 179.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_exo -43.1 124.7 3.87 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.789 2.326 . . . . 0.0 112.724 -179.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.3 mmtt -59.56 164.32 5.56 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.094 0.473 . . . . 0.0 110.978 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.499 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 4.6 Cg_exo -81.21 105.63 1.65 Allowed 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 123.601 2.867 . . . . 0.0 112.284 -179.141 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.06 152.52 40.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.119 -179.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 30.2 mtt180 -155.45 137.23 14.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.286 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.479 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 15.2 m-70 -97.82 111.52 23.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.637 0.256 . . . . 0.0 110.558 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.85 122.45 42.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.941 0.401 . . . . 0.0 110.899 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.459 ' CG ' ' CD1' ' A' ' 16' ' ' ILE . 79.5 m-85 -125.58 116.87 22.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.775 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.429 ' HA ' ' HG3' ' A' ' 59' ' ' MET . 0.8 OUTLIER -95.83 114.55 26.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.145 -179.788 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.476 ' CE2' HG13 ' A' ' 100' ' ' ILE . 23.6 m-85 -91.42 158.63 16.4 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.169 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 -115.61 29.94 7.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.552 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.452 ' CB ' HG23 ' A' ' 96' ' ' VAL . 4.2 m-20 -173.43 115.84 0.25 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.532 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.409 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 10.4 ttp85 -58.95 -15.92 15.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.017 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.45 -43.7 54.99 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 121.03 0.443 . . . . 0.0 110.174 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.452 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -67.75 -48.48 75.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.437 179.102 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.43 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.1 OUTLIER -62.05 -36.08 80.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.998 179.153 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.43 ' N ' ' HG3' ' A' ' 97' ' ' MET . 2.0 m-20 -62.57 -33.87 75.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.255 179.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 16.6 m-20 -81.87 -30.44 32.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.613 179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.476 HG13 ' CE2' ' A' ' 91' ' ' PHE . 3.7 mm -79.53 -60.28 2.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.982 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.419 ' HB2' HD21 ' A' ' 60' ' ' LEU . 12.0 ttmt -51.85 -28.19 15.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.537 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 12.4 mtm -81.88 -29.39 32.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.941 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -82.42 -41.44 19.88 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.123 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.422 ' HB3' HD13 ' A' ' 48' ' ' LEU . 32.6 mt -56.81 -52.5 64.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.017 0.437 . . . . 0.0 109.855 179.131 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.445 ' HG2' HD22 ' A' ' 48' ' ' LEU . 5.3 mm-40 -61.98 -48.05 82.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.012 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -47.24 -33.06 5.07 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.985 0.422 . . . . 0.0 111.014 -179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.638 HG22 ' OH ' ' A' ' 111' ' ' TYR . 3.5 mt -85.77 -52.14 12.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.68 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.685 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.14 -59.34 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.63 179.758 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -47.08 -24.89 0.73 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.228 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.447 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 49.8 mtp85 -74.69 -25.31 59.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.385 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.685 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -76.18 -34.19 59.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.184 0.516 . . . . 0.0 109.611 179.656 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.754 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.21 -43.61 19.0 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 178.98 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -62.29 -31.67 72.3 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 113.737 -1.574 . . . . 0.0 109.07 178.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.447 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.68 -18.4 23.05 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.676 178.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 24.1 t70 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.257 -0.878 . . . . 0.0 111.073 179.896 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.887 0.375 . . . . 0.0 111.17 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -104.42 -39.8 6.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.883 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 60.84 92.46 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.941 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 19.6 m -144.48 80.03 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.083 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 665' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 61.77 152.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.886 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 666' ' ' SER . . . . . . . . . . . . . 1.2 t -153.42 87.17 1.23 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.434 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -88.32 18.82 4.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.901 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -105.96 8.3 32.42 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.913 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . 0.407 ' CD1' ' N ' ' B' ' 670' ' ' PHE . 0.0 OUTLIER -120.4 -17.81 8.08 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.557 -179.618 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 670' ' ' PHE . . . . . 0.422 ' O ' ' CD1' ' B' ' 670' ' ' PHE . 0.0 OUTLIER -82.46 153.47 25.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.873 0.368 . . . . 0.0 111.207 -179.634 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -126.22 171.25 11.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.172 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -71.48 148.72 46.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.173 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 673' ' ' VAL . . . . . 0.472 ' CG2' ' HB3' ' A' ' 50' ' ' ALA . 10.8 t -80.61 143.77 55.42 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.961 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -69.24 128.22 16.18 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.615 2.21 . . . . 0.0 112.949 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.93 -159.39 0.84 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.666 179.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 676' ' ' LYS . . . . . 0.458 ' HB3' ' HG3' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -45.91 155.48 0.18 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.802 0.335 . . . . 0.0 111.29 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 6.7 t -162.52 140.76 8.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.844 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.78 121.92 10.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.903 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 26.3 mt 63.25 84.71 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.059 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 30.3 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.165 -0.922 . . . . 0.0 110.909 179.942 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_endo . . . . . 0 N--CA 1.488 1.168 0 CA-C-O 120.816 0.257 . . . . 0.0 111.81 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.75 -37.48 10.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.822 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 29.8 m170 -89.95 16.12 8.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.359 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.545 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 3.5 p -152.65 155.28 37.0 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.046 0.451 . . . . 0.0 111.051 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 174.29 139.97 3.13 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 111.101 -0.799 . . . . 0.0 111.101 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.559 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -84.04 143.99 29.38 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.206 0.527 . . . . 0.0 112.333 -178.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.42 ' CB ' ' HB3' ' A' ' 89' ' ' PHE . . . -153.48 171.26 18.96 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.19 -179.27 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.485 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.99 123.49 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.563 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.44 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.6 t80 -123.85 109.55 13.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.978 0.418 . . . . 0.0 111.082 178.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 30.6 mt-10 67.84 51.27 0.79 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.735 179.087 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.8 mmtp 69.07 -2.74 1.69 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.264 -0.425 . . . . 0.0 112.12 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.424 HG12 ' CZ2' ' A' ' 29' ' ' TRP . 20.1 t -102.81 148.79 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.47 0 CA-C-O 121.096 0.474 . . . . 0.0 110.625 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -111.22 112.47 24.27 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.941 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -131.42 -134.62 3.63 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.829 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.559 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 18.0 mm -135.85 135.62 50.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.721 0.296 . . . . 0.0 111.332 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.503 ' CD1' ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.57 141.23 17.77 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.66 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 176.476 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.545 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -150.93 117.44 5.73 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 119.574 -0.851 . . . . 0.0 111.489 -178.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.492 ' HA ' ' HA ' ' A' ' 27' ' ' LEU . 6.2 mt -87.12 142.28 13.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 114.565 -1.198 . . . . 0.0 111.703 -178.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.499 ' O ' HG21 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -120.13 92.99 3.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.467 179.758 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -80.69 -0.05 36.54 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.411 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -82.93 0.53 43.97 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.289 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.499 HG21 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -101.59 -162.5 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.844 0.354 . . . . 0.0 110.853 179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.5 t -174.06 101.33 0.3 Allowed Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.504 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.426 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 61.1 Cg_endo -73.15 160.3 95.95 Favored 'Cis proline' 0 C--N 1.347 0.486 0 C-N-CA 123.455 -1.477 . . . . 0.0 112.758 0.367 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.15 175.39 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.52 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.434 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.65 136.31 5.24 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.14 179.343 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.545 ' CD1' ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.99 149.15 28.74 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.787 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.5 m -135.15 112.97 10.92 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.546 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 79.4 t90 -92.04 110.64 22.02 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 178.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 15' ' ' ILE . 4.2 ttt180 -110.4 131.23 55.24 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.972 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.7 t -49.83 158.86 0.44 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.475 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 46.1 m -74.74 -37.18 62.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.459 0.647 . . . . 0.0 109.773 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -84.37 -15.96 44.53 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.124 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.59 34.55 11.55 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.322 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -85.37 -26.8 26.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.742 0.306 . . . . 0.0 111.309 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.31 164.24 3.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.319 0.58 . . . . 0.0 111.441 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.511 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.64 147.0 18.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.041 -178.769 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.411 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 38.9 m80 -121.01 119.86 33.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.587 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.43 142.85 28.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.803 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.526 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.1 t -131.54 140.22 48.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.49 -179.437 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.4 ' O ' HG12 ' A' ' 45' ' ' ILE . 49.9 t -103.79 96.43 4.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 177.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.415 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.8 OUTLIER -41.94 -24.77 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.931 -178.819 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.426 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -74.54 -49.09 23.3 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.535 -0.542 . . . . 0.0 109.535 179.218 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 46.6 p -64.64 -27.82 69.19 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.532 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 43.2 mm -56.66 106.92 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.623 178.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.424 ' N ' ' O ' ' A' ' 63' ' ' ILE . 19.5 t70 -52.56 -30.88 33.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.119 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 11.0 pttt -172.49 163.8 5.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.97 179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.413 ' O ' HG23 ' B' ' 673' ' ' VAL . 21.2 tp -108.95 116.68 32.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.56 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -110.92 144.14 40.46 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.61 0.243 . . . . 0.0 110.439 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.5 ' HB3' HD22 ' A' ' 60' ' ' LEU . . . -157.09 148.9 22.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.619 0.247 . . . . 0.0 111.277 -179.588 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.429 HG21 ' CE1' ' B' ' 670' ' ' PHE . 19.6 p -58.82 134.15 86.73 Favored Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.888 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.68 163.27 38.96 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.568 2.178 . . . . 0.0 112.288 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.58 -31.82 64.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.133 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.5 m -70.84 -15.92 62.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.2 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 8.6 t -75.31 119.91 20.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.955 0.407 . . . . 0.0 110.954 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -60.68 -14.1 18.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.683 179.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.81 174.13 6.05 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.937 179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -131.55 114.35 14.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.875 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -144.58 138.49 27.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.286 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.5 HD22 ' HB3' ' A' ' 50' ' ' ALA . 15.2 mt -118.71 140.37 50.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.313 178.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 25.5 ttp180 -141.33 150.42 42.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.076 0.465 . . . . 0.0 112.017 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.532 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.5 mp -128.41 114.13 16.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.836 178.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.481 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 6.7 mm -76.77 156.52 5.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.659 0.266 . . . . 0.0 111.043 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -118.71 159.56 14.35 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.509 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.3 mtpt -59.05 115.1 2.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.809 0.337 . . . . 0.0 110.837 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 13.3 p -100.98 159.79 3.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.312 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -100.39 43.94 1.04 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.798 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.95 -12.07 61.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.308 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -55.0 -24.36 23.88 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.937 0.399 . . . . 0.0 111.115 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.6 mmmt -74.98 -69.36 0.47 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.687 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 42.97 82.31 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.241 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.33 168.01 16.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.277 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 18.0 mmtp -80.45 -166.91 1.17 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.699 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -109.42 -48.65 3.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.057 0.456 . . . . 0.0 110.931 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 168.87 -31.46 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.089 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -100.13 -16.57 17.78 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.324 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 135.54 -7.05 4.25 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.95 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -57.61 -166.11 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.734 0.302 . . . . 0.0 110.904 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -146.39 131.11 17.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.743 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.4 t -95.08 -66.51 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.5 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.423 HG11 ' O ' ' A' ' 81' ' ' VAL . 4.4 p 34.53 81.24 0.24 Allowed Pre-proline 0 CA--C 1.53 0.199 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.684 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_exo -42.11 128.25 4.16 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.954 2.436 . . . . 0.0 112.823 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.0 159.07 85.68 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.949 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -84.78 151.39 11.36 Favored 'Trans proline' 0 N--CA 1.461 -0.44 0 C-N-CA 123.492 2.795 . . . . 0.0 112.488 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -104.71 114.26 28.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.776 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.459 ' HB3' ' HA ' ' A' ' 63' ' ' ILE . 23.2 ptt-85 -123.5 146.22 48.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.798 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.524 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 5.1 m-70 -99.74 111.01 23.37 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 15.4 ttt -94.19 136.31 34.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.071 0.462 . . . . 0.0 111.818 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.503 ' CD2' ' CD1' ' A' ' 16' ' ' ILE . 19.3 m-85 -133.51 116.69 16.27 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.365 179.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.401 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.8 OUTLIER -87.1 115.94 24.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.968 0.413 . . . . 0.0 110.793 -179.959 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.453 ' CE2' ' HA ' ' A' ' 97' ' ' MET . 8.6 m-85 -91.1 137.54 32.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.592 -179.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -101.62 29.4 4.9 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.532 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.423 ' CB ' HG21 ' A' ' 96' ' ' VAL . 4.9 m-20 -175.97 119.95 0.16 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.432 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.431 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 10.7 ttp85 -60.98 -15.06 27.26 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.718 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -75.67 -47.57 25.71 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.954 0.407 . . . . 0.0 110.387 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.423 HG21 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -66.91 -42.86 89.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.722 179.286 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.453 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 0.1 OUTLIER -65.76 -36.95 85.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.953 179.415 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.42 ' N ' ' HG3' ' A' ' 97' ' ' MET . 6.4 m-20 -65.25 -27.24 68.51 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.269 179.047 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.425 ' O ' ' HG2' ' A' ' 102' ' ' MET . 66.9 m-20 -81.74 -52.49 7.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.599 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.444 HG13 ' CE2' ' A' ' 91' ' ' PHE . 12.6 mm -63.16 -59.3 4.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.094 0.473 . . . . 0.0 110.488 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.434 ' HB2' HD22 ' A' ' 60' ' ' LEU . 6.4 ttmt -47.33 -36.31 9.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.415 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.425 ' HG2' ' O ' ' A' ' 99' ' ' ASN . 7.7 ptp -83.47 -37.78 22.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.726 -179.23 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.485 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 0.9 OUTLIER -70.9 -27.68 63.97 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.181 -178.954 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.432 ' O ' ' CG1' ' A' ' 108' ' ' ILE . 5.4 mt -71.22 -43.34 67.53 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -50.39 70.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.243 -0.889 . . . . 0.0 112.449 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.485 ' HG3' ' O ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -49.29 -30.29 7.17 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.072 0.463 . . . . 0.0 110.656 -179.295 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.55 HG23 ' OH ' ' A' ' 111' ' ' TYR . 9.0 mt -85.03 -52.72 12.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.412 179.314 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.64 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.39 -56.75 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.298 179.396 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -46.88 -28.15 1.49 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.295 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.521 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.0 OUTLIER -73.46 -25.01 60.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.177 179.73 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.64 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.2 OUTLIER -74.04 -35.22 64.32 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 179.576 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.763 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.28 -42.89 18.23 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 179.019 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -61.54 -32.03 72.08 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.014 -1.448 . . . . 0.0 108.957 178.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.444 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.58 -18.95 22.44 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.752 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.8 t0 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.235 -0.888 . . . . 0.0 111.045 179.998 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 17.4 p-10 . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.859 0.361 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 8.7 tt -60.43 -48.25 82.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.852 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -176.86 80.02 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.989 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 21.5 t 64.35 94.41 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.1 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 665' ' ' LEU . . . . . 0.401 ' CD1' ' CD2' ' B' ' 669' ' ' LEU . 1.9 pt? -95.07 167.18 11.54 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.905 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 666' ' ' SER . . . . . 0.481 ' O ' ' CD1' ' B' ' 670' ' ' PHE . 0.1 OUTLIER -179.53 -73.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.036 0.446 . . . . 0.0 111.13 179.9 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -94.02 19.44 9.11 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.614 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -92.64 -46.26 7.68 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.537 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . 0.401 ' CD2' ' CD1' ' B' ' 665' ' ' LEU . 4.6 pp -120.53 20.01 11.88 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.472 -179.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 670' ' ' PHE . . . . . 0.481 ' CD1' ' O ' ' B' ' 666' ' ' SER . 1.5 m-85 -88.5 141.68 28.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.904 0.383 . . . . 0.0 111.275 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -128.66 126.91 41.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.622 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -67.78 108.85 3.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.121 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 673' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 48' ' ' LEU . 33.8 m -58.22 138.37 84.47 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.727 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -54.6 127.98 28.33 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.276 1.984 . . . . 0.0 112.427 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -139.47 116.94 11.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.684 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 11.4 pttt -179.52 161.71 1.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.944 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 94.5 p -111.14 -22.64 11.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.223 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 59.5 95.28 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.888 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 679' ' ' ILE . . . . . 0.42 ' CD1' ' N ' ' B' ' 679' ' ' ILE . 0.2 OUTLIER -139.34 31.28 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.164 179.956 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.934 179.991 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo . . . . . 0 N--CA 1.489 1.248 0 CA-C-O 120.838 0.266 . . . . 0.0 111.827 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.34 -37.54 7.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.824 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.449 ' CD2' HG22 ' A' ' 18' ' ' ILE . 1.6 t-160 -61.39 -13.07 17.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.826 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.427 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 0.5 OUTLIER -137.99 161.7 36.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.023 0.44 . . . . 0.0 110.875 179.881 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.49 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 171.54 138.76 2.61 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 111.168 -0.773 . . . . 0.0 111.168 -179.612 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.561 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -84.13 140.95 31.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.075 0.464 . . . . 0.0 112.228 -178.732 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -149.65 171.25 16.97 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.254 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.476 ' N ' ' CD1' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.93 125.12 56.12 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.707 -179.667 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.447 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.5 t80 -125.28 109.49 12.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.912 0.387 . . . . 0.0 111.12 178.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.416 ' HG3' ' CE1' ' A' ' 9' ' ' PHE . 47.1 mt-10 67.51 49.15 1.03 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.9 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 mmmt 71.76 -4.88 1.8 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.225 -0.443 . . . . 0.0 112.17 179.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.431 HG11 ' CZ2' ' A' ' 29' ' ' TRP . 17.1 t -100.91 148.72 6.75 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.458 0 CA-C-O 121.087 0.47 . . . . 0.0 110.526 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.402 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -111.6 113.09 25.27 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.898 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -131.4 -133.29 3.47 Favored Glycine 0 N--CA 1.445 -0.713 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.03 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.561 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 19.4 mm -136.31 135.9 49.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 120.648 0.261 . . . . 0.0 111.297 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.491 ' CD1' ' CD2' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.81 140.8 18.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 106.452 -1.684 . . . . 0.0 106.452 176.637 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.427 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.32 117.17 5.49 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 121.687 0.756 . . . . 0.0 111.244 -178.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.509 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 7.5 mt -81.73 143.22 12.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 114.481 -1.236 . . . . 0.0 112.578 -178.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -126.17 111.71 14.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.245 179.23 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.425 ' HG2' ' NE2' ' A' ' 3' ' ' HIS . 0.0 OUTLIER -100.41 -2.58 33.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.261 -179.541 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.87 -4.87 40.48 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.985 0.421 . . . . 0.0 110.241 178.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -92.29 -159.7 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.176 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.427 179.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.4 p -179.27 99.29 0.2 Allowed Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.545 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.451 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 10.6 Cg_exo -71.04 164.97 81.54 Favored 'Cis proline' 0 C--N 1.347 0.471 0 C-N-CA 123.697 -1.376 . . . . 0.0 112.625 0.322 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.14 176.15 0.08 Allowed 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.562 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.505 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.84 139.6 6.41 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.017 178.97 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.573 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.4 OUTLIER -107.71 146.37 32.19 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 178.722 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -128.49 112.93 14.87 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -178.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.526 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 78.5 t90 -92.13 110.63 22.01 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.467 ' O ' ' N ' ' A' ' 15' ' ' ILE . 18.9 ttm180 -110.6 131.55 54.95 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.67 0.271 . . . . 0.0 110.934 -179.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.3 m -49.97 159.33 0.42 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.489 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 42.5 m -74.91 -37.1 62.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.358 0.599 . . . . 0.0 109.737 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -84.91 -15.96 42.76 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.184 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.94 34.28 11.23 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.311 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -85.26 -26.22 26.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.722 0.296 . . . . 0.0 111.386 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.43 164.79 3.18 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.24 0.543 . . . . 0.0 111.546 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.503 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.35 146.89 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.051 -178.822 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.419 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 35.3 m80 -121.04 120.33 35.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.614 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.42 138.8 33.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.691 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.573 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -125.32 140.43 48.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.458 -179.623 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.433 ' O ' HG12 ' A' ' 45' ' ' ILE . 44.1 t -104.08 94.42 3.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 177.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.442 ' CB ' ' OH ' ' A' ' 111' ' ' TYR . 0.6 OUTLIER -42.1 -24.8 0.05 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.088 -0.506 . . . . 0.0 112.031 -178.864 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.451 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 1.2 t -76.02 -48.62 20.28 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.402 ' CG2' ' HB ' ' A' ' 41' ' ' VAL . 30.0 p -64.58 -27.88 69.25 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 178.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.531 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 44.8 mm -56.54 109.12 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.536 178.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 63' ' ' ILE . 24.3 t0 -53.22 -31.84 45.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.829 0.347 . . . . 0.0 110.933 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 11.2 pttt -172.66 164.65 5.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.836 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.434 HD23 ' HB2' ' A' ' 104' ' ' LEU . 8.2 tp -108.88 116.36 31.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.611 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -110.04 144.86 38.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.638 0.256 . . . . 0.0 110.542 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.474 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -156.98 145.74 19.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.634 0.254 . . . . 0.0 111.082 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 54.5 p -60.11 143.14 88.83 Favored Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.724 0.297 . . . . 0.0 110.978 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.85 163.25 33.77 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.652 2.234 . . . . 0.0 112.436 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.98 -29.36 70.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.121 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.9 m -70.85 -18.12 62.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.131 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.3 t -97.28 115.51 27.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.945 0.402 . . . . 0.0 110.791 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -57.99 -17.59 18.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.753 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.3 mmmt -82.21 98.92 8.98 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.735 179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.2 mpp? -83.11 111.07 18.56 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.771 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.43 ' HB2' ' CE1' ' B' ' 670' ' ' PHE . 29.8 mtm -149.5 142.31 24.67 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.637 -179.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.474 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 18.7 mt -119.47 143.37 47.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.065 178.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' A' ' 87' ' ' HIS . 24.3 ttp180 -143.59 150.58 39.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.968 0.413 . . . . 0.0 111.699 -179.049 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.531 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.7 mp -128.02 115.18 18.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.776 178.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.468 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 6.4 mm -76.53 156.44 5.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.661 0.267 . . . . 0.0 110.89 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -120.4 144.36 17.07 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.484 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -58.85 122.3 13.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.801 0.334 . . . . 0.0 110.852 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.461 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 14.6 p -95.38 159.53 2.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.313 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 21.0 p-10 -108.01 55.62 0.64 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.877 -0.602 . . . . 0.0 109.857 179.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.95 41.45 1.0 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.371 -179.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 32.8 t -110.52 -19.68 12.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.082 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.9 mmtp -81.54 -55.43 4.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.857 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 61.34 93.07 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.899 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -95.37 -173.71 2.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.918 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.0 -176.63 3.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.712 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -106.09 -39.58 5.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.988 0.423 . . . . 0.0 110.81 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 165.14 -30.14 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.821 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -108.56 40.11 1.85 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.032 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 69.35 11.4 64.53 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.47 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -56.6 -165.69 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.108 0 CA-C-O 120.692 0.282 . . . . 0.0 110.84 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -135.54 120.88 19.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.858 0.361 . . . . 0.0 111.016 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 63.0 t -91.99 -63.52 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.494 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.503 ' O ' ' CG1' ' A' ' 81' ' ' VAL . 0.9 OUTLIER 40.7 94.21 0.05 OUTLIER Pre-proline 0 CA--C 1.535 0.38 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.093 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -50.66 134.11 39.8 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.515 2.144 . . . . 0.0 112.478 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.73 161.53 73.93 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.915 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.461 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 6.2 Cg_exo -82.44 145.58 13.37 Favored 'Trans proline' 0 N--CA 1.461 -0.426 0 C-N-CA 123.563 2.842 . . . . 0.0 112.278 -179.182 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -94.87 157.97 15.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.0 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.87 138.54 3.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.761 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.506 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 4.3 m-70 -100.73 111.34 23.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.834 0.349 . . . . 0.0 110.262 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.413 ' HE1' ' CE1' ' B' ' 670' ' ' PHE . 0.0 OUTLIER -94.3 142.14 27.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.149 0.5 . . . . 0.0 111.406 -179.338 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.491 ' CD2' ' CD1' ' A' ' 16' ' ' ILE . 61.0 m-85 -139.86 116.83 11.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.574 179.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -91.22 115.16 27.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.926 0.393 . . . . 0.0 110.596 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.444 ' CE2' ' HA ' ' A' ' 97' ' ' MET . 8.7 m-85 -91.05 136.85 32.8 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.533 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 20.2 m-20 -100.24 29.52 4.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.424 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.421 ' CB ' HG22 ' A' ' 96' ' ' VAL . 5.2 m-20 -175.58 116.74 0.15 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.541 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.438 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -57.2 -16.48 8.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.957 179.803 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.43 -49.75 21.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.852 0.358 . . . . 0.0 110.265 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.421 HG22 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -65.82 -41.52 90.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.637 179.26 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.444 ' HA ' ' CE2' ' A' ' 91' ' ' PHE . 0.0 OUTLIER -66.67 -37.94 85.8 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.955 179.472 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.436 ' N ' ' HG3' ' A' ' 97' ' ' MET . 20.1 m-20 -66.67 -24.64 66.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.112 0.482 . . . . 0.0 109.921 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -81.71 -63.24 1.43 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.358 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.48 HD13 HG22 ' A' ' 100' ' ' ILE . 14.3 mm -53.48 -53.85 22.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.579 179.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.41 ' HB2' HD23 ' A' ' 60' ' ' LEU . 0.2 OUTLIER -51.4 -29.55 16.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.924 179.908 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 5.1 mtm -83.08 -48.11 10.94 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.132 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.509 ' HB ' ' CD1' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -53.38 -58.11 8.27 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.109 179.554 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.434 ' HB2' HD23 ' A' ' 48' ' ' LEU . 3.9 mt -46.34 -53.34 11.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.192 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.33 -45.58 87.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.167 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -51.34 -32.95 27.4 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.048 0.452 . . . . 0.0 110.287 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.6 HG21 ' OH ' ' A' ' 111' ' ' TYR . 10.3 mt -85.82 -52.11 12.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.51 179.217 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.663 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.14 -57.22 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.56 179.623 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.25 -27.05 1.37 Allowed 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.597 -0.728 . . . . 0.0 111.067 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.439 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 27.1 mtt180 -73.25 -25.08 60.57 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.359 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.663 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -75.68 -34.15 60.42 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.734 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.774 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.66 -43.35 17.02 Favored 'General case' 0 CA--C 1.507 -0.7 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.945 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -61.44 -32.07 72.03 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 113.858 -1.519 . . . . 0.0 108.987 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.439 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.64 -18.88 22.48 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.666 178.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 37.6 t70 . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.301 -0.857 . . . . 0.0 111.092 179.9 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.808 0.337 . . . . 0.0 111.213 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -122.84 -50.37 1.95 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.845 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 60.91 92.63 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.837 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 6.2 m -139.23 77.22 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.144 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 665' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -97.5 109.95 22.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.891 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 666' ' ' SER . . . . . 0.434 ' O ' ' CD1' ' B' ' 670' ' ' PHE . 26.3 p -177.68 -80.37 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.992 0.425 . . . . 0.0 111.04 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -94.17 19.31 9.47 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.585 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -93.87 -39.31 10.77 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.117 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -120.58 19.89 11.87 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.215 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 670' ' ' PHE . . . . . 0.434 ' CD1' ' O ' ' B' ' 666' ' ' SER . 1.5 m-85 -98.83 158.25 15.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.881 0.372 . . . . 0.0 111.06 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -149.87 126.99 11.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.829 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -60.62 123.71 18.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.049 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 673' ' ' VAL . . . . . 0.425 ' CG1' ' HB1' ' A' ' 50' ' ' ALA . 25.9 m -74.35 146.38 84.02 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.973 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -56.32 128.33 29.69 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.476 2.117 . . . . 0.0 112.288 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -139.15 116.96 11.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.802 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -178.75 166.0 1.67 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.92 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 54.0 p -126.03 38.87 4.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.939 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 -176.59 134.59 0.23 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.947 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 3.3 tt -149.48 53.59 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.998 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.911 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo . . . . . 0 N--CA 1.488 1.164 0 CA-C-O 120.87 0.279 . . . . 0.0 111.845 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.4 m -106.82 -31.56 8.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.888 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -84.76 13.91 5.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.456 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.54 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 2.6 p -154.0 150.41 28.24 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.303 0.573 . . . . 0.0 111.335 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.469 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 178.64 138.68 3.25 Favored Glycine 0 N--CA 1.448 -0.511 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 -179.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.561 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.58 145.74 29.55 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.484 ' HB3' ' CZ ' ' A' ' 91' ' ' PHE . . . -154.41 171.38 19.43 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.337 -179.11 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.483 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.63 122.58 55.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.82 -179.466 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.432 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 6.6 t80 -123.1 109.35 13.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.949 0.404 . . . . 0.0 111.237 178.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.42 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 24.8 mt-10 68.11 49.07 0.89 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.812 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 13.1 mttm 71.5 -3.82 2.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.237 -0.438 . . . . 0.0 112.137 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.434 HG13 ' CZ2' ' A' ' 29' ' ' TRP . 18.2 t -101.68 148.5 7.37 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.55 0 CA-C-O 121.123 0.487 . . . . 0.0 110.587 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.7 112.89 25.08 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.806 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -131.5 -135.12 3.69 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.006 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.561 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 18.2 mm -135.87 134.93 51.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.543 0 CA-C-O 120.608 0.242 . . . . 0.0 111.435 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.471 ' CD1' ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.43 141.71 16.85 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.649 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 176.388 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.54 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -150.87 118.62 6.15 Favored 'General case' 0 C--N 1.31 -1.117 0 C-N-CA 119.64 -0.824 . . . . 0.0 111.542 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.501 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 11.0 mt -86.71 142.02 13.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 114.697 -1.138 . . . . 0.0 111.887 -178.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.498 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.8 t30 -118.97 93.1 3.98 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.316 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -80.79 0.02 36.64 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.33 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -82.66 0.6 42.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.624 0.249 . . . . 0.0 111.304 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.498 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.04 -162.76 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.807 0.337 . . . . 0.0 110.832 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.4 t -175.97 101.75 0.25 Allowed Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.339 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.446 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 11.0 Cg_exo -69.95 161.46 86.7 Favored 'Cis proline' 0 C--N 1.347 0.483 0 C-N-CA 123.597 -1.418 . . . . 0.0 112.619 0.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.417 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -54.76 178.49 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.3 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.5 pp20? -163.67 133.92 4.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.331 179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.573 ' CD1' ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.92 144.5 35.09 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 178.706 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.3 m -131.48 113.64 13.93 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.702 0.631 . . . . 0.0 112.702 -178.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.545 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 78.8 t90 -92.06 110.43 21.8 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 178.263 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.402 ' O ' ' N ' ' A' ' 15' ' ' ILE . 22.4 ttt-85 -110.2 131.11 55.35 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.674 0.274 . . . . 0.0 110.822 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.1 m -49.91 158.22 0.53 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.626 0.25 . . . . 0.0 110.493 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 44.7 m -74.1 -37.0 64.29 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.421 0.629 . . . . 0.0 109.751 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.48 -16.25 43.14 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.021 -0.991 . . . . 0.0 111.087 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.66 34.42 11.59 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.302 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -85.88 -25.76 26.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.688 0.28 . . . . 0.0 111.425 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.68 164.18 2.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.314 0.578 . . . . 0.0 111.35 -179.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.514 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.65 147.91 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.048 -178.767 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 50.0 m-70 -122.09 119.19 30.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.734 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.49 141.2 30.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.831 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.551 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -127.5 141.01 47.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.449 -179.511 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.434 ' O ' HG12 ' A' ' 45' ' ' ILE . 21.1 t -103.89 93.54 2.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 178.138 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.432 HD22 ' N ' ' A' ' 42' ' ' LEU . 0.6 OUTLIER -41.23 -25.12 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.09 -0.504 . . . . 0.0 112.11 -178.827 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.446 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER -74.66 -49.79 20.11 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 179.175 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 30.0 p -64.66 -27.51 68.98 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.53 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 34.5 mm -56.6 109.24 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.661 179.044 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.414 ' N ' ' O ' ' A' ' 63' ' ' ILE . 12.6 t70 -51.76 -34.01 37.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.137 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.43 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 0.7 OUTLIER -169.64 165.41 10.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.089 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.411 ' CD1' ' CD1' ' A' ' 104' ' ' LEU . 45.1 tp -108.77 118.3 36.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.499 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -115.76 147.22 41.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.602 0.239 . . . . 0.0 110.512 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.464 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -157.14 137.2 12.62 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.148 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.424 ' CG2' ' CE1' ' B' ' 670' ' ' PHE . 42.8 p -55.33 121.19 35.85 Favored Pre-proline 0 CA--C 1.53 0.207 0 CA-C-O 120.58 0.229 . . . . 0.0 110.865 -179.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -68.23 163.4 36.36 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.45 2.1 . . . . 0.0 112.347 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.52 -31.0 22.36 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.338 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.7 t -70.85 -17.6 62.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.068 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.7 t -82.0 119.8 24.45 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.873 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -64.29 -11.45 32.02 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.866 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.7 108.7 18.24 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.941 0.401 . . . . 0.0 111.134 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.72 106.69 8.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.632 179.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.419 ' HB2' ' CZ ' ' B' ' 670' ' ' PHE . 35.2 mtm -149.65 155.51 40.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.132 0.491 . . . . 0.0 111.983 -179.365 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.464 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 28.6 mt -123.38 149.76 44.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.165 178.419 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.429 ' HB2' ' CE2' ' B' ' 670' ' ' PHE . 28.4 ttp180 -146.18 150.87 36.67 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.916 0.389 . . . . 0.0 112.029 -179.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.53 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.3 mp -128.34 116.87 20.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.175 178.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.43 ' CG1' ' CG ' ' A' ' 47' ' ' LYS . 22.6 mm -76.64 156.47 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.683 0.277 . . . . 0.0 111.011 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -122.41 169.2 14.94 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.352 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.95 118.18 31.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.768 0.318 . . . . 0.0 110.935 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.51 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 10.2 p -72.61 160.34 5.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.613 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -128.02 35.75 4.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.757 0.313 . . . . 0.0 111.411 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 40.31 31.87 0.11 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.522 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.8 m -95.32 -26.61 15.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.877 0.37 . . . . 0.0 110.986 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.09 -77.74 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.751 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.6 mtpm? 56.15 89.95 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.002 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.99 123.15 48.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.823 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -75.38 159.93 30.85 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.851 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -97.32 -64.04 1.08 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.085 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -178.05 -34.71 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.172 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -92.0 40.8 1.05 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.115 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 59.43 18.01 42.02 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.777 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -90.97 118.21 30.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.746 0.307 . . . . 0.0 110.836 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -87.57 115.8 25.25 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.822 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 17.4 t -111.79 139.25 37.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.638 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.405 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 35.9 t -96.34 90.12 0.68 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.462 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 81' ' ' VAL . 1.4 Cg_endo -45.44 151.0 1.12 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.861 2.374 . . . . 0.0 112.759 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 18.1 mttt -46.47 166.34 0.17 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.543 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.51 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 7.8 Cg_exo -77.17 148.33 27.16 Favored 'Trans proline' 0 N--CA 1.464 -0.22 0 C-N-CA 123.72 2.947 . . . . 0.0 112.294 -179.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -50.33 156.56 0.83 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.953 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -154.61 138.79 16.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.776 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.47 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 5.6 m-70 -102.84 111.26 23.5 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 179.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.43 ' CE ' ' CE1' ' B' ' 670' ' ' PHE . 2.8 ttt -109.34 131.5 55.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.269 -179.388 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.53 ' CD1' ' N ' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -131.05 117.18 18.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.376 179.684 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.13 114.32 21.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.231 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.484 ' CZ ' ' HB3' ' A' ' 7' ' ' ALA . 7.8 m-85 -91.17 136.36 33.14 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.945 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 59.3 m-20 -93.52 43.46 1.12 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.789 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.478 ' CB ' HG22 ' A' ' 96' ' ' VAL . 1.8 m-20 175.2 113.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.229 -179.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.403 ' O ' ' HB2' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -56.16 -17.41 7.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.079 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.95 -45.66 56.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.1 0.476 . . . . 0.0 110.171 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.478 HG22 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -65.32 -49.57 77.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.396 179.087 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.401 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.1 OUTLIER -62.62 -37.09 84.92 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.727 179.731 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.405 ' HA ' ' HG2' ' A' ' 101' ' ' LYS . 69.1 m-20 -73.35 -31.08 63.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.029 0.442 . . . . 0.0 110.445 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -80.25 -27.92 38.57 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.291 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.419 HD11 ' N ' ' A' ' 5' ' ' GLY . 1.6 mm -85.13 -52.82 11.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.699 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.405 ' HG2' ' HA ' ' A' ' 98' ' ' ASP . 8.6 ptpt -48.59 -28.97 3.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.796 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -78.11 -39.81 40.19 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.081 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.501 ' HB ' ' CD1' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -59.05 -61.03 2.94 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.501 179.551 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.418 ' O ' ' CG1' ' A' ' 108' ' ' ILE . 7.3 mt -46.76 -56.09 6.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.715 179.397 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.425 ' NE2' HG21 ' B' ' 673' ' ' VAL . 0.0 OUTLIER -55.67 -45.51 77.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.054 179.378 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -51.92 -35.36 45.42 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-O 121.168 0.508 . . . . 0.0 110.57 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.602 HG21 ' OH ' ' A' ' 111' ' ' TYR . 11.3 mt -85.75 -51.08 13.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.669 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.646 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -42.25 -57.03 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.585 179.654 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.15 -28.47 1.83 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.261 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.499 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 3.1 mtt180 -72.44 -24.89 61.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.28 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.646 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.2 OUTLIER -74.57 -36.11 63.05 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 179.77 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.766 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.46 -43.45 17.24 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 107.875 -1.158 . . . . 0.0 107.875 179.039 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -60.96 -30.35 70.19 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 113.93 -1.486 . . . . 0.0 108.922 178.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.456 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -91.33 -20.89 21.37 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.594 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.865 179.742 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 120.843 0.354 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 3.4 mp -97.81 -44.02 6.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.927 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 60.62 49.27 6.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.889 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 14.6 p 43.74 39.83 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.506 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 665' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -76.5 108.75 9.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.852 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 666' ' ' SER . . . . . 0.439 ' O ' ' CD1' ' B' ' 670' ' ' PHE . 12.6 p -179.04 -39.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.004 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -94.3 19.33 9.61 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.681 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -101.97 -35.74 8.86 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.557 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . 0.44 ' N ' ' CD1' ' B' ' 669' ' ' LEU . 0.0 OUTLIER -120.61 20.02 11.83 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.534 -179.868 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 670' ' ' PHE . . . . . 0.439 ' CD1' ' O ' ' B' ' 666' ' ' SER . 1.6 m-85 -101.41 148.42 25.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.891 0.377 . . . . 0.0 111.073 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -140.64 126.9 19.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.77 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -59.84 108.01 0.69 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.91 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 673' ' ' VAL . . . . . 0.425 HG21 ' NE2' ' A' ' 105' ' ' GLN . 2.6 m -56.04 157.25 8.8 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.014 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.21 131.4 40.96 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.707 2.271 . . . . 0.0 112.555 -179.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.11 136.27 35.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.703 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.46 165.67 2.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.939 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 1.5 m -176.62 121.87 0.15 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.898 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -135.37 151.61 50.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.871 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 2.7 pp -138.09 31.16 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.12 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 2.9 m . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.953 179.964 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo . . . . . 0 N--CA 1.487 1.14 0 CA-C-O 120.865 0.277 . . . . 0.0 111.633 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.83 -32.42 67.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.983 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.414 ' CE1' ' HB2' ' A' ' 20' ' ' GLU . 30.5 m170 -90.38 14.36 13.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.5 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.543 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 2.7 p -151.85 154.69 36.66 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.222 0.534 . . . . 0.0 111.242 179.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.483 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 172.37 137.98 2.47 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 -179.522 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.574 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.94 144.34 30.08 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -178.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.423 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -155.38 171.38 19.97 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.062 -179.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.485 HG12 ' HB3' ' A' ' 90' ' ' SER . 4.8 mm -102.16 128.82 54.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.432 ' O ' ' HB2' ' A' ' 10' ' ' GLU . 6.8 t80 -127.29 109.38 11.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.0 0.429 . . . . 0.0 110.889 177.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 22.4 mt-10 69.0 50.38 0.59 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.747 179.242 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.6 mttt 69.77 -4.76 1.36 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.134 -0.484 . . . . 0.0 112.084 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.421 HG13 ' CZ2' ' A' ' 29' ' ' TRP . 13.8 t -101.55 144.24 13.39 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.476 0 CA-C-O 121.201 0.524 . . . . 0.0 110.745 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.434 ' CB ' HD12 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -99.25 113.83 26.31 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.898 179.957 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -136.04 -168.1 11.42 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.84 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.574 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 14.0 mm -107.59 136.21 43.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.76 0.314 . . . . 0.0 111.285 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.527 ' CD1' ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.73 141.37 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 176.808 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.543 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.52 117.25 5.44 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 119.634 -0.827 . . . . 0.0 111.469 -178.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.532 ' HA ' ' HA ' ' A' ' 27' ' ' LEU . 5.3 mt -85.63 142.75 12.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.629 -178.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.504 ' O ' HG22 ' A' ' 22' ' ' VAL . 2.6 t30 -119.45 96.37 5.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.609 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.414 ' HB2' ' CE1' ' A' ' 3' ' ' HIS . 1.5 mt-10 -79.86 -0.86 36.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.261 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -81.86 -0.06 41.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.612 0.244 . . . . 0.0 111.387 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.504 HG22 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -100.97 -162.45 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.82 0.343 . . . . 0.0 110.74 179.883 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 53.8 p -176.51 100.23 0.24 Allowed Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.37 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.435 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 13.4 Cg_exo -68.91 165.82 73.18 Favored 'Cis proline' 0 C--N 1.346 0.409 0 C-N-CA 123.626 -1.406 . . . . 0.0 112.723 0.36 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.425 ' HB1' HG23 ' A' ' 107' ' ' ILE . . . -56.79 178.03 0.07 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.153 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.409 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 9.1 mt-10 -163.4 133.49 4.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.429 179.458 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.554 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.3 OUTLIER -108.11 140.78 40.8 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.58 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.2 m -126.08 112.86 16.34 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -178.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.501 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 73.8 t90 -91.98 110.4 21.76 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.522 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.3 ttt180 -107.35 131.03 54.69 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.668 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 27.1 t -49.88 156.21 0.77 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.718 0.294 . . . . 0.0 110.654 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 21.4 m -73.77 -34.35 64.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.223 0.535 . . . . 0.0 109.832 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -87.36 -16.58 34.58 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.187 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.35 33.72 11.39 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.306 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -87.61 -25.83 23.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.694 0.283 . . . . 0.0 111.451 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.53 165.1 3.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.308 0.575 . . . . 0.0 111.537 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.484 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.5 OUTLIER -142.42 155.43 18.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.934 -178.853 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -130.03 119.33 22.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.709 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.48 138.9 33.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.599 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.554 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -126.16 141.12 46.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.5 -179.5 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.411 ' O ' HG12 ' A' ' 45' ' ' ILE . 41.7 t -103.87 94.39 3.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.057 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.412 HD13 ' CD2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -41.94 -25.49 0.06 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.836 -179.085 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.435 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -74.88 -49.2 21.24 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 179.236 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.406 ' CG2' ' HB ' ' A' ' 41' ' ' VAL . 30.3 p -64.7 -27.54 68.98 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.451 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.537 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 39.9 mm -56.32 104.44 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.357 178.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' A' ' 63' ' ' ILE . 31.5 t70 -47.98 -31.73 5.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.841 0.353 . . . . 0.0 111.297 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.1 pttt -172.54 162.13 5.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.792 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.403 ' CD1' HD13 ' A' ' 104' ' ' LEU . 10.6 tp -108.91 122.42 47.18 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.757 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.406 ' HB2' ' HB3' ' A' ' 61' ' ' ARG . 11.6 mt-30 -119.65 146.31 45.68 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.567 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.488 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -157.08 138.86 14.21 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.673 -0.239 . . . . 0.0 111.101 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.463 ' CG2' ' CE1' ' B' ' 670' ' ' PHE . 37.1 p -60.16 142.42 89.72 Favored Pre-proline 0 C--N 1.332 -0.167 0 CA-C-O 120.643 0.259 . . . . 0.0 110.894 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.87 163.28 39.35 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.584 2.19 . . . . 0.0 112.551 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.38 -25.25 67.48 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.276 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.3 p -70.57 -18.38 62.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.046 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 74.6 m -103.07 113.24 26.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.769 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -57.09 -17.97 12.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.879 179.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 27.0 mmmt -71.96 72.3 0.84 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.892 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.11 106.71 0.4 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.75 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 25.1 mtm -149.79 138.38 20.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.073 0.463 . . . . 0.0 112.012 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.488 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 22.3 mt -118.06 145.01 45.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.712 178.272 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.418 ' HG3' ' HA ' ' A' ' 88' ' ' MET . 10.5 ttm-85 -143.43 147.38 34.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.005 0.431 . . . . 0.0 112.131 -179.004 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.537 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.6 mp -128.3 115.05 17.7 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.662 178.436 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.473 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 6.8 mm -76.76 156.19 5.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 C-N-CA 121.02 -0.272 . . . . 0.0 111.016 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -117.79 149.14 18.58 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.551 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 66.8 mttt -60.1 116.08 3.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.87 0.367 . . . . 0.0 110.768 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.403 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 15.0 p -98.91 159.6 3.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.431 -179.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -109.19 57.22 0.61 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.82 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -88.25 33.67 0.74 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.555 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 67.8 p -81.88 -19.1 41.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.793 0.33 . . . . 0.0 111.067 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.3 mmtp -79.82 -78.33 0.16 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.855 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 6.2 mttt 58.89 91.84 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.765 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.21 -178.32 7.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.197 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.6 mmtt -82.43 -178.93 7.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.762 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -113.38 -37.34 4.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.032 0.444 . . . . 0.0 111.039 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 168.88 -32.3 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.019 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -105.68 38.56 1.96 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.926 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.26 16.31 57.84 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.651 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 36.2 m-20 -72.9 -166.19 0.28 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.705 0.288 . . . . 0.0 110.742 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -139.19 108.03 5.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.876 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.401 ' O ' ' C ' ' A' ' 81' ' ' VAL . 59.2 t -77.88 -66.05 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.283 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.428 HG11 ' O ' ' A' ' 81' ' ' VAL . 4.7 p 33.22 83.58 0.2 Allowed Pre-proline 0 CA--C 1.531 0.24 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.674 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -41.32 124.79 2.4 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.947 2.431 . . . . 0.0 112.869 -179.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 10.3 mtmt -78.05 162.33 67.58 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.051 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.403 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.1 Cg_exo -83.64 171.03 11.16 Favored 'Trans proline' 0 N--CA 1.46 -0.476 0 C-N-CA 123.629 2.886 . . . . 0.0 112.388 -179.065 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -127.05 114.57 17.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.893 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.442 ' HB3' ' HA ' ' A' ' 63' ' ' ILE . 0.0 OUTLIER -121.44 145.12 48.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.747 -179.886 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.507 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 10.5 m-70 -96.72 111.66 23.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.335 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.418 ' HA ' ' HG3' ' A' ' 61' ' ' ARG . 6.6 ttt -94.13 124.63 38.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.095 0.474 . . . . 0.0 111.282 -179.54 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.527 ' CD1' ' CD1' ' A' ' 16' ' ' ILE . 89.8 m-85 -122.93 116.85 24.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.551 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.485 ' HB3' HG12 ' A' ' 8' ' ' ILE . 0.3 OUTLIER -92.2 114.66 27.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.837 0.351 . . . . 0.0 110.849 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.468 ' CE2' HG13 ' A' ' 100' ' ' ILE . 31.1 m-85 -97.34 143.54 27.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.111 0.481 . . . . 0.0 111.399 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 20.1 m-20 -106.57 38.29 2.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.777 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.429 ' CB ' HG22 ' A' ' 96' ' ' VAL . 5.3 m-20 -179.87 122.92 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.991 -179.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.456 ' HA ' ' HG3' ' A' ' 97' ' ' MET . 20.0 tpt85 -65.83 -14.41 61.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.474 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.91 -43.07 56.28 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 121.211 0.529 . . . . 0.0 110.023 179.452 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.464 ' HB ' ' HD2' ' A' ' 91' ' ' PHE . 0.2 OUTLIER -62.6 -51.74 68.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.145 179.059 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.456 ' HG3' ' HA ' ' A' ' 94' ' ' ARG . 0.9 OUTLIER -51.87 -44.87 63.87 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.392 178.656 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.451 ' O ' ' HB2' ' A' ' 102' ' ' MET . 1.2 m-20 -53.41 -29.44 35.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.975 179.03 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.5 m-20 -82.48 -53.83 5.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.125 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.468 HG13 ' CE2' ' A' ' 91' ' ' PHE . 11.0 mm -70.88 -60.46 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.963 -179.318 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 10.6 ttmt -48.6 -35.38 13.45 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.516 -179.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.451 ' HB2' ' O ' ' A' ' 98' ' ' ASP . 33.3 mtm -83.45 -29.62 27.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.715 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.408 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -76.36 -45.35 32.41 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.485 -179.648 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.418 HD11 ' CG2' ' A' ' 100' ' ' ILE . 5.4 mt -53.53 -53.86 45.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.038 0.447 . . . . 0.0 109.923 179.32 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.407 ' NE2' ' CG2' ' B' ' 673' ' ' VAL . 0.3 OUTLIER -56.7 -47.43 79.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.146 179.901 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -47.28 -36.01 8.59 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 121.26 0.552 . . . . 0.0 110.37 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.618 HG23 ' OH ' ' A' ' 111' ' ' TYR . 12.3 mt -85.75 -51.81 12.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.143 179.094 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.65 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.4 -59.19 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.34 179.129 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -46.76 -27.38 1.18 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.228 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.456 ' HB3' ' O ' ' A' ' 107' ' ' ILE . 0.0 OUTLIER -73.97 -24.79 59.67 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.88 179.964 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.65 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.2 OUTLIER -73.98 -37.08 64.57 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.265 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.738 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -80.23 -43.62 21.12 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 179.14 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -61.4 -30.78 70.77 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.886 -1.507 . . . . 0.0 109.051 178.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.452 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.73 -19.65 21.58 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.631 178.745 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.2 t70 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.236 -0.887 . . . . 0.0 110.969 179.914 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 8.8 t70 . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.839 0.352 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -176.89 87.96 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.897 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 60.09 81.63 0.17 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.884 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 13.0 t -151.37 83.65 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.012 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 665' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 46.51 38.61 5.66 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.283 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 666' ' ' SER . . . . . 0.445 ' O ' ' CG ' ' B' ' 670' ' ' PHE . 0.3 OUTLIER -82.71 -80.13 0.17 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.166 -179.749 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -93.99 19.38 9.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.76 -179.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -89.94 -47.77 7.65 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.342 -179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 2.2 pp -120.52 20.01 11.89 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.666 -179.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 670' ' ' PHE . . . . . 0.463 ' CE1' ' CG2' ' A' ' 51' ' ' THR . 2.3 m-85 -91.68 127.83 37.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.828 0.347 . . . . 0.0 111.08 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.22 133.88 54.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.744 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -77.53 111.86 13.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.15 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 673' ' ' VAL . . . . . 0.413 ' CG1' ' HB1' ' A' ' 50' ' ' ALA . 19.5 m -58.69 128.09 83.32 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.769 179.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -51.08 134.48 43.28 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.502 2.135 . . . . 0.0 112.78 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -115.28 116.76 28.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.582 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.15 124.32 20.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.02 -179.78 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 16.0 t -142.84 -80.59 0.21 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.965 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -90.92 167.78 12.17 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.92 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 2.6 pp -138.46 30.93 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.14 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 5.6 p . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.86 -179.99 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo . . . . . 0 N--CA 1.488 1.188 0 CA-C-O 120.94 0.308 . . . . 0.0 111.715 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.4 m -107.0 -31.36 8.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.919 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 25.6 m170 -95.27 23.32 5.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.11 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.519 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 0.5 OUTLIER -160.09 160.57 33.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.206 0.526 . . . . 0.0 111.282 179.747 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.441 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . 166.73 135.73 1.91 Allowed Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -179.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.572 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -80.32 148.46 30.68 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.46 ' HB3' ' CZ ' ' A' ' 91' ' ' PHE . . . -154.52 171.23 19.75 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.462 -179.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.496 ' O ' ' HA ' ' A' ' 89' ' ' PHE . 0.4 OUTLIER -103.0 120.67 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.582 -179.644 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.473 ' CZ ' ' CD2' ' A' ' 38' ' ' HIS . 4.5 t80 -119.6 106.67 12.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.899 0.38 . . . . 0.0 111.361 178.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.42 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 16.6 mt-10 67.71 49.42 0.96 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.928 179.123 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.3 mtmt 72.64 -3.56 2.33 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 179.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 22.5 t -102.08 151.17 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 CA-C-O 121.066 0.46 . . . . 0.0 110.483 179.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -107.16 114.08 27.92 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.843 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -133.55 -158.55 8.72 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.061 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.572 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 17.0 mm -120.21 132.23 70.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.77 0.319 . . . . 0.0 111.38 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.521 HG22 HD11 ' A' ' 16' ' ' ILE . 0.3 OUTLIER -101.19 114.87 41.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 177.843 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.519 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -124.03 115.79 21.76 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.539 0.685 . . . . 0.0 110.784 -179.248 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 7.8 mt -82.47 142.75 13.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 114.709 -1.132 . . . . 0.0 112.031 -178.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.474 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.4 OUTLIER -118.45 93.12 4.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.201 179.294 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.07 0.5 44.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.414 -179.689 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -83.36 1.46 41.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.35 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -100.86 -162.46 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.864 0.364 . . . . 0.0 110.972 -179.828 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 94.1 p -176.15 100.36 0.25 Allowed Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.324 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_exo -66.81 165.06 67.43 Favored 'Cis proline' 0 C--N 1.347 0.475 0 C-N-CA 123.644 -1.398 . . . . 0.0 112.474 0.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.34 -171.83 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.663 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -163.36 141.75 7.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.443 0.64 . . . . 0.0 112.249 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.677 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 3.1 tt -108.17 149.05 29.04 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.984 -1.007 . . . . 0.0 108.574 178.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.3 m -146.9 104.19 3.69 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -178.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.485 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 82.2 t90 -92.13 110.59 21.97 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.683 178.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -108.75 130.33 55.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.852 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.8 m -49.96 154.44 1.11 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.696 0.284 . . . . 0.0 110.607 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 21.6 m -72.94 -34.42 66.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.354 0.597 . . . . 0.0 109.703 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -87.03 -16.9 34.27 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.123 179.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.01 34.08 11.34 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.338 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 57.7 m-20 -89.54 -22.63 22.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.644 0.259 . . . . 0.0 111.542 -179.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.96 162.66 2.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.38 0.61 . . . . 0.0 111.434 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.485 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.61 144.95 20.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.025 -178.871 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.473 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 21.9 m80 -118.92 120.2 36.58 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.613 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.51 144.43 26.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.724 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.677 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.2 t -128.75 138.76 53.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.559 -179.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.405 ' O ' HG12 ' A' ' 45' ' ' ILE . 21.7 t -103.86 94.3 3.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 177.568 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.461 ' CD1' HD21 ' A' ' 104' ' ' LEU . 0.9 OUTLIER -42.29 -22.88 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.226 -0.443 . . . . 0.0 112.171 -178.744 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.03 -49.93 16.2 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 29.6 p -65.15 -28.01 69.12 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.369 178.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.576 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 44.5 mm -56.46 109.92 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.591 179.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -53.76 -37.33 63.29 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.847 0.356 . . . . 0.0 110.835 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -167.37 168.57 13.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.834 179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.414 ' CD2' ' CG2' ' B' ' 673' ' ' VAL . 11.6 tp -109.01 115.62 30.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.706 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.481 ' O ' ' N ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -106.7 141.93 37.16 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 179.728 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.493 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -157.01 139.2 14.61 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.664 0.269 . . . . 0.0 111.308 -179.712 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.402 ' CB ' ' O ' ' A' ' 57' ' ' LYS . 71.6 p -56.92 141.29 75.69 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.102 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.12 163.29 33.09 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.595 2.197 . . . . 0.0 112.407 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.95 -30.09 71.3 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.104 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.0 t -70.81 -18.31 62.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.186 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 59.7 p -94.45 115.64 27.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.897 0.379 . . . . 0.0 110.845 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.02 -18.14 12.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.688 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.402 ' O ' ' CB ' ' A' ' 51' ' ' THR . 0.1 OUTLIER -84.9 94.78 8.84 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.818 179.841 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.413 ' HE1' ' CB ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -80.23 107.95 13.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.85 -179.846 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.419 ' HB2' ' CZ ' ' B' ' 670' ' ' PHE . 35.2 mtm -149.78 151.66 33.94 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.005 0.431 . . . . 0.0 111.868 -179.446 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.493 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 33.6 mt -123.95 152.46 42.46 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.3 178.544 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.481 ' N ' ' O ' ' A' ' 49' ' ' GLN . 24.0 ttm180 -151.9 151.56 31.42 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -179.357 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.576 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.4 mp -126.65 117.84 23.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.856 178.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.426 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 10.6 mm -76.62 156.52 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.765 0.317 . . . . 0.0 111.055 -179.571 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -121.28 126.39 6.53 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.434 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -62.55 128.55 36.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.929 0.395 . . . . 0.0 110.897 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.509 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 13.9 p -97.43 161.4 2.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.097 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -114.14 63.44 0.66 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.799 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -63.22 -17.73 62.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.294 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.9 t -58.4 -21.9 52.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.198 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.7 mmmp? -75.46 -68.44 0.56 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.907 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.4 mttt 55.89 89.59 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.966 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.01 -179.93 4.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.908 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 10.7 mttt -133.76 -168.44 2.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.779 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -135.04 -175.39 3.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.858 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -57.58 -22.09 42.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.316 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 -110.0 33.72 4.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.953 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.14 24.52 44.12 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.474 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -62.46 -169.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.848 0.356 . . . . 0.0 110.899 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -135.65 114.99 12.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.638 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 96.3 t -86.89 -60.6 2.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.39 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.418 HG11 ' O ' ' A' ' 81' ' ' VAL . 4.2 p 34.98 88.29 0.1 OUTLIER Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.854 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_exo -42.12 140.35 2.3 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.94 2.427 . . . . 0.0 112.775 -179.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 46.4 mmtt -93.56 163.87 22.99 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.036 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.509 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.7 Cg_exo -82.11 112.84 2.34 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 123.602 2.868 . . . . 0.0 112.311 -179.05 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -77.28 158.91 29.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.871 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 55.9 mtt180 -151.45 129.88 12.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.721 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.468 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 7.1 m-70 -95.39 111.53 23.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.568 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.453 ' CE ' ' CE1' ' B' ' 670' ' ' PHE . 4.5 ttt -109.19 134.56 51.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.066 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.496 ' HA ' ' O ' ' A' ' 8' ' ' ILE . 0.2 OUTLIER -135.08 116.81 15.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.77 179.821 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.69 114.42 23.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.871 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.46 ' CZ ' ' HB3' ' A' ' 7' ' ' ALA . 7.9 m-85 -91.17 140.92 29.35 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.12 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -97.2 38.54 1.24 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.775 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.471 ' CB ' HG23 ' A' ' 96' ' ' VAL . 1.3 m-20 178.41 116.08 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.553 -179.719 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.414 ' O ' ' CB ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -57.49 -18.14 17.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.674 179.584 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.17 -42.22 66.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.177 0.513 . . . . 0.0 110.122 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.471 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -66.26 -53.01 40.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.287 179.012 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.429 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.1 OUTLIER -61.2 -36.8 80.88 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.335 179.309 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.429 ' N ' ' HG3' ' A' ' 97' ' ' MET . 26.8 t70 -67.81 -32.56 73.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.097 0.475 . . . . 0.0 110.181 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 68.1 m-20 -81.63 -33.25 31.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.237 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.477 ' CD1' HG21 ' A' ' 16' ' ' ILE . 3.2 mm -79.39 -60.09 2.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.616 179.568 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.446 ' HB2' HD22 ' A' ' 60' ' ' LEU . 5.9 ttmt -49.0 -29.58 5.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.508 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 31.5 mtm -79.13 -32.02 44.32 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.701 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.499 ' HA ' ' HG2' ' A' ' 106' ' ' GLN . 0.9 OUTLIER -86.51 -22.98 26.08 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 120.983 0.42 . . . . 0.0 110.235 179.623 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.461 HD21 ' CD1' ' A' ' 42' ' ' LEU . 9.5 mt -73.26 -44.73 58.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.803 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.506 ' HA ' HG13 ' A' ' 108' ' ' ILE . 0.7 OUTLIER -80.63 -33.1 35.99 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -179.431 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.499 ' HG2' ' HA ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -55.71 -36.34 67.09 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 121.309 0.576 . . . . 0.0 110.122 179.832 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.62 HG22 ' OH ' ' A' ' 111' ' ' TYR . 17.7 mt -75.96 -52.05 18.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.441 179.164 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.523 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -43.86 -55.61 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.267 0.556 . . . . 0.0 111.142 179.09 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -46.85 -28.07 1.44 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.237 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.497 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.3 OUTLIER -73.19 -24.76 60.58 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.146 179.751 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.62 ' OH ' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -74.47 -36.53 63.32 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 179.68 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.752 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -80.6 -43.62 20.25 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 179.211 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -61.45 -31.25 71.19 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 113.887 -1.506 . . . . 0.0 108.955 178.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.452 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.67 -19.44 21.84 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.638 178.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 9.7 t70 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.251 -0.881 . . . . 0.0 111.034 179.893 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 . . . . . 0 N--CA 1.488 1.429 0 CA-C-O 120.773 0.32 . . . . 0.0 111.126 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -155.5 33.56 0.37 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.887 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 60.86 92.6 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.918 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 21.4 t 65.3 94.84 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.134 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 665' ' ' LEU . . . . . . . . . . . . . 1.1 tt -70.59 65.91 0.32 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.997 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 666' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 58.72 85.07 0.1 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.029 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.2 19.17 9.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.079 0.466 . . . . 0.0 111.519 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -105.79 -17.26 14.43 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.238 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.1 pp -100.07 19.94 15.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.144 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 670' ' ' PHE . . . . . 0.453 ' CE1' ' CE ' ' A' ' 88' ' ' MET . 2.1 m-85 -80.56 140.34 35.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.974 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -111.16 126.95 55.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.905 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -76.22 106.7 7.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.968 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 673' ' ' VAL . . . . . 0.419 ' CG1' ' HB3' ' A' ' 50' ' ' ALA . 33.5 m -59.58 143.88 85.61 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.995 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.69 139.53 25.27 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.503 2.135 . . . . 0.0 112.438 -179.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.8 116.65 13.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.891 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 179.72 109.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.801 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 8.7 t 54.28 -89.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.226 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 42.97 87.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.582 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 46.4 pt 42.42 33.16 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.744 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.944 179.986 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo . . . . . 0 N--CA 1.488 1.17 0 CA-C-O 120.811 0.255 . . . . 0.0 111.816 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.6 p -81.81 -37.37 27.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.901 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.404 ' O ' ' N ' ' A' ' 18' ' ' ILE . 18.8 m80 -85.59 25.05 1.11 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.45 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.566 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 7.5 p -156.48 151.06 25.7 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.222 0.534 . . . . 0.0 111.209 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.484 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 175.2 140.04 3.24 Favored Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 -179.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -83.03 136.09 34.62 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -178.431 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.419 ' HB3' ' CE1' ' A' ' 91' ' ' PHE . . . -144.79 171.24 14.69 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.011 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.463 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.84 127.81 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-O 120.696 0.284 . . . . 0.0 111.664 -179.672 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.496 ' CZ ' ' CD2' ' A' ' 38' ' ' HIS . 6.8 t80 -127.81 110.08 12.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.986 0.422 . . . . 0.0 111.288 178.382 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.411 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 59.7 mt-10 67.75 47.77 1.12 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.988 179.104 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp 72.29 -5.41 1.78 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.152 179.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.429 HG12 ' CZ2' ' A' ' 29' ' ' TRP . 14.3 t -99.75 148.14 6.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 CA-C-O 121.028 0.442 . . . . 0.0 110.424 179.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.47 113.1 25.47 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.023 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.405 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -131.67 -134.29 3.57 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.613 -0.722 . . . . 0.0 111.905 179.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.553 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 17.3 mm -135.82 135.86 50.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.584 0.23 . . . . 0.0 111.405 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.518 ' CD1' ' CD1' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.41 140.52 19.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 106.295 -1.742 . . . . 0.0 106.295 176.61 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.566 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.33 119.07 6.12 Favored 'General case' 0 C--N 1.313 -0.997 0 C-N-CA 119.591 -0.844 . . . . 0.0 111.915 -178.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.529 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 7.1 mt -82.59 142.82 13.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 114.57 -1.196 . . . . 0.0 112.142 -178.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.507 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -117.32 92.78 3.94 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.822 178.883 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.31 -0.85 42.89 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.348 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -82.7 0.56 42.81 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.132 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.87 -163.6 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.908 0.385 . . . . 0.0 110.694 179.939 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 1.8 t -175.08 102.29 0.26 Allowed Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.274 179.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.42 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 8.5 Cg_exo -70.48 162.41 86.21 Favored 'Cis proline' 0 C--N 1.345 0.38 0 C-N-CA 123.49 -1.462 . . . . 0.0 112.674 0.45 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.417 ' O ' ' CG ' ' A' ' 26' ' ' GLU . . . -54.3 178.47 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.376 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.436 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 20.4 mt-10 -163.12 135.41 5.3 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.011 179.195 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.575 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.3 OUTLIER -107.79 139.54 42.23 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 178.813 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.4 m -124.82 113.12 17.5 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -178.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.529 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 78.5 t90 -91.97 110.5 21.86 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 178.317 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.455 ' O ' ' N ' ' A' ' 15' ' ' ILE . 49.0 ttt180 -110.5 130.93 55.45 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.955 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.0 m -49.84 158.5 0.48 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.492 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.405 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 45.3 m -74.25 -37.05 63.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.371 0.605 . . . . 0.0 109.71 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -84.64 -16.03 43.36 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.992 -1.004 . . . . 0.0 111.114 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.51 34.5 11.79 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.315 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -85.51 -25.92 26.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.753 0.311 . . . . 0.0 111.408 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.5 164.22 3.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.352 0.596 . . . . 0.0 111.441 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.512 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.65 147.94 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.125 -178.793 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.496 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 15.5 m80 -123.16 121.19 35.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.825 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.51 139.98 31.81 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.838 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.575 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -127.07 140.43 49.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.467 -179.627 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.426 ' O ' HG12 ' A' ' 45' ' ' ILE . 21.9 t -103.83 95.76 4.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 177.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.448 ' CB ' ' OH ' ' A' ' 111' ' ' TYR . 0.6 OUTLIER -42.7 -23.78 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.85 -178.994 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.42 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -76.03 -48.81 19.49 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 179.242 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 40.6 p -64.47 -27.19 68.81 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.524 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 47.9 mm -56.36 107.38 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.472 178.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.434 ' N ' ' O ' ' A' ' 63' ' ' ILE . 15.6 t70 -53.25 -28.48 27.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.543 -179.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.441 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 0.0 OUTLIER -172.83 163.46 5.01 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.02 0.438 . . . . 0.0 110.963 179.852 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.454 ' CD2' ' HB2' ' A' ' 104' ' ' LEU . 15.0 tp -109.17 122.19 46.76 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.722 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.419 ' HB2' ' HB3' ' A' ' 61' ' ' ARG . 4.2 mt-30 -124.22 146.56 48.64 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-O 120.776 0.322 . . . . 0.0 111.177 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.479 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -157.16 145.1 19.16 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.61 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 72.4 p -68.94 150.79 97.52 Favored Pre-proline 0 C--N 1.333 -0.124 0 CA-C-O 120.804 0.335 . . . . 0.0 111.182 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -75.64 163.38 34.03 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.753 2.302 . . . . 0.0 112.506 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.24 -23.89 67.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.389 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.6 m -70.66 -19.86 62.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.872 0.368 . . . . 0.0 111.125 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.9 m -71.87 123.15 22.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.041 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -56.16 -18.04 8.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.276 179.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.468 ' O ' ' HD2' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -129.01 118.68 22.96 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.73 179.357 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.413 ' HB3' ' HG2' ' A' ' 97' ' ' MET . 3.0 mpp? -85.38 134.62 34.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.457 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.0 mpp? -149.79 142.36 24.47 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.589 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.479 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 21.8 mt -116.63 145.64 43.26 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.032 178.525 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.419 ' HB3' ' HB2' ' A' ' 49' ' ' GLN . 10.2 ttm180 -143.6 148.82 36.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.092 0.472 . . . . 0.0 112.237 -179.098 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.524 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.5 mp -128.29 115.94 19.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.625 178.276 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.494 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 24.8 mm -76.41 156.5 5.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.807 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -117.52 171.99 14.13 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.734 -0.745 . . . . 0.0 112.631 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.1 mttt -98.07 127.78 44.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.812 0.339 . . . . 0.0 110.909 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.466 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 14.8 p -97.34 161.04 2.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.191 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -112.28 75.87 0.94 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.767 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -62.79 -17.57 61.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.31 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.4 m -57.27 -22.77 43.85 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.144 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.9 mmtm -63.01 -65.38 0.69 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.79 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.7 mttp 58.23 92.25 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.851 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -110.32 166.98 10.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.873 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.2 mttp -133.95 -168.02 2.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.812 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -136.54 -176.69 4.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.879 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 -59.11 -20.86 57.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.326 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -105.86 29.07 6.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.016 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.31 26.08 35.5 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.551 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 26.8 m-20 -65.9 -163.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.699 0.285 . . . . 0.0 110.917 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -137.22 116.81 12.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.662 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.406 ' O ' ' O ' ' A' ' 81' ' ' VAL . 99.3 t -86.63 -60.67 2.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.613 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.492 ' O ' ' CG1' ' A' ' 81' ' ' VAL . 0.9 OUTLIER 43.6 98.84 0.03 OUTLIER Pre-proline 0 CA--C 1.537 0.452 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.109 179.868 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -45.01 149.64 1.17 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.591 2.194 . . . . 0.0 112.707 -179.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.1 mtpt -105.14 162.17 20.54 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.953 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.466 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.9 Cg_exo -82.07 111.77 2.21 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 123.598 2.865 . . . . 0.0 112.269 -179.116 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -71.91 143.18 49.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.917 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.3 mtt180 -131.49 144.82 51.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.585 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.478 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 27.6 m-70 -97.04 111.37 23.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.802 0.334 . . . . 0.0 110.216 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 3.1 mtp -94.3 126.36 39.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.339 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.518 ' CD1' ' CD1' ' A' ' 16' ' ' ILE . 88.8 m-85 -130.55 116.57 18.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.508 179.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.416 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -98.18 114.49 26.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.842 0.353 . . . . 0.0 110.661 179.863 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.477 ' CE2' HG13 ' A' ' 100' ' ' ILE . 43.0 m-85 -94.37 139.64 30.84 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.559 -179.632 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 -99.19 31.98 2.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.712 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.427 ' CB ' HG22 ' A' ' 96' ' ' VAL . 2.1 m-20 -175.41 113.68 0.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.722 -179.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.424 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 10.1 ttp85 -56.62 -19.28 15.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.784 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.62 -47.77 58.42 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-O 120.851 0.358 . . . . 0.0 110.752 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.427 HG22 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -67.0 -45.4 87.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 178.927 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.462 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -63.91 -37.24 86.67 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.755 179.202 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.462 ' N ' ' HG3' ' A' ' 97' ' ' MET . 9.3 m-20 -60.14 -30.18 69.13 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 121.179 0.514 . . . . 0.0 109.948 178.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -81.69 -63.26 1.43 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.169 179.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.477 HG13 ' CE2' ' A' ' 91' ' ' PHE . 9.0 mm -48.56 -59.89 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.948 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.421 ' HB2' HD21 ' A' ' 60' ' ' LEU . 0.6 OUTLIER -48.54 -30.69 5.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.648 -179.997 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 17.1 mtm -83.45 -45.68 13.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.405 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.529 ' HB ' ' CD1' ' A' ' 18' ' ' ILE . 0.3 OUTLIER -57.23 -53.05 62.53 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.756 179.747 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.454 ' HB2' ' CD2' ' A' ' 48' ' ' LEU . 6.4 mt -49.87 -53.61 24.67 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.176 0.512 . . . . 0.0 109.924 179.296 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.441 ' NE2' ' CG1' ' B' ' 673' ' ' VAL . 59.9 mm-40 -56.45 -47.56 78.87 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.963 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -49.82 -34.51 19.92 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-O 121.112 0.482 . . . . 0.0 110.494 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.615 HG21 ' OH ' ' A' ' 111' ' ' TYR . 3.4 mt -85.71 -51.73 13.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.374 179.337 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.675 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.48 -57.02 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.43 179.266 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 35.0 t -47.33 -28.54 2.06 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.209 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.502 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.7 OUTLIER -71.9 -24.99 61.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.12 179.879 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.675 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.2 OUTLIER -74.85 -35.04 62.36 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.526 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.778 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.77 -43.02 17.24 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 178.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -61.42 -32.02 71.97 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 113.898 -1.501 . . . . 0.0 108.957 178.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.456 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.7 -18.91 22.38 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.616 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.7 t70 . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.252 -0.88 . . . . 0.0 111.082 179.902 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.779 0.324 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 5.3 tt -104.45 -30.94 9.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.908 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -176.23 89.92 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.896 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 21.6 t -144.55 80.15 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.045 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 665' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -129.41 145.86 51.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.882 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 666' ' ' SER . . . . . . . . . . . . . 2.7 t -138.32 77.67 1.64 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.771 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 667' ' ' GLU . . . . . 0.452 ' CB ' ' CE1' ' B' ' 670' ' ' PHE . 8.0 pt-20 -94.13 19.2 9.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.083 0.468 . . . . 0.0 111.618 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -77.72 -17.65 57.38 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.212 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -105.15 20.01 19.6 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.296 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 670' ' ' PHE . . . . . 0.452 ' CE1' ' CB ' ' B' ' 667' ' ' GLU . 2.4 m-85 -59.69 122.07 13.22 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.796 0.332 . . . . 0.0 110.969 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -92.03 143.95 25.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.803 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -92.81 109.23 20.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.001 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 673' ' ' VAL . . . . . 0.458 ' CG2' ' HB3' ' A' ' 50' ' ' ALA . 12.0 t -58.1 135.33 84.25 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.844 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -72.98 128.34 13.04 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.372 2.048 . . . . 0.0 112.461 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -117.24 153.32 33.1 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.777 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 7.4 tttm -59.41 159.22 8.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.922 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 11.9 p 59.04 -169.47 0.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.915 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 60.88 80.18 0.22 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.903 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 20.6 mt -109.95 31.4 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.149 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.85 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo . . . . . 0 N--CA 1.489 1.238 0 CA-C-O 121.171 0.404 . . . . 0.0 111.998 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.0 p -68.83 -31.53 70.57 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.937 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.9 m170 -93.08 25.41 3.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.153 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.518 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 12.5 p -156.66 159.49 38.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.2 0.524 . . . . 0.0 111.107 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.446 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . 168.24 136.49 2.06 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.575 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.5 148.16 28.27 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -178.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.485 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -157.23 171.45 20.4 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.225 -179.076 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.526 ' O ' ' HA ' ' A' ' 89' ' ' PHE . 4.3 mm -101.7 122.77 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.982 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.478 ' CE1' ' CE1' ' A' ' 38' ' ' HIS . 3.7 t80 -118.44 105.27 11.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.951 0.405 . . . . 0.0 111.051 178.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 67.45 54.75 0.67 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.756 179.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.1 mttm 70.19 -4.66 1.49 Allowed 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 179.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.414 ' O ' ' HA ' ' A' ' 8' ' ' ILE . 21.7 t -104.04 146.7 11.17 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.501 0 CA-C-O 121.134 0.492 . . . . 0.0 110.806 179.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.431 ' HA ' ' CD1' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -98.48 114.81 27.33 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.459 179.705 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -133.97 -177.37 14.89 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.365 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.575 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 15.5 mm -105.38 130.5 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-O 120.815 0.341 . . . . 0.0 111.237 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.514 HG23 HD11 ' A' ' 16' ' ' ILE . 0.4 OUTLIER -101.14 113.63 37.83 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.967 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.518 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -122.47 114.7 21.05 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 121.452 0.644 . . . . 0.0 110.623 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 10.7 mt -82.41 142.82 13.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.906 -178.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.477 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -116.94 94.78 4.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.292 179.471 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.31 0.69 40.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.384 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -82.78 0.61 42.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.385 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -100.93 -161.94 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.884 0.373 . . . . 0.0 110.911 -179.957 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.0 t -178.84 100.57 0.2 Allowed Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.307 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -65.68 160.99 72.8 Favored 'Cis proline' 0 C--N 1.346 0.412 0 C-N-CA 123.526 -1.447 . . . . 0.0 112.585 0.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.454 ' HB3' HG23 ' A' ' 107' ' ' ILE . . . -55.77 -171.36 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.805 179.428 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -163.3 142.06 8.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.465 0.65 . . . . 0.0 112.193 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.678 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 2.7 tt -108.22 147.61 31.12 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.92 -1.036 . . . . 0.0 108.578 178.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.5 m -143.42 104.29 4.22 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.475 ' CH2' ' HB3' ' A' ' 9' ' ' PHE . 82.3 t90 -92.07 110.59 21.97 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.903 178.678 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -109.39 129.27 55.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.644 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.1 t -49.77 156.68 0.67 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.613 0.244 . . . . 0.0 110.514 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.0 m -72.28 -36.2 68.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.352 0.596 . . . . 0.0 109.75 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -82.27 -18.51 42.16 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.063 179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.58 34.81 15.18 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.435 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -93.03 -21.25 19.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.629 0.252 . . . . 0.0 111.62 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.24 161.24 6.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.341 0.591 . . . . 0.0 111.492 -179.774 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.468 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.64 148.95 16.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.107 -178.873 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.478 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 16.3 m80 -123.3 120.47 33.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.606 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.51 143.14 27.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.948 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.678 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.2 t -127.11 138.81 53.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.479 -179.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.427 ' O ' HG12 ' A' ' 45' ' ' ILE . 21.8 t -104.02 94.15 3.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 177.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.443 HD22 ' CG1' ' A' ' 40' ' ' VAL . 0.6 OUTLIER -41.31 -23.47 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.221 -178.698 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.403 ' N ' ' O ' ' A' ' 41' ' ' VAL . 1.2 t -77.34 -49.07 15.73 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.402 ' CG2' ' HB ' ' A' ' 41' ' ' VAL . 30.6 p -64.9 -27.73 69.06 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.488 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.556 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 40.6 mm -55.99 110.19 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.582 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -57.28 -29.56 63.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.519 -179.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.419 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 1.2 pttt -172.47 168.97 5.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.033 0.444 . . . . 0.0 111.09 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.55 HD11 HD22 ' A' ' 62' ' ' LEU . 1.1 tp -109.21 117.09 33.21 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.239 -179.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.527 ' O ' ' N ' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -111.17 138.85 47.1 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 179.033 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.479 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -156.84 141.44 16.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.71 0.29 . . . . 0.0 111.129 -179.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 43.9 p -50.16 137.8 20.66 Favored Pre-proline 0 CA--C 1.531 0.215 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.95 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -72.18 163.25 39.3 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.52 2.147 . . . . 0.0 112.58 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.82 -31.59 72.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.128 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 68.5 m -70.71 -21.84 62.51 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.902 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 27.6 m -91.06 117.15 29.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.732 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -55.4 -18.93 7.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.589 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.3 mmtm -74.85 130.77 40.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.867 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.59 102.52 10.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.621 179.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.408 ' HB2' ' CZ ' ' B' ' 670' ' ' PHE . 32.8 mtm -149.59 146.6 27.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.484 -179.401 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.534 HD23 ' HB2' ' A' ' 101' ' ' LYS . 32.1 mt -121.53 152.73 38.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.793 178.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.527 ' N ' ' O ' ' A' ' 49' ' ' GLN . 6.9 ttm180 -151.78 145.3 24.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.802 -179.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.556 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.2 mp -120.46 118.16 29.55 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 178.281 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.445 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 26.8 mm -76.48 156.48 5.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.596 0.236 . . . . 0.0 111.058 -179.581 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -113.14 141.72 17.05 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.548 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.4 mttm -71.41 115.7 10.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.93 0.395 . . . . 0.0 110.915 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.466 ' HB ' ' CA ' ' A' ' 84' ' ' PRO . 12.0 p -96.84 162.5 2.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.074 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -132.9 64.39 1.61 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.536 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -65.39 -14.79 61.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.561 -179.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.8 m -108.75 34.95 3.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.709 0.29 . . . . 0.0 110.987 -179.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.9 mmmm -122.97 -65.85 1.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.167 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 32.9 mttt 66.1 96.86 0.05 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.394 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.76 132.56 55.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.181 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.8 mmtp -82.32 159.94 22.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.853 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 51.6 p30 -112.45 -173.48 2.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.893 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -60.05 -20.36 57.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.329 -179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -101.05 24.13 9.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.126 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.21 21.89 34.4 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.731 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -89.79 117.07 28.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.697 0.284 . . . . 0.0 110.771 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -70.26 108.1 4.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.811 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 21.3 t -111.03 119.49 59.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.751 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.441 ' O ' ' CG1' ' A' ' 81' ' ' VAL . 14.6 p -99.72 100.71 11.6 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.86 178.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -38.58 143.66 0.23 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.829 2.353 . . . . 0.0 113.121 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 8.7 pttt -112.06 166.36 11.08 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.997 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.466 ' CA ' ' HB ' ' A' ' 66' ' ' VAL . 2.6 Cg_exo -80.16 92.21 1.11 Allowed 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 123.621 2.881 . . . . 0.0 112.232 -179.034 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -83.29 114.93 21.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.103 -179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.415 ' HG2' ' CD1' ' A' ' 63' ' ' ILE . 0.1 OUTLIER -108.84 134.38 51.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.835 179.879 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.489 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 4.3 m-70 -100.82 111.41 23.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.378 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.446 ' CE ' ' CZ ' ' B' ' 670' ' ' PHE . 1.0 OUTLIER -104.88 139.03 40.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.179 -179.622 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.526 ' HA ' ' O ' ' A' ' 8' ' ' ILE . 0.2 OUTLIER -140.04 120.33 13.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.977 179.888 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.494 ' HB2' HG12 ' A' ' 8' ' ' ILE . 1.2 m -88.66 114.72 25.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.275 -179.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.485 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 6.8 m-85 -95.2 133.61 38.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.9 0.381 . . . . 0.0 111.094 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 24.3 m-20 -92.55 43.76 1.14 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.706 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.464 ' CB ' HG22 ' A' ' 96' ' ' VAL . 1.1 m-20 174.77 114.49 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.293 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.32 -16.95 10.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.933 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.62 -42.48 64.42 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.18 0.514 . . . . 0.0 109.906 179.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.464 HG22 ' CB ' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -65.82 -54.25 29.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.266 178.905 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -59.35 -35.96 74.84 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.438 179.388 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -67.08 -31.72 72.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.066 0.46 . . . . 0.0 110.428 179.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 90.3 m-20 -81.74 -30.03 32.63 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.335 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.454 HD11 ' CG2' ' A' ' 16' ' ' ILE . 4.5 mm -83.23 -59.97 2.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.817 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.534 ' HB2' HD23 ' A' ' 60' ' ' LEU . 17.8 ttpp -47.55 -38.3 13.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.644 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 41.6 mtm -79.94 -25.62 40.4 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.242 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -80.76 -40.74 24.66 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.126 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 13.2 mt -57.73 -53.01 63.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.267 -0.424 . . . . 0.0 109.993 179.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.456 ' NE2' ' CD2' ' A' ' 48' ' ' LEU . 4.6 mm-40 -60.59 -43.66 97.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.433 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -47.18 -36.44 8.7 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 121.22 0.533 . . . . 0.0 110.512 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.595 HG23 ' OH ' ' A' ' 111' ' ' TYR . 14.4 mt -85.88 -51.59 13.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.512 179.193 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.643 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.21 -60.49 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.681 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 6.6 t -46.96 -25.87 0.88 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.25 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.459 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 15.7 mtt180 -72.26 -25.07 61.47 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.942 179.5 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.643 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.2 OUTLIER -75.38 -36.7 60.87 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 179.698 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.741 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.59 -42.87 19.46 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.988 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -61.39 -30.24 70.42 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.007 -1.451 . . . . 0.0 108.967 177.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.459 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -91.66 -20.65 21.38 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.54 178.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 38.6 t70 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.288 -0.863 . . . . 0.0 110.839 179.825 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 . . . . . 0 N--CA 1.488 1.432 0 CA-C-O 120.771 0.319 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -109.59 -41.62 4.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.916 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 62.23 93.53 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.92 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 21.3 t 65.66 95.1 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.162 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 665' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -113.59 149.79 34.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.845 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 666' ' ' SER . . . . . . . . . . . . . 2.7 t -145.07 80.93 1.63 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.791 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 667' ' ' GLU . . . . . 0.422 ' HA ' ' CD1' ' B' ' 670' ' ' PHE . 0.1 OUTLIER -94.08 19.16 9.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.188 0.518 . . . . 0.0 111.588 -179.934 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -102.71 -19.21 14.85 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.149 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.85 19.92 19.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.156 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 670' ' ' PHE . . . . . 0.446 ' CZ ' ' CE ' ' A' ' 88' ' ' MET . 2.0 m-85 -63.73 134.48 55.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.842 0.353 . . . . 0.0 110.915 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -102.32 165.07 11.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.838 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -107.18 122.35 46.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.97 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 673' ' ' VAL . . . . . 0.403 ' CG2' ' HB3' ' A' ' 50' ' ' ALA . 11.1 t -71.08 136.09 84.84 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.871 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -63.96 128.03 20.89 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.291 1.994 . . . . 0.0 112.101 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 675' ' ' THR . . . . . 0.411 ' HB ' ' NZ ' ' A' ' 112' ' ' LYS . 1.8 p -133.07 127.78 34.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.653 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -52.62 162.17 0.61 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.145 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -178.38 -175.74 0.47 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.978 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -143.64 109.04 5.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.857 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 19.8 mm -97.75 35.95 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.085 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 40.7 t . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.177 -0.916 . . . . 0.0 110.857 179.954 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo . . . . . 0 N--CA 1.489 1.216 0 CA-C-O 120.919 0.3 . . . . 0.0 111.755 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -105.75 -37.62 6.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.76 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.403 ' CE1' ' HB2' ' A' ' 20' ' ' GLU . 25.2 m170 -89.76 24.06 2.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.119 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.545 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 8.9 p -156.33 142.31 18.05 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.139 0.495 . . . . 0.0 111.228 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.461 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . -175.45 140.27 5.13 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 110.746 -0.942 . . . . 0.0 110.746 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.555 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -81.94 139.73 34.44 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.415 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.418 ' HB1' ' CE1' ' A' ' 91' ' ' PHE . . . -148.92 171.23 16.66 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.043 -179.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.463 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.96 128.72 55.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-O 120.827 0.346 . . . . 0.0 111.791 -179.55 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.464 ' CZ ' ' CD2' ' A' ' 38' ' ' HIS . 7.1 t80 -129.19 110.62 12.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.111 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 5.6 mm-40 67.41 47.69 1.23 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.947 179.014 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.2 mmtm 72.25 -5.95 1.66 Allowed 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.435 HG13 ' CZ2' ' A' ' 29' ' ' TRP . 14.4 t -99.23 148.52 6.2 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 CA-C-O 121.034 0.445 . . . . 0.0 110.474 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -111.34 113.86 26.62 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.084 -179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -132.31 -133.91 3.48 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.877 -0.678 . . . . 0.0 112.112 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.555 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 17.5 mm -136.13 135.27 50.18 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.491 0 CA-C-O 120.81 0.338 . . . . 0.0 111.322 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.517 ' CD1' ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.32 139.99 20.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 176.669 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.545 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -150.1 118.56 6.47 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 119.489 -0.884 . . . . 0.0 111.68 -178.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.521 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 11.3 mt -81.57 142.92 13.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 114.469 -1.242 . . . . 0.0 112.053 -178.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.503 ' O ' HG21 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -119.98 92.59 3.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.045 179.052 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.403 ' HB2' ' CE1' ' A' ' 3' ' ' HIS . 1.2 tt0 -82.46 -0.39 46.12 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.33 -179.645 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -83.08 1.31 40.83 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.336 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.503 HG21 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -102.58 -162.72 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.842 0.354 . . . . 0.0 110.819 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 8.3 p -174.28 101.08 0.29 Allowed Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.366 179.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.427 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 58.4 Cg_endo -71.84 165.56 81.51 Favored 'Cis proline' 0 C--N 1.346 0.41 0 C-N-CA 123.518 -1.451 . . . . 0.0 112.765 0.466 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.403 ' HB1' HG22 ' A' ' 107' ' ' ILE . . . -58.32 175.72 0.21 Allowed 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.549 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.468 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 6.6 pt-20 -163.71 138.71 6.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.112 179.179 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.566 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.3 OUTLIER -107.72 143.92 35.55 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.861 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.2 m -127.52 113.55 16.28 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -178.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.525 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 77.9 t90 -92.0 110.33 21.69 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.73 130.97 55.43 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.68 0.276 . . . . 0.0 110.905 -179.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.3 t -49.84 158.52 0.48 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.561 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 48.1 m -73.76 -37.34 65.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.483 0.658 . . . . 0.0 109.69 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -84.2 -16.32 43.81 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.001 -1.0 . . . . 0.0 111.18 179.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.49 34.54 11.74 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.308 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -85.54 -25.61 26.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.677 0.275 . . . . 0.0 111.379 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.73 163.94 2.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.213 0.53 . . . . 0.0 111.423 -179.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.52 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.68 146.16 19.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.196 -178.729 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.464 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 37.4 m80 -119.84 120.75 37.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.664 179.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.53 137.42 35.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.063 -179.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.566 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.1 t -126.53 139.31 52.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.221 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.417 ' O ' HG12 ' A' ' 45' ' ' ILE . 47.0 t -103.96 95.98 4.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 177.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.4 ' N ' ' CD2' ' A' ' 42' ' ' LEU . 0.9 OUTLIER -41.16 -25.52 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.12 -178.919 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.427 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 2.0 t -76.14 -48.51 20.33 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.465 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.408 ' CG2' ' HB ' ' A' ' 41' ' ' VAL . 30.9 p -64.69 -27.86 69.2 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 178.449 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.539 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 42.0 mm -56.48 107.14 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.512 178.619 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.407 ' N ' ' O ' ' A' ' 63' ' ' ILE . 8.2 t70 -47.89 -33.98 8.3 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.926 0.393 . . . . 0.0 111.011 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.405 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 1.8 pttt -172.44 164.02 5.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.72 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.416 ' O ' HG22 ' B' ' 673' ' ' VAL . 15.1 tp -108.65 123.29 48.74 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.61 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -119.53 148.56 43.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.537 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.461 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -157.1 148.37 22.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.573 0.225 . . . . 0.0 111.043 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 35.7 p -57.95 138.86 83.23 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-O 120.626 0.25 . . . . 0.0 110.985 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -76.63 163.22 32.06 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.562 2.174 . . . . 0.0 112.446 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.94 -28.06 68.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.144 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.0 t -70.74 -17.78 62.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.172 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.0 m -101.04 114.31 28.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.781 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -58.75 -16.93 19.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.889 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 15.7 mmmt -80.72 104.08 10.99 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.841 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -82.58 108.6 16.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.855 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.445 ' HB2' ' CE1' ' B' ' 670' ' ' PHE . 31.9 mtm -149.7 143.19 25.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.632 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.461 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 25.4 mt -120.48 145.55 47.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.096 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.448 ' HB2' ' CE2' ' B' ' 670' ' ' PHE . 14.7 ttm-85 -141.9 151.3 42.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.949 0.404 . . . . 0.0 111.857 -179.058 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.539 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.5 mp -128.19 117.42 21.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.817 178.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.44 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 17.3 mm -76.6 156.52 5.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.792 0.329 . . . . 0.0 111.279 -179.354 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -114.95 166.96 12.21 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.447 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.6 mmtp -74.66 114.37 13.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.932 0.396 . . . . 0.0 110.858 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.462 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 7.6 p -107.12 160.58 6.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.313 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -113.04 39.57 2.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.807 179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.59 -21.91 65.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.187 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.2 m -80.02 -21.07 43.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.208 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.4 mmtp -79.63 -68.37 0.67 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.9 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.3 mtpt 60.04 89.25 0.07 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.818 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.28 -176.51 3.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.923 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 11.1 mttt -134.38 -167.74 2.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.674 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -135.91 -179.21 5.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.91 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -56.93 -22.32 36.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.347 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.73 33.49 4.04 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.989 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 55.5 26.17 44.35 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.51 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -66.8 -169.51 0.08 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.816 0.341 . . . . 0.0 111.001 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -135.58 119.39 17.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.568 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.2 t -89.28 -63.92 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.424 -179.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.424 HG11 ' O ' ' A' ' 81' ' ' VAL . 4.8 p 34.21 80.41 0.26 Allowed Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.849 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -45.51 124.69 6.85 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.848 2.365 . . . . 0.0 112.592 -179.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.09 161.62 77.9 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.018 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.462 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.5 Cg_exo -83.13 128.46 4.97 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 123.645 2.897 . . . . 0.0 112.42 -179.036 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -102.46 115.32 30.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.936 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -121.46 143.47 49.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.568 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.479 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 17.3 m-70 -99.02 111.37 23.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.732 0.301 . . . . 0.0 110.372 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.81 121.04 35.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.008 0.432 . . . . 0.0 111.199 -179.532 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.517 ' CD1' ' CD1' ' A' ' 16' ' ' ILE . 92.9 m-85 -122.9 116.73 24.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.467 179.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.11 114.55 26.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.846 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.418 ' CE1' ' HB1' ' A' ' 7' ' ' ALA . 17.0 m-85 -94.66 137.14 34.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.182 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 24.6 m-20 -97.08 39.26 1.19 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.823 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.465 ' CB ' HG22 ' A' ' 96' ' ' VAL . 5.4 m-20 179.59 111.17 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.553 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.409 ' O ' ' HG3' ' A' ' 97' ' ' MET . 0.3 OUTLIER -53.41 -21.67 6.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.781 179.795 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.79 -47.3 66.49 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-O 120.891 0.377 . . . . 0.0 110.834 179.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.465 HG22 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -65.76 -47.22 86.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 178.873 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.457 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -64.52 -37.42 87.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.372 179.539 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.457 ' N ' ' HG3' ' A' ' 97' ' ' MET . 35.7 t0 -68.75 -33.88 74.65 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.095 0.474 . . . . 0.0 109.965 179.278 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.435 ' O ' ' OG1' ' A' ' 103' ' ' THR . 53.2 m-20 -81.88 -26.86 33.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.475 179.294 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.409 HG22 ' CD1' ' A' ' 60' ' ' LEU . 1.6 mm -86.4 -59.7 2.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.041 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.434 ' HB2' HD22 ' A' ' 60' ' ' LEU . 7.9 ttmt -44.15 -30.6 0.79 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.374 -179.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.77 -37.93 34.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.446 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.521 ' HB ' ' CD1' ' A' ' 18' ' ' ILE . 0.3 OUTLIER -59.33 -57.42 13.09 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.714 179.588 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.406 ' O ' ' CG1' ' A' ' 108' ' ' ILE . 5.7 mt -47.97 -56.03 8.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.892 179.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.414 ' NE2' ' CG2' ' B' ' 673' ' ' VAL . 0.0 OUTLIER -56.37 -44.99 80.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.883 179.444 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -52.19 -34.44 45.3 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-O 121.168 0.509 . . . . 0.0 110.404 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.666 HG21 ' HE1' ' A' ' 111' ' ' TYR . 5.0 mt -85.64 -51.91 12.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.328 179.291 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.659 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -42.26 -57.58 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.501 179.396 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.7 m -46.92 -26.12 0.92 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.178 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.438 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 14.4 mtp85 -74.06 -25.02 59.61 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.282 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.666 ' HE1' HG21 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -76.32 -34.34 59.01 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.76 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.01 -43.51 17.88 Favored 'General case' 0 CA--C 1.505 -0.776 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 178.851 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -61.65 -31.56 71.67 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 113.867 -1.515 . . . . 0.0 109.099 178.112 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.438 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.67 -18.85 22.48 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.697 178.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 36.6 t70 . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.071 179.941 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 12.3 t70 . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.793 0.33 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 2.8 tt -168.69 86.15 0.18 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.851 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 61.01 92.76 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.892 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 21.7 t -96.51 40.59 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.109 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 665' ' ' LEU . . . . . . . . . . . . . 30.0 tp -111.49 127.96 55.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.873 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 666' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 178.75 -84.85 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.001 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -94.29 19.21 9.75 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.61 -179.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -86.58 -31.53 21.14 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.26 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 3.1 pp -120.54 20.04 11.87 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.189 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 670' ' ' PHE . . . . . 0.448 ' CE2' ' HB2' ' A' ' 61' ' ' ARG . 1.1 m-85 -93.01 168.23 11.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.991 0.424 . . . . 0.0 111.255 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -148.21 126.9 12.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.652 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -71.1 98.81 1.73 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.096 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 673' ' ' VAL . . . . . 0.416 HG22 ' O ' ' A' ' 48' ' ' LEU . 21.9 m -59.39 121.18 54.61 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.82 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -48.39 141.69 18.66 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.736 2.29 . . . . 0.0 112.842 -179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.0 116.84 11.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.73 179.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 2.3 mtmt 179.94 165.98 1.22 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.876 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 96.9 p -126.37 153.69 44.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.936 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 6.0 pm0 45.24 -168.45 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.414 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 4.3 mt 59.63 87.32 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.069 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 2.0 t . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.891 -179.994 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_endo . . . . . 0 N--CA 1.488 1.193 0 CA-C-O 120.819 0.258 . . . . 0.0 111.829 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -92.75 -37.48 12.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.859 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 33.8 m170 -86.62 11.5 12.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.434 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.551 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 3.4 p -151.25 155.39 38.69 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.162 0.506 . . . . 0.0 111.328 179.543 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.489 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 173.62 138.02 2.55 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.866 -0.894 . . . . 0.0 110.866 -179.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.561 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.22 133.41 35.25 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -178.53 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.42 ' HB1' ' CE1' ' A' ' 91' ' ' PHE . . . -141.6 171.23 14.35 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.182 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.46 ' N ' ' CD1' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.66 127.99 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.827 -179.598 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.46 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 7.6 t80 -129.41 110.81 12.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.957 0.408 . . . . 0.0 111.155 178.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.419 ' HG3' ' CE1' ' A' ' 9' ' ' PHE . 36.8 mt-10 67.53 49.38 1.01 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.826 179.173 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 69.76 -4.69 1.37 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.214 179.412 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.435 HG11 ' CZ2' ' A' ' 29' ' ' TRP . 15.7 t -100.07 148.11 6.95 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.479 0 CA-C-O 121.108 0.48 . . . . 0.0 110.41 179.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -112.1 112.83 24.73 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.956 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.405 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -130.46 -128.97 3.04 Favored Glycine 0 N--CA 1.445 -0.71 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.958 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.561 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 19.4 mm -138.66 135.48 43.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 120.692 0.282 . . . . 0.0 111.313 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.508 ' CD1' ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.8 141.2 17.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 106.279 -1.748 . . . . 0.0 106.279 176.575 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.551 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.41 116.99 5.4 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 119.532 -0.867 . . . . 0.0 111.549 -178.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.47 ' HA ' ' HA ' ' A' ' 27' ' ' LEU . 4.7 mt -85.28 137.81 20.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 114.553 -1.203 . . . . 0.0 111.85 -178.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.499 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.7 OUTLIER -116.6 93.43 4.21 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.316 179.545 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -80.36 0.08 34.62 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.475 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -82.7 0.41 43.51 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.36 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -101.75 -162.27 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.873 0.368 . . . . 0.0 110.886 179.89 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 t -175.73 101.23 0.25 Allowed Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.427 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.428 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 57.5 Cg_endo -71.31 160.23 92.71 Favored 'Cis proline' 0 C--N 1.346 0.434 0 C-N-CA 123.471 -1.47 . . . . 0.0 112.784 0.409 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.41 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -53.64 176.97 0.03 OUTLIER 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.421 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.494 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.64 135.0 4.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.43 179.309 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.557 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.3 OUTLIER -108.08 130.57 55.09 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 178.736 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.4 m -114.52 113.44 24.44 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -178.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.526 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 78.1 t90 -91.94 110.58 21.94 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.246 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.505 ' O ' ' N ' ' A' ' 15' ' ' ILE . 1.5 ttt180 -110.83 131.27 55.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.199 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 17.1 m -49.91 160.6 0.31 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.424 179.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.405 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 45.9 m -75.66 -37.34 59.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.341 0.591 . . . . 0.0 109.751 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -85.42 -14.53 45.93 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.107 179.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.65 34.72 12.91 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.323 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.32 -26.1 26.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.812 0.339 . . . . 0.0 111.358 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.28 162.49 2.95 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.275 0.56 . . . . 0.0 111.411 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.515 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.61 145.63 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.035 -178.768 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 31.3 m-70 -120.03 120.99 37.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.779 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.51 128.52 43.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.708 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.557 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -114.72 140.25 36.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.522 -179.547 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 28.3 t -104.03 96.29 4.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 177.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.438 ' CB ' ' OH ' ' A' ' 111' ' ' TYR . 0.5 OUTLIER -42.81 -24.46 0.06 Allowed 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.874 -178.89 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.428 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 1.5 t -74.84 -48.02 27.36 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.255 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 48.4 p -64.66 -27.71 69.11 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 108.976 -0.749 . . . . 0.0 108.976 178.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.531 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 44.6 mm -56.58 108.06 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.645 178.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.444 ' N ' ' O ' ' A' ' 63' ' ' ILE . 14.9 t0 -55.27 -28.13 51.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.395 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 2.7 ptpt -172.45 161.97 5.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.901 0.381 . . . . 0.0 110.873 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.435 ' CD1' HD13 ' A' ' 104' ' ' LEU . 46.5 tp -109.09 118.94 38.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.975 -179.607 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.45 ' O ' ' N ' ' A' ' 61' ' ' ARG . 3.2 tt0 -117.6 145.68 44.15 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.788 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.477 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -157.1 145.92 19.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.997 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 72.7 p -52.34 138.68 38.21 Favored Pre-proline 0 CA--C 1.53 0.173 0 CA-C-O 120.595 0.236 . . . . 0.0 110.954 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.24 163.21 39.94 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.484 2.122 . . . . 0.0 112.469 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.43 -32.07 73.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.12 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.5 m -70.77 -20.69 62.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.995 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 12.1 m -89.37 117.65 28.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.855 179.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -56.64 -17.91 10.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.622 179.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.5 mmmm -80.1 127.23 32.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.825 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.08 104.35 13.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.526 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.418 ' HB2' ' CZ ' ' B' ' 670' ' ' PHE . 47.8 mtm -149.6 146.29 27.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.615 -179.424 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.477 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 26.7 mt -119.8 148.75 43.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.596 178.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.45 ' N ' ' O ' ' A' ' 49' ' ' GLN . 1.7 ttt180 -144.52 147.19 32.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.879 0.371 . . . . 0.0 111.559 -179.621 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.531 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.6 mp -128.37 113.74 15.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.815 178.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.574 ' HA ' ' HB3' ' A' ' 86' ' ' ARG . 7.1 mm -76.7 156.48 5.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.747 0.308 . . . . 0.0 111.239 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -116.84 179.26 17.52 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.489 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.2 mmtm -92.57 127.37 38.04 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.809 0.338 . . . . 0.0 111.032 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.544 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 11.2 p -97.58 161.2 2.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.152 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -91.7 74.22 5.82 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.138 179.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 -54.29 -21.01 8.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.603 -179.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.7 m -48.53 -27.46 2.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.882 0.372 . . . . 0.0 111.317 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.8 mmmt -67.46 -65.83 0.64 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.757 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.3 mttt 60.93 93.01 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.022 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.57 124.46 34.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.754 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -76.18 167.49 21.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.944 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -104.43 -50.48 3.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.203 0.525 . . . . 0.0 111.168 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.3 t30 174.36 -31.54 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.198 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -93.37 40.78 1.07 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.091 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 58.33 19.16 38.9 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.645 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -80.38 174.23 11.81 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.821 0.343 . . . . 0.0 110.8 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -133.29 111.99 11.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.825 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 24.4 t -103.33 141.58 18.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.432 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 45.4 t -110.65 90.6 10.81 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.633 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -44.55 145.51 2.6 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.681 2.254 . . . . 0.0 112.57 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.443 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -54.06 154.44 7.72 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.156 -179.889 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.544 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 4.2 Cg_exo -83.7 -176.29 2.64 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 123.513 2.808 . . . . 0.0 112.351 -179.193 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -89.72 113.82 25.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.59 179.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.574 ' HB3' ' HA ' ' A' ' 63' ' ' ILE . 0.0 OUTLIER -116.1 143.15 45.86 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.056 -179.652 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.523 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 14.4 m-70 -94.93 116.44 28.71 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.183 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.04 110.95 22.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.005 0.431 . . . . 0.0 111.186 -179.413 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.508 ' CD1' ' CD1' ' A' ' 16' ' ' ILE . 94.2 m-85 -110.93 116.61 31.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.501 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -100.79 114.39 28.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.884 0.373 . . . . 0.0 110.711 179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.499 ' CE2' HG13 ' A' ' 100' ' ' ILE . 42.6 m-85 -93.41 150.69 20.26 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.426 -179.751 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 -107.98 31.54 5.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.404 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.447 ' CB ' HG22 ' A' ' 96' ' ' VAL . 2.1 m-20 -175.93 113.68 0.12 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.468 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.421 ' O ' ' HG3' ' A' ' 97' ' ' MET . 0.0 OUTLIER -56.57 -19.07 14.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 179.77 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.92 -45.07 64.92 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.735 179.764 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.447 HG22 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -67.81 -48.27 76.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.966 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.421 ' HG3' ' O ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -62.07 -35.56 79.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.865 179.165 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.409 ' N ' ' HG3' ' A' ' 97' ' ' MET . 7.3 m-20 -61.15 -31.47 71.19 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.217 179.111 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.9 m-80 -81.73 -51.76 7.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.42 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.499 HG13 ' CE2' ' A' ' 91' ' ' PHE . 10.7 mm -58.46 -59.77 3.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.623 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.456 ' HB2' HD21 ' A' ' 60' ' ' LEU . 5.3 ttmt -51.18 -31.75 21.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.912 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 14.1 mtm -83.34 -31.44 26.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.592 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.434 ' HA ' ' HG2' ' A' ' 106' ' ' GLN . 0.9 OUTLIER -82.32 -27.16 32.41 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.798 -179.568 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.464 ' O ' HG13 ' A' ' 108' ' ' ILE . 19.3 mt -67.69 -42.08 82.63 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 179.322 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.29 -48.72 69.48 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.603 -179.362 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.434 ' HG2' ' HA ' ' A' ' 103' ' ' THR . 11.1 pt20 -46.86 -33.39 4.48 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 121.087 0.47 . . . . 0.0 110.973 -178.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.65 HG21 ' OH ' ' A' ' 111' ' ' TYR . 11.3 mt -82.42 -53.36 11.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.603 179.278 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.652 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.24 -57.15 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.342 179.65 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -46.87 -26.92 1.08 Allowed 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.134 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.446 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 19.7 mtp180 -73.95 -25.05 59.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.29 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.652 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -76.1 -35.59 59.25 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.735 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.732 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -80.54 -43.78 20.14 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 178.911 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -61.54 -31.08 71.09 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 113.876 -1.511 . . . . 0.0 109.053 178.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.446 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.62 -19.41 21.92 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.691 178.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.5 t0 . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.033 179.989 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 4.0 t0 . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.885 0.374 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 1.1 tp -104.92 -33.1 8.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.85 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -86.95 53.34 2.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.991 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 14.5 p 43.75 39.7 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.578 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 665' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -74.58 112.88 11.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.91 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 666' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -176.67 -86.03 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.986 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -94.28 19.17 9.78 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.628 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -85.63 -25.1 26.81 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.249 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 3.5 pp -120.26 19.85 12.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.35 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 670' ' ' PHE . . . . . 0.428 ' CE2' ' HB2' ' A' ' 61' ' ' ARG . 1.3 m-85 -92.84 159.0 15.57 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.862 0.363 . . . . 0.0 110.948 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -151.45 138.51 19.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.92 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -68.48 108.08 3.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.913 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 673' ' ' VAL . . . . . 0.465 ' CG1' ' HB2' ' A' ' 50' ' ' ALA . 30.8 m -60.15 141.97 90.03 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.056 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -54.03 136.24 66.43 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.588 2.192 . . . . 0.0 112.701 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -126.31 116.76 21.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.536 179.585 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -61.92 110.02 1.43 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.963 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 19.8 p -143.26 -169.77 3.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.865 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -133.62 121.17 21.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.904 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 23.6 mm -134.8 75.07 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.147 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.852 -179.883 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo . . . . . 0 N--CA 1.489 1.223 0 CA-C-O 121.149 0.395 . . . . 0.0 111.996 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.43 ' O ' ' CD2' ' A' ' 3' ' ' HIS . 83.1 p -97.98 22.78 8.86 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.116 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.43 ' CD2' ' O ' ' A' ' 2' ' ' SER . 24.3 m170 -152.12 21.23 0.66 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.093 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.552 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 3.9 p -155.79 157.58 36.73 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.122 0.487 . . . . 0.0 111.218 179.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.48 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 171.33 139.15 2.7 Favored Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 111.119 -0.792 . . . . 0.0 111.119 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.559 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.78 144.2 30.33 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -178.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -153.28 171.19 18.94 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.054 -179.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.478 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.79 125.74 55.85 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 CA-C-O 120.745 0.307 . . . . 0.0 111.721 -179.68 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.449 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.2 t80 -125.17 109.16 12.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.938 0.399 . . . . 0.0 111.194 178.498 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 49.9 mt-10 67.5 48.06 1.16 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.888 179.025 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.6 mttt 73.3 -5.84 1.87 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.2 0.445 . . . . 0.0 112.2 179.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.429 HG11 ' CZ2' ' A' ' 29' ' ' TRP . 16.8 t -100.21 148.68 6.49 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.496 0 CA-C-O 121.174 0.511 . . . . 0.0 110.448 179.639 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -110.8 113.18 25.56 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.97 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -131.9 -133.86 3.51 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.803 -0.713 . . . . 0.0 111.983 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.559 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 18.4 mm -135.93 135.68 50.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.682 0.277 . . . . 0.0 111.319 179.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.511 ' CD1' ' CD1' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.74 140.37 19.82 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 176.5 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.552 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -149.55 117.51 6.31 Favored 'General case' 0 C--N 1.31 -1.115 0 C-N-CA 119.607 -0.837 . . . . 0.0 111.614 -178.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.477 ' HA ' ' HA ' ' A' ' 27' ' ' LEU . 4.3 mt -85.39 142.77 12.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.738 -178.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.491 ' O ' HG21 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -121.26 92.83 3.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.399 179.634 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -81.18 0.42 36.57 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.487 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -82.67 0.65 42.26 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.295 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.491 HG21 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -102.24 -162.56 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.924 0.392 . . . . 0.0 110.858 -179.962 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.1 p -174.43 101.07 0.28 Allowed Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.437 179.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.44 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 56.4 Cg_endo -70.71 165.64 78.76 Favored 'Cis proline' 0 C--N 1.347 0.461 0 C-N-CA 123.438 -1.484 . . . . 0.0 112.807 0.278 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.25 176.74 0.15 Allowed 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.308 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.468 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.7 135.46 4.87 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.287 179.287 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.557 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.3 OUTLIER -107.85 147.37 31.01 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.786 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.2 m -132.73 113.65 13.22 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.431 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.543 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 79.7 t90 -91.96 110.5 21.86 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 178.331 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.406 ' O ' ' N ' ' A' ' 15' ' ' ILE . 8.8 ttt180 -110.51 131.0 55.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.961 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.5 m -49.87 158.92 0.44 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.53 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 48.4 m -74.42 -37.35 63.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.379 0.609 . . . . 0.0 109.674 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -84.21 -16.02 44.83 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.027 -0.988 . . . . 0.0 111.154 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.47 34.53 11.81 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.235 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.92 -25.53 26.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.638 0.256 . . . . 0.0 111.364 -179.665 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.78 163.75 2.86 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.31 0.576 . . . . 0.0 111.403 -179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.518 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.65 146.83 19.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.07 -178.757 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.43 ' ND1' ' CZ ' ' A' ' 9' ' ' PHE . 12.6 m-70 -120.48 120.18 35.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.698 179.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.43 141.45 29.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.805 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.557 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -129.98 139.83 50.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.413 -179.507 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.403 ' O ' HG12 ' A' ' 45' ' ' ILE . 30.7 t -103.87 96.32 4.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 177.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.411 HD12 ' CD2' ' A' ' 104' ' ' LEU . 0.6 OUTLIER -41.75 -24.21 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.127 -178.775 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.44 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 1.8 t -77.38 -48.59 16.9 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 179.388 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.7 p -64.49 -27.5 69.02 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.528 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 36.7 mm -56.48 112.59 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.595 178.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.418 ' N ' ' O ' ' A' ' 63' ' ' ILE . 1.4 t70 -52.37 -35.05 50.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.882 0.373 . . . . 0.0 111.034 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.6 pttt -172.34 167.44 5.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.813 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.433 ' CD1' HD13 ' A' ' 104' ' ' LEU . 15.1 tp -109.05 118.85 37.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.986 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -114.27 145.92 41.12 Favored 'General case' 0 C--O 1.225 -0.224 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.423 179.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.474 ' HB2' HD21 ' A' ' 60' ' ' LEU . . . -156.97 151.07 24.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.129 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.5 p -56.44 136.41 76.47 Favored Pre-proline 0 C--N 1.331 -0.196 0 CA-C-O 120.657 0.265 . . . . 0.0 111.295 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -71.95 163.44 38.81 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.665 2.243 . . . . 0.0 112.358 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.44 -25.14 49.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.403 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.9 t -92.25 18.27 8.48 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.209 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 94.0 p -87.13 123.15 31.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.921 0.391 . . . . 0.0 111.296 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -58.52 -18.56 30.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.133 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.35 166.96 21.61 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.671 179.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.418 ' HG2' ' CA ' ' A' ' 94' ' ' ARG . 3.0 mpp? -112.01 124.29 52.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.201 -179.501 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 31.0 mtm -149.69 138.48 20.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.637 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.474 HD21 ' HB2' ' A' ' 50' ' ' ALA . 16.0 mt -117.68 143.54 46.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.054 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.406 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 0.3 OUTLIER -144.59 149.57 36.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.022 0.439 . . . . 0.0 112.023 -179.043 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.528 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.8 mp -128.08 118.05 22.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.819 178.533 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.418 ' O ' ' N ' ' A' ' 46' ' ' ASP . 10.0 mm -76.5 156.5 5.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.037 -179.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -117.7 152.04 17.8 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.53 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.1 mttm -76.73 115.63 16.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.824 0.345 . . . . 0.0 110.911 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.509 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 14.5 p -88.16 160.87 2.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.174 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.0 p30 -101.71 73.11 1.41 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.623 179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -54.92 -23.99 21.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.256 -179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.6 m -63.44 -21.77 66.49 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.0 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -63.33 -62.88 1.39 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.795 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.8 mttm 62.77 94.47 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.819 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.6 128.74 45.02 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.857 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.48 153.96 37.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.913 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.46 -42.16 7.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.984 0.421 . . . . 0.0 111.007 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 167.76 -29.66 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.166 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -101.6 20.79 15.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.356 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.21 36.05 56.29 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.555 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -90.29 0.38 57.26 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 54.77 110.42 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.901 0.381 . . . . 0.0 111.661 179.423 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 7.1 t -113.44 133.54 59.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.619 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 42.5 t -106.17 85.78 1.79 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.605 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -43.85 139.9 5.19 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.954 2.436 . . . . 0.0 112.633 -179.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -58.82 165.08 3.53 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.122 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.509 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.3 Cg_exo -81.7 158.29 18.86 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 123.683 2.922 . . . . 0.0 112.33 -179.094 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -84.0 117.3 23.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.011 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -114.65 141.55 47.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.751 179.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.502 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 10.0 m-70 -99.09 111.33 23.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.756 0.312 . . . . 0.0 110.164 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.429 ' HE2' ' CE1' ' B' ' 670' ' ' PHE . 9.0 ttt -94.74 134.7 37.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.065 0.46 . . . . 0.0 111.586 -179.19 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.511 ' CD1' ' CD1' ' A' ' 16' ' ' ILE . 51.5 m-85 -135.31 116.62 14.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.667 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.22 114.8 27.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.894 0.378 . . . . 0.0 110.491 179.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.456 ' CE2' ' HA ' ' A' ' 97' ' ' MET . 9.0 m-85 -89.74 136.33 33.1 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.733 -179.368 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -101.08 27.79 5.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.306 179.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.41 ' CB ' HG21 ' A' ' 96' ' ' VAL . 9.9 m-20 -175.24 112.76 0.13 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.556 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.418 ' CA ' ' HG2' ' A' ' 58' ' ' MET . 0.0 OUTLIER -55.79 -19.39 11.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.927 179.72 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.21 -47.95 59.25 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.796 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.41 HG21 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -66.83 -45.37 87.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.006 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.461 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -63.9 -37.02 85.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.766 179.31 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.461 ' N ' ' HG3' ' A' ' 97' ' ' MET . 14.1 m-20 -61.14 -31.95 71.66 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.093 0.473 . . . . 0.0 109.941 178.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 -81.97 -54.04 5.64 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.502 179.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.457 HD12 ' N ' ' A' ' 5' ' ' GLY . 15.3 mm -57.5 -60.01 2.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.896 179.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.404 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 0.4 OUTLIER -51.6 -37.3 49.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.269 -179.584 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.41 ' HB2' ' O ' ' A' ' 98' ' ' ASP . 39.1 mtm -81.35 -27.72 34.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.218 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.415 HG23 HD12 ' A' ' 18' ' ' ILE . 1.0 OUTLIER -81.49 -31.44 32.9 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.852 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.433 HD13 ' CD1' ' A' ' 48' ' ' LEU . 33.7 mt -64.8 -55.95 16.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.96 179.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.404 ' NE2' ' O ' ' A' ' 101' ' ' LYS . 0.5 OUTLIER -62.34 -35.9 80.54 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.926 179.64 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -50.39 -36.97 35.11 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-O 121.289 0.566 . . . . 0.0 109.811 179.287 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.573 HG23 ' OH ' ' A' ' 111' ' ' TYR . 12.4 mt -85.78 -52.08 12.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.02 178.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.639 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.53 -58.1 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.342 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.229 179.225 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.4 m -47.29 -25.98 1.11 Allowed 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.133 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.454 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 33.6 mtp180 -74.08 -25.04 59.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.214 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.639 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -75.41 -35.28 61.04 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.661 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.755 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.34 -43.46 19.03 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 178.873 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -61.66 -31.59 71.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 113.838 -1.528 . . . . 0.0 108.983 178.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.454 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.54 -19.13 22.27 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.681 178.748 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 29.4 t0 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.151 -0.928 . . . . 0.0 110.999 -179.953 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.854 0.359 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 5.1 mp -124.2 69.62 1.08 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.878 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -87.13 53.78 2.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.027 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 16.5 m 42.18 61.36 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.716 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 665' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.07 150.98 23.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.914 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 666' ' ' SER . . . . . . . . . . . . . 7.2 m -121.52 70.35 0.94 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.615 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -91.44 19.17 6.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.785 -179.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -105.7 5.58 31.17 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.243 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.28 19.86 12.06 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.715 0.293 . . . . 0.0 111.145 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 670' ' ' PHE . . . . . 0.429 ' CE1' ' HE2' ' A' ' 88' ' ' MET . 4.1 m-85 -68.19 131.37 45.27 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.889 0.376 . . . . 0.0 111.007 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -107.16 127.02 53.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.788 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -71.98 112.57 8.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.934 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 673' ' ' VAL . . . . . 0.407 ' CG2' ' CD2' ' A' ' 48' ' ' LEU . 26.9 m -59.19 148.47 71.7 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.022 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.21 135.15 28.67 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.618 2.212 . . . . 0.0 112.485 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -129.9 116.69 19.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.89 179.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 2.6 pttt 179.88 109.98 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.806 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 9.3 p 60.85 152.03 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.081 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -90.43 78.4 6.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.843 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 9.0 tt -108.44 -20.42 6.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.373 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.866 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo . . . . . 0 N--CA 1.489 1.221 0 CA-C-O 120.794 0.247 . . . . 0.0 111.665 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.9 p -106.19 -37.55 6.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.896 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.42 ' O ' ' N ' ' A' ' 18' ' ' ILE . 18.6 m80 -91.39 25.83 2.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.009 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.53 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 19.2 p -158.31 133.63 8.71 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 121.244 0.545 . . . . 0.0 111.212 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.431 ' O ' ' HB ' ' A' ' 16' ' ' ILE . . . -170.29 138.78 5.17 Favored Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.563 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -80.26 142.28 34.75 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -178.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.458 ' HB1' ' CZ ' ' A' ' 91' ' ' PHE . . . -154.66 171.19 19.9 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.326 -179.35 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.471 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -99.08 127.59 51.58 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.388 -179.782 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.471 ' CB ' ' CE2' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -127.19 107.18 9.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.994 0.426 . . . . 0.0 111.545 179.122 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 68.04 53.87 0.62 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.221 179.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.06 -0.7 1.64 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.91 179.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.405 HG11 ' CZ2' ' A' ' 29' ' ' TRP . 37.1 t -105.15 151.91 7.22 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.481 0 CA-C-O 121.201 0.524 . . . . 0.0 110.576 179.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.428 ' HA ' HD12 ' A' ' 8' ' ' ILE . 54.7 p -114.09 115.84 28.19 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.136 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.421 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -138.04 -139.27 3.83 Favored Glycine 0 N--CA 1.444 -0.804 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.94 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.563 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 15.9 mm -129.32 134.93 62.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.844 0.354 . . . . 0.0 111.219 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.503 HG23 HD11 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -100.36 140.62 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 176.703 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.53 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.46 118.1 5.74 Favored 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 119.537 -0.865 . . . . 0.0 111.507 -178.347 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.497 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 6.9 mt -80.79 142.96 13.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 114.385 -1.28 . . . . 0.0 112.254 -178.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.515 ' O ' HG22 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -119.39 92.65 3.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.96 179.057 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.26 -0.95 47.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.305 -179.76 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -83.0 1.07 41.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.57 -0.287 . . . . 0.0 111.241 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.515 HG22 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -102.91 -162.92 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.837 0.351 . . . . 0.0 110.758 179.998 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.9 p -174.42 101.07 0.28 Allowed Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.333 179.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.435 ' CG ' ' HB3' ' A' ' 43' ' ' SER . 58.5 Cg_endo -71.74 165.4 81.75 Favored 'Cis proline' 0 C--N 1.347 0.464 0 C-N-CA 123.569 -1.43 . . . . 0.0 112.905 0.396 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.55 176.57 0.13 Allowed 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.514 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.507 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 13.7 pt-20 -163.76 136.85 5.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.229 179.104 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.566 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.3 OUTLIER -107.92 129.06 55.12 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.954 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.7 m -111.67 113.18 25.39 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.478 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 75.4 t90 -91.99 110.63 22.0 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.737 178.668 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -107.98 126.84 53.18 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.912 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.4 t -49.77 156.53 0.69 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.378 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.421 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 54.4 m -71.69 -38.04 70.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.433 0.635 . . . . 0.0 109.415 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -78.75 -9.99 59.62 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 114.897 -1.047 . . . . 0.0 111.184 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 69.77 42.38 70.77 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.276 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -101.98 -23.18 14.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.729 0.299 . . . . 0.0 111.262 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -168.19 153.85 6.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.385 0.612 . . . . 0.0 111.487 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.445 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.5 OUTLIER -140.97 155.47 21.74 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.072 -178.634 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.415 ' HB2' ' CE2' ' A' ' 9' ' ' PHE . 10.7 m-70 -131.2 121.96 25.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.491 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.42 127.23 42.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.0 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.566 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -113.11 138.94 40.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.16 -179.915 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.422 ' O ' HG12 ' A' ' 45' ' ' ILE . 44.5 t -103.86 95.85 4.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.067 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.405 ' N ' ' CD2' ' A' ' 42' ' ' LEU . 0.7 OUTLIER -41.8 -25.09 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.123 -0.489 . . . . 0.0 112.008 -178.905 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.435 ' HB3' ' CG ' ' A' ' 24' ' ' PRO . 2.1 t -76.07 -48.64 20.06 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 179.352 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.401 ' CG2' ' HB ' ' A' ' 41' ' ' VAL . 31.0 p -64.68 -27.89 69.23 Favored 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.407 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.541 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 41.6 mm -56.43 108.15 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.471 178.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.423 ' N ' ' O ' ' A' ' 63' ' ' ILE . 50.5 t0 -48.74 -34.03 11.37 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.807 0.337 . . . . 0.0 111.143 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.414 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 2.3 pttt -172.56 165.02 5.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.853 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.406 ' CD2' ' CG2' ' B' ' 673' ' ' VAL . 8.3 tp -109.03 119.19 38.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.76 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -115.72 147.13 41.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.413 179.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.466 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -157.03 149.11 22.83 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.79 -0.187 . . . . 0.0 110.969 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.1 p -54.13 138.89 55.97 Favored Pre-proline 0 CA--C 1.53 0.18 0 CA-C-O 120.628 0.251 . . . . 0.0 110.819 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -68.99 163.18 38.64 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.538 2.159 . . . . 0.0 112.524 -179.665 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.03 -31.67 72.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.088 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.71 -20.94 62.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.944 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 38.8 m -94.0 116.14 28.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.714 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -55.86 -18.59 9.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.64 179.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 17.7 mmtt -67.76 128.67 37.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.836 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -109.09 99.15 8.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.504 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 46.2 mtm -149.6 143.03 25.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.755 -179.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.466 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 24.8 mt -121.78 145.19 48.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.205 178.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.441 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 14.8 ttm-85 -140.29 150.71 44.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.937 0.399 . . . . 0.0 111.6 -179.373 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.541 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.4 mp -128.07 117.75 22.22 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.958 178.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.465 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 21.4 mm -76.54 156.51 5.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.857 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -118.69 139.17 14.26 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.614 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.5 mttt -59.69 123.49 17.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.86 0.362 . . . . 0.0 110.787 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.476 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 11.7 p -101.23 160.02 3.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.287 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -98.06 48.16 1.0 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.806 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.38 -20.41 54.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.262 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.0 m -59.33 -21.45 59.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.163 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.7 mmmt -72.82 -67.66 0.54 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.856 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.5 mttm 62.12 94.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.767 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.58 170.29 8.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.839 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -133.01 -166.7 1.8 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.737 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -138.32 -170.16 2.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.993 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -58.78 -21.28 55.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.303 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -110.25 29.09 7.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.01 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.63 26.17 38.14 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.639 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -62.44 -164.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.798 0.332 . . . . 0.0 110.934 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -133.45 115.41 14.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.581 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 90.1 t -86.98 -61.16 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.558 -179.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.5 ' O ' ' CG1' ' A' ' 81' ' ' VAL . 0.9 OUTLIER 40.85 95.98 0.04 OUTLIER Pre-proline 0 CA--C 1.536 0.414 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.128 179.904 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.457 ' HD2' ' HA ' ' A' ' 81' ' ' VAL . 9.6 Cg_endo -52.05 139.08 52.66 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.599 2.199 . . . . 0.0 112.398 -179.301 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.4 mmmm -69.09 155.97 92.49 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.946 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.476 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 2.3 Cg_endo -85.25 153.58 10.83 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.528 2.818 . . . . 0.0 112.444 -179.171 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -80.93 156.26 26.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.759 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.405 ' HG3' ' HA ' ' A' ' 63' ' ' ILE . 0.9 OUTLIER -163.66 119.26 1.65 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.815 -179.739 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.459 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 40.9 m-70 -94.05 111.42 23.14 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 179.423 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.45 ' CE ' ' CE1' ' B' ' 670' ' ' PHE . 0.0 OUTLIER -94.25 110.97 22.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.993 0.425 . . . . 0.0 111.241 -179.282 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.5 ' CD1' ' CD1' ' A' ' 16' ' ' ILE . 96.2 m-85 -115.16 116.6 28.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.537 179.755 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.63 114.53 28.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.637 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.458 ' CZ ' ' HB1' ' A' ' 7' ' ' ALA . 3.7 m-85 -94.35 137.27 33.71 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.077 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -94.0 41.06 1.08 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.707 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.452 ' CB ' HG22 ' A' ' 96' ' ' VAL . 1.6 m-20 177.97 115.41 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.333 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.2 -16.47 13.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.829 179.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -73.19 -45.31 57.1 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-O 121.099 0.476 . . . . 0.0 110.12 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.452 HG22 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -65.24 -49.93 76.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.42 179.031 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.69 -36.24 82.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.49 179.523 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -70.43 -35.01 73.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.076 0.465 . . . . 0.0 110.191 179.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.404 ' O ' ' OG1' ' A' ' 103' ' ' THR . 73.1 m-20 -81.75 -27.48 33.79 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.468 179.418 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.45 HD12 HG22 ' A' ' 16' ' ' ILE . 1.3 mm -86.21 -59.19 2.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.959 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.432 ' HB2' HD22 ' A' ' 60' ' ' LEU . 6.5 ttmt -43.98 -31.05 0.81 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.193 -179.55 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.403 ' HG3' ' N ' ' A' ' 103' ' ' THR . 19.8 ptp -77.83 -39.75 42.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.352 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.497 ' HB ' ' CD1' ' A' ' 18' ' ' ILE . 0.3 OUTLIER -60.13 -52.42 65.43 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.794 179.654 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 9.5 mt -51.5 -59.45 4.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.369 179.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.432 ' NE2' ' O ' ' A' ' 101' ' ' LYS . 0.8 OUTLIER -60.49 -34.26 73.8 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.87 179.601 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -56.09 -36.22 67.89 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.232 0.539 . . . . 0.0 109.856 179.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.556 HG22 ' OH ' ' A' ' 111' ' ' TYR . 8.3 mt -85.76 -50.61 14.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.367 179.104 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.644 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.13 -56.4 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.427 179.433 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -46.26 -28.23 1.23 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.047 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.468 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 29.2 mtt180 -72.77 -25.04 61.03 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.346 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.644 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -76.34 -35.12 58.91 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 179.884 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.748 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.17 -44.01 18.5 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 178.954 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 54.7 t0 -61.87 -31.24 71.5 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 113.822 -1.535 . . . . 0.0 109.148 178.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.468 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.68 -19.35 21.93 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.85 178.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.274 -0.869 . . . . 0.0 110.982 179.973 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 . . . . . 0 N--CA 1.488 1.437 0 CA-C-O 120.782 0.325 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 3.9 tp 60.21 63.76 1.35 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.891 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -176.46 95.56 0.05 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.86 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 21.4 t 66.38 95.6 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.086 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 665' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 63.16 147.93 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.809 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 666' ' ' SER . . . . . . . . . . . . . 3.0 t -133.46 74.76 1.57 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.851 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 667' ' ' GLU . . . . . 0.411 ' HB2' ' CD1' ' B' ' 670' ' ' PHE . 1.1 pt-20 -94.13 19.12 9.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.553 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -83.23 0.71 44.28 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.395 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -120.2 19.88 12.11 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.587 0.232 . . . . 0.0 111.071 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 670' ' ' PHE . . . . . 0.45 ' CE1' ' CE ' ' A' ' 88' ' ' MET . 1.8 m-85 -63.44 122.11 15.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.834 0.35 . . . . 0.0 110.915 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -101.53 170.98 7.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.933 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -114.48 113.36 24.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.955 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 673' ' ' VAL . . . . . 0.406 ' CG2' ' CD2' ' A' ' 48' ' ' LEU . 35.1 m -66.14 149.72 97.49 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.01 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -72.27 155.65 55.88 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.57 2.18 . . . . 0.0 112.514 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.07 116.99 11.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.744 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 3.6 tttt -56.38 121.67 10.1 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.073 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 32.1 t -149.97 -44.24 0.13 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.105 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -122.44 163.28 20.13 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.864 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 20.9 pt -82.72 -20.41 9.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.405 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 11.8 m . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.239 -0.886 . . . . 0.0 110.868 179.953 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo . . . . . 0 N--CA 1.488 1.177 0 CA-C-O 121.006 0.336 . . . . 0.0 111.727 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.446 ' O ' ' CD2' ' A' ' 3' ' ' HIS . 26.3 p -105.8 22.85 14.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.12 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.446 ' CD2' ' O ' ' A' ' 2' ' ' SER . 22.3 m170 -157.52 24.99 0.29 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.934 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.555 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 2.6 p -158.49 156.15 29.75 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.205 0.526 . . . . 0.0 111.295 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.493 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 172.75 139.44 2.85 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 110.898 -0.881 . . . . 0.0 110.898 -179.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.554 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -84.0 143.17 29.96 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.424 ' HB3' ' CD1' ' A' ' 91' ' ' PHE . . . -152.46 171.15 18.52 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.079 -179.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.471 ' N ' ' CD1' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.67 126.48 56.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-O 120.786 0.327 . . . . 0.0 111.715 -179.613 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.476 ' CE1' ' CD2' ' A' ' 38' ' ' HIS . 6.6 t80 -126.63 109.81 12.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.917 0.389 . . . . 0.0 111.128 178.388 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 3.8 mm-40 67.73 50.43 0.87 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.828 179.214 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.1 mttt 69.23 -3.42 1.55 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 179.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.423 HG12 ' CZ2' ' A' ' 29' ' ' TRP . 17.0 t -101.38 148.58 7.13 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 CA-C-O 121.097 0.475 . . . . 0.0 110.564 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.0 p -111.12 114.62 28.01 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.024 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -134.18 -133.99 3.38 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.953 179.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.554 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 18.8 mm -136.35 136.49 48.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.683 0.278 . . . . 0.0 111.34 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.516 ' CD1' ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.84 141.47 17.5 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.63 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 176.436 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.555 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.4 118.39 5.86 Favored 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.534 -178.608 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.498 ' HA ' ' HA ' ' A' ' 27' ' ' LEU . 4.8 mt -85.33 142.73 12.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 114.537 -1.21 . . . . 0.0 111.796 -178.696 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.485 ' O ' HG22 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -121.65 93.07 3.89 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.419 179.596 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.427 ' HB2' ' NE2' ' A' ' 3' ' ' HIS . 0.1 OUTLIER -81.19 1.09 33.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.532 -179.777 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -81.86 0.47 39.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.122 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.485 HG22 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -101.75 -161.99 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.801 0.334 . . . . 0.0 110.838 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.6 p -175.24 100.93 0.26 Allowed Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.455 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.442 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 10.5 Cg_exo -70.11 166.04 76.04 Favored 'Cis proline' 0 C--N 1.347 0.471 0 C-N-CA 123.55 -1.437 . . . . 0.0 112.512 0.296 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.04 176.99 0.27 Allowed 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.248 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.443 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 6.9 pt-20 -163.78 138.19 5.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.141 179.177 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.566 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.3 OUTLIER -107.76 149.05 28.66 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.874 -0.788 . . . . 0.0 108.874 178.86 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.3 m -133.84 112.58 11.44 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -178.272 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.524 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 76.8 t90 -92.11 110.68 22.06 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.258 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.411 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.1 ptp180 -112.13 133.44 54.27 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.718 0.294 . . . . 0.0 110.761 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 25.4 m -49.82 161.02 0.26 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.593 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 53.5 m -74.22 -37.78 63.75 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.404 0.621 . . . . 0.0 109.659 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.72 -17.29 41.76 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.041 179.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.81 33.74 10.83 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.367 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -83.83 -27.85 28.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.714 0.292 . . . . 0.0 111.258 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.96 161.49 5.72 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.283 0.564 . . . . 0.0 111.348 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.524 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.69 140.82 22.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.036 -178.709 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.476 ' CD2' ' CE1' ' A' ' 9' ' ' PHE . 89.4 m-70 -114.58 121.25 42.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.683 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.54 140.94 30.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.842 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.566 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -127.79 140.47 49.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.329 -179.673 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.424 ' O ' HG12 ' A' ' 45' ' ' ILE . 41.1 t -103.95 95.94 4.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 177.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.401 ' CD1' HD21 ' A' ' 104' ' ' LEU . 0.7 OUTLIER -42.27 -23.83 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.972 -178.955 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.442 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -76.42 -48.32 20.13 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.255 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 38.9 p -64.53 -27.89 69.28 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 178.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.536 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 48.4 mm -56.9 108.49 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.582 178.73 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.414 ' N ' ' O ' ' A' ' 63' ' ' ILE . 8.3 t70 -51.93 -33.77 38.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.871 0.367 . . . . 0.0 110.819 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.8 pttt -171.23 165.04 7.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.703 179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.415 ' CD1' HD13 ' A' ' 104' ' ' LEU . 16.6 tp -108.82 122.47 47.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.85 -179.554 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -115.49 141.56 47.89 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.473 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.477 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -157.06 141.15 16.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.075 -179.739 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 44.6 p -52.58 142.97 30.08 Favored Pre-proline 0 CA--C 1.53 0.174 0 CA-C-N 116.607 -0.27 . . . . 0.0 111.09 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -72.69 163.24 39.05 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.566 2.177 . . . . 0.0 112.516 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.45 -31.44 70.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.189 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.5 m -70.79 -21.32 62.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.021 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 46.6 t -96.83 117.22 30.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.929 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -55.19 -19.97 9.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.515 179.322 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 13.8 mmtt -61.26 121.62 13.03 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.624 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -106.16 99.41 9.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.857 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.1 mpp? -149.88 138.52 20.81 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.93 0.395 . . . . 0.0 111.996 -179.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.477 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 15.5 mt -120.0 140.73 50.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.615 178.246 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.467 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 13.0 ttm180 -143.38 151.67 40.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.032 0.444 . . . . 0.0 112.126 -178.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.536 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.5 mp -128.52 117.63 21.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.95 178.491 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.485 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 14.2 mm -76.66 156.43 5.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.718 -0.219 . . . . 0.0 110.805 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -117.24 178.05 16.92 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.531 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.5 mttm -102.05 120.31 40.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.785 0.326 . . . . 0.0 111.001 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.515 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 9.8 p -83.29 160.56 3.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.771 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -132.75 36.92 3.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.741 0.305 . . . . 0.0 111.44 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 43.08 29.89 0.23 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.323 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 36.3 m -94.26 -28.15 15.76 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.974 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.6 mmtm -57.06 -79.88 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.708 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.0 mtpt 55.37 89.82 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.2 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.77 121.19 40.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.589 179.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -74.39 150.59 39.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.068 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -97.58 -166.19 1.35 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.833 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -65.72 -15.44 62.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.346 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -113.11 14.22 19.47 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.685 -0.234 . . . . 0.0 111.399 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.91 40.46 72.73 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.501 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -84.65 3.09 38.66 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.844 0.312 . . . . 0.0 111.844 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 79' ' ' GLU . 10.3 pt-20 42.24 97.2 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.09 0.472 . . . . 0.0 112.022 179.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 13.9 t -109.83 157.66 10.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.721 -179.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 52.8 t -111.92 82.24 4.01 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.326 179.288 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -42.1 149.49 0.29 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.933 2.422 . . . . 0.0 112.954 -179.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -46.1 168.61 0.11 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.521 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.515 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 8.1 Cg_exo -77.18 179.61 6.35 Favored 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 123.705 2.937 . . . . 0.0 112.403 -178.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.4 162.98 0.29 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.876 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.411 ' CG ' ' CD1' ' A' ' 63' ' ' ILE . 0.2 OUTLIER -166.67 116.83 0.92 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.028 -179.67 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.479 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 37.8 m-70 -96.5 111.18 23.39 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.283 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.417 ' HE1' ' CZ ' ' B' ' 670' ' ' PHE . 0.0 OUTLIER -96.28 128.01 42.81 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.076 0.465 . . . . 0.0 111.637 -178.866 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.516 ' CD2' ' CD1' ' A' ' 16' ' ' ILE . 58.5 m-85 -132.15 116.57 17.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.481 179.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.447 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -91.61 115.04 27.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.953 0.406 . . . . 0.0 110.632 179.867 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.453 ' CD2' ' HB ' ' A' ' 96' ' ' VAL . 2.8 m-85 -91.53 137.72 32.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.162 -179.522 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 22.5 m-20 -102.04 34.87 2.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.743 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.425 ' HB3' ' CG2' ' A' ' 96' ' ' VAL . 10.3 t30 179.14 123.42 0.05 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.943 -179.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.522 ' HA ' ' HG3' ' A' ' 97' ' ' MET . 2.8 mmm-85 -61.85 -14.41 33.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.547 179.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -71.72 -51.14 24.38 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 121.029 0.442 . . . . 0.0 110.352 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.453 ' HB ' ' CD2' ' A' ' 91' ' ' PHE . 0.2 OUTLIER -56.94 -45.28 83.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.624 179.415 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.522 ' HG3' ' HA ' ' A' ' 94' ' ' ARG . 1.0 OUTLIER -57.14 -48.97 77.36 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.584 178.877 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.448 ' O ' ' HB2' ' A' ' 102' ' ' MET . 12.1 t70 -52.87 -32.94 47.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.378 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -82.52 -57.07 3.51 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.09 179.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.443 HD13 ' N ' ' A' ' 5' ' ' GLY . 11.3 mm -65.08 -60.45 2.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.958 -179.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.419 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 5.6 ttmt -50.18 -37.84 36.87 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.493 -178.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.448 ' HB2' ' O ' ' A' ' 98' ' ' ASP . 14.4 mtm -80.04 -27.16 39.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.037 -179.663 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -81.75 -31.71 31.83 Favored 'General case' 0 N--CA 1.443 -0.793 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 179.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.415 HD13 ' CD1' ' A' ' 48' ' ' LEU . 45.2 mt -65.1 -57.45 8.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.882 179.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.419 ' NE2' ' O ' ' A' ' 101' ' ' LYS . 0.1 OUTLIER -63.43 -34.06 76.92 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.932 179.562 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -52.31 -36.78 54.1 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.348 0.594 . . . . 0.0 109.829 179.332 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.582 HG21 ' OH ' ' A' ' 111' ' ' TYR . 12.1 mt -85.84 -51.71 12.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.049 178.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.63 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.63 -57.54 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.326 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.259 179.17 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 10.9 m -47.49 -26.29 1.34 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.027 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.451 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 73.5 mtt180 -73.64 -25.04 60.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.265 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.63 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -75.49 -34.9 60.9 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.734 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.766 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.47 -43.31 17.38 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 178.923 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -61.45 -31.54 71.5 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.875 -1.511 . . . . 0.0 109.092 178.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.451 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.65 -20.83 20.45 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.611 178.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.361 -0.828 . . . . 0.0 110.838 179.821 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.825 0.345 . . . . 0.0 111.196 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 4.2 pp -119.39 30.62 7.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.922 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -86.67 53.04 2.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.028 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 17.7 m -142.56 40.23 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.08 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 665' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.98 162.07 28.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.792 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 666' ' ' SER . . . . . . . . . . . . . 3.1 t -176.36 96.06 0.05 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.744 179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 667' ' ' GLU . . . . . 0.427 ' HA ' ' CD1' ' B' ' 670' ' ' PHE . 2.4 pt-20 -94.08 19.24 9.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.112 0.482 . . . . 0.0 111.509 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.2 -10.36 35.99 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.338 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . 0.421 ' N ' ' CD1' ' B' ' 669' ' ' LEU . 0.0 OUTLIER -120.2 19.91 12.11 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.679 0.276 . . . . 0.0 111.275 179.954 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 670' ' ' PHE . . . . . 0.427 ' CD1' ' HA ' ' B' ' 667' ' ' GLU . 2.7 m-85 -75.73 122.07 23.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.773 0.321 . . . . 0.0 110.884 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -111.74 166.93 10.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.801 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 11.4 p30 -108.31 112.13 24.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.991 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 673' ' ' VAL . . . . . 0.408 ' CG2' ' CD2' ' A' ' 48' ' ' LEU . 27.0 m -58.92 118.9 33.07 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.828 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_exo -48.02 136.73 23.38 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.614 2.21 . . . . 0.0 112.675 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -122.56 116.87 24.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.759 179.825 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 179.88 166.0 1.2 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.832 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 9.9 t -167.79 78.12 0.16 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.884 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -71.68 -172.97 0.88 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.874 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 1.8 pp -110.56 -19.71 6.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.41 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 31.6 p . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.217 -0.896 . . . . 0.0 110.901 179.986 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo . . . . . 0 N--CA 1.487 1.143 0 CA-C-O 120.964 0.318 . . . . 0.0 111.839 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.416 ' CB ' HG21 ' A' ' 103' ' ' THR . 58.1 p -86.38 -37.49 18.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.904 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.454 ' O ' ' N ' ' A' ' 18' ' ' ILE . 30.6 m170 -71.43 -4.95 29.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.381 179.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.464 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 2.0 p -143.73 158.4 43.7 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.982 0.42 . . . . 0.0 111.011 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 172.26 141.58 3.46 Favored Glycine 0 C--O 1.225 -0.435 0 N-CA-C 110.909 -0.876 . . . . 0.0 110.909 -179.467 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.556 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -84.87 147.06 26.98 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.639 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.435 ' CB ' ' HB3' ' A' ' 89' ' ' PHE . . . -156.14 171.13 20.69 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.202 -179.14 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.492 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.93 122.98 54.81 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 N-CA-C 111.817 0.302 . . . . 0.0 111.817 -179.556 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.483 ' CE1' ' CD2' ' A' ' 38' ' ' HIS . 5.7 t80 -121.86 108.65 13.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.983 0.421 . . . . 0.0 111.111 178.411 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 61.0 mt-10 67.43 48.95 1.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.911 179.016 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.7 mttm 73.28 -5.31 1.99 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 179.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.418 HG13 ' CZ2' ' A' ' 29' ' ' TRP . 18.6 t -101.13 148.67 6.9 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.514 0 CA-C-O 121.114 0.483 . . . . 0.0 110.534 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -111.76 112.71 24.59 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.067 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -131.57 -132.31 3.35 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.933 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.556 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 17.8 mm -136.64 136.4 48.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.708 0.289 . . . . 0.0 111.345 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.499 ' CD1' ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.86 140.95 18.47 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 N-CA-C 106.246 -1.761 . . . . 0.0 106.246 176.56 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . 0.464 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.6 118.18 5.72 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.565 -0.854 . . . . 0.0 111.695 -178.454 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.507 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 48.3 mt -84.06 142.94 12.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 114.623 -1.171 . . . . 0.0 112.155 -178.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.476 ' O ' HG22 ' A' ' 22' ' ' VAL . 2.4 t-20 -118.84 92.52 3.83 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.653 178.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -82.85 0.67 42.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.601 -179.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -82.53 1.57 37.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.76 0.314 . . . . 0.0 111.066 179.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.476 HG22 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -106.05 -163.03 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.825 -179.779 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.4 t -175.31 102.9 0.26 Allowed Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.32 179.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.45 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 9.4 Cg_exo -70.5 161.71 87.76 Favored 'Cis proline' 0 C--N 1.347 0.46 0 C-N-CA 123.614 -1.411 . . . . 0.0 112.678 0.348 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.4 179.4 0.05 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.403 179.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.46 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.58 135.89 5.13 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.174 179.091 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.56 ' HG ' ' CG1' ' A' ' 40' ' ' VAL . 0.3 OUTLIER -107.92 138.42 44.19 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.958 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.4 ' CG2' ' CG2' ' A' ' 37' ' ' VAL . 1.0 OUTLIER -123.14 112.31 17.57 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -178.263 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.525 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 77.9 t90 -91.97 110.7 22.06 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 178.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' A' ' 15' ' ' ILE . 8.4 ptm180 -112.25 132.87 54.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.751 0.31 . . . . 0.0 110.916 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 8.4 t -50.02 161.71 0.24 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.692 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 54.6 m -75.38 -37.81 60.36 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.322 0.582 . . . . 0.0 109.759 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -83.4 -16.06 47.36 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.125 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.66 34.34 11.74 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.303 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -85.28 -26.37 26.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.717 0.294 . . . . 0.0 111.398 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.36 162.11 5.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.327 0.584 . . . . 0.0 111.449 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.525 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.9 OUTLIER -145.65 140.45 21.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.811 -178.826 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.483 ' CD2' ' CE1' ' A' ' 9' ' ' PHE . 29.5 m-70 -116.2 120.58 39.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.785 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.45 135.62 38.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.851 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.56 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -122.76 140.74 45.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.349 -179.527 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.429 ' O ' HG12 ' A' ' 45' ' ' ILE . 21.4 t -103.98 95.45 3.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 177.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.429 ' CB ' ' OH ' ' A' ' 111' ' ' TYR . 0.7 OUTLIER -41.95 -23.76 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.882 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.45 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -76.97 -48.64 17.47 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.344 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 33.5 p -64.61 -26.82 68.56 Favored 'General case' 0 N--CA 1.441 -0.875 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 178.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.554 ' CG2' ' HB3' ' A' ' 62' ' ' LEU . 48.0 mm -56.57 108.66 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.602 178.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.426 ' N ' ' O ' ' A' ' 63' ' ' ILE . 3.7 t0 -53.32 -30.97 41.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.808 0.337 . . . . 0.0 111.011 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.423 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 5.1 ptpt -172.55 162.99 5.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.02 0.438 . . . . 0.0 110.878 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.437 HD23 ' HB2' ' A' ' 104' ' ' LEU . 12.0 tp -109.03 116.47 32.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.619 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.85 146.59 37.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.589 0.233 . . . . 0.0 110.627 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.475 ' CB ' ' CD2' ' A' ' 60' ' ' LEU . . . -157.05 148.57 22.28 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.116 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 37.2 p -60.46 135.32 91.67 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-O 120.676 0.274 . . . . 0.0 111.117 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.16 163.34 35.18 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.577 2.185 . . . . 0.0 112.317 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.53 -30.36 60.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.284 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.6 t -70.81 -15.89 62.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.262 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 54.0 p -70.94 122.56 20.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.888 0.375 . . . . 0.0 111.094 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -60.57 -14.68 21.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.466 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.37 -176.66 3.27 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.875 179.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.432 ' HB3' ' HG2' ' A' ' 97' ' ' MET . 2.4 mpp? -134.76 120.52 19.52 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.175 -179.689 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 53.7 mtm -149.91 142.35 24.35 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.999 0.428 . . . . 0.0 111.716 -179.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.475 ' CD2' ' CB ' ' A' ' 50' ' ' ALA . 20.6 mt -122.07 143.46 49.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.155 178.834 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.405 ' HG3' ' O ' ' A' ' 87' ' ' HIS . 53.3 ttp180 -143.61 152.71 41.72 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 -178.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.554 ' HB3' ' CG2' ' A' ' 45' ' ' ILE . 1.3 mp -127.95 116.24 19.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.637 178.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.451 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 23.2 mm -76.54 156.68 5.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.701 0.286 . . . . 0.0 111.38 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -122.85 129.91 7.65 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.301 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.67 125.55 25.62 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.964 0.411 . . . . 0.0 111.089 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.473 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 13.5 p -99.18 161.63 3.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.141 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.62 66.53 0.74 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.689 179.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -64.13 -16.2 61.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.416 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.2 m -101.03 29.53 4.59 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.767 0.318 . . . . 0.0 110.858 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.9 mmmt -115.21 -63.15 1.5 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.905 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.8 mttm 61.63 95.36 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.53 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.42 124.74 47.58 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.129 -179.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.1 mmtt -80.12 170.26 16.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.878 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -122.58 -172.16 2.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.879 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -68.01 -21.27 65.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.163 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -100.88 27.64 5.83 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.002 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.42 26.48 51.61 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.632 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 19.4 m-20 -93.59 115.16 27.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.815 0.341 . . . . 0.0 110.907 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -76.11 115.15 15.54 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.729 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 13.8 t -115.46 120.08 63.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.748 -179.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.472 ' O ' ' CG1' ' A' ' 81' ' ' VAL . 11.6 p -101.66 96.76 6.8 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.973 179.052 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -36.26 151.34 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.068 2.512 . . . . 0.0 113.257 -178.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.0 mttp -104.36 169.63 7.01 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.131 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.473 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 2.8 Cg_exo -80.04 115.12 3.22 Favored 'Trans proline' 0 N--CA 1.461 -0.408 0 C-N-CA 123.694 2.929 . . . . 0.0 112.259 -178.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -85.37 114.65 22.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.164 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.33 131.15 55.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.495 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.492 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 6.4 m-70 -95.39 111.0 22.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.798 0.332 . . . . 0.0 110.318 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.449 ' CE ' ' CE1' ' B' ' 670' ' ' PHE . 0.7 OUTLIER -101.37 141.79 33.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.357 -179.369 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.499 ' CD2' ' CD1' ' A' ' 16' ' ' ILE . 5.1 m-85 -140.96 116.93 10.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.063 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.434 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -87.01 115.29 24.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.417 179.566 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.44 ' CE2' ' HA ' ' A' ' 97' ' ' MET . 8.9 m-85 -89.12 134.67 33.92 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.398 -179.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 22.4 m-20 -98.75 28.87 4.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.467 179.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -175.47 114.32 0.14 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.555 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.445 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.1 OUTLIER -56.52 -17.63 9.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.997 179.767 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -72.3 -50.32 27.9 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 120.887 0.375 . . . . 0.0 110.43 179.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -65.88 -41.95 91.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.675 179.241 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.469 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -66.74 -37.82 85.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.927 179.317 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.469 ' N ' ' HG3' ' A' ' 97' ' ' MET . 29.2 t70 -62.61 -29.48 70.63 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.858 178.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.434 ' O ' ' OG1' ' A' ' 103' ' ' THR . 9.0 m-80 -81.9 -65.58 0.99 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.363 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.457 HD13 ' N ' ' A' ' 5' ' ' GLY . 15.2 mm -46.53 -56.29 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 CA-C-O 121.148 0.499 . . . . 0.0 110.763 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.415 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 17.5 ttpp -48.07 -42.43 28.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.982 179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.472 ' HG2' ' N ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -75.18 -39.4 60.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.332 179.903 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.507 ' HB ' ' CD1' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -60.0 -50.73 72.61 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.815 179.785 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.437 ' HB2' HD23 ' A' ' 48' ' ' LEU . 6.4 mt -53.36 -59.07 5.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.258 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.415 ' NE2' ' O ' ' A' ' 101' ' ' LYS . 0.7 OUTLIER -60.22 -33.66 72.57 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.654 179.524 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -56.4 -36.48 68.95 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 121.338 0.59 . . . . 0.0 109.44 178.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.589 HG23 ' OH ' ' A' ' 111' ' ' TYR . 6.9 mt -85.79 -51.65 13.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.002 178.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.637 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.38 -57.41 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.138 179.187 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 75.4 m -47.09 -26.03 0.99 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.162 179.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.449 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 71.0 mtt-85 -74.26 -25.05 59.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.146 179.744 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.637 ' CE2' ' HA ' ' A' ' 108' ' ' ILE . 0.1 OUTLIER -75.85 -35.09 60.05 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.875 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.753 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.18 -43.69 18.96 Favored 'General case' 0 CA--C 1.506 -0.744 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 179.027 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -61.78 -31.33 71.52 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 113.862 -1.517 . . . . 0.0 109.064 178.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.449 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.69 -19.01 22.26 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.64 178.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 39.1 t70 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.245 -0.883 . . . . 0.0 111.006 179.987 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.859 0.361 . . . . 0.0 111.25 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 3.2 pp -91.98 -29.46 16.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.91 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -175.21 38.65 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.864 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 5.7 m -159.34 87.51 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.045 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 665' ' ' LEU . . . . . . . . . . . . . 4.2 pp -139.12 -166.62 2.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.873 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 666' ' ' SER . . . . . . . . . . . . . 1.5 m -138.87 79.56 1.74 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.458 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 18.2 pt-20 -89.24 19.16 4.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.903 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -93.71 7.09 46.14 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.085 179.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -120.34 19.97 12.01 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.136 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 670' ' ' PHE . . . . . 0.449 ' CE1' ' CE ' ' A' ' 88' ' ' MET . 1.7 m-85 -57.03 123.75 16.3 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.89 0.376 . . . . 0.0 111.091 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -111.65 171.06 7.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.74 179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 22.4 p-10 -106.55 109.24 21.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.978 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 673' ' ' VAL . . . . . . . . . . . . . 27.7 m -58.13 153.76 33.9 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.936 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -68.62 137.83 40.06 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.615 2.21 . . . . 0.0 112.502 -179.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.56 116.88 19.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.713 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 4.8 mttt 179.89 166.04 1.2 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.748 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 2.3 t -135.99 88.61 2.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.91 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -134.01 80.33 1.86 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.891 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 8.6 tp -75.16 -20.52 16.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.355 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 40.0 t . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.936 179.95 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.518 ' HA ' HG21 ' A' ' 103' ' ' THR . 33.8 m80 . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.651 0.262 . . . . 0.0 111.164 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.534 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 11.3 p -161.2 152.24 18.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.281 0.563 . . . . 0.0 111.111 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.432 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 173.95 137.76 2.51 Favored Glycine 0 N--CA 1.448 -0.509 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.566 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -80.86 145.47 31.35 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -178.539 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.579 ' C ' HD13 ' A' ' 8' ' ' ILE . . . -151.98 171.18 18.23 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.358 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.672 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -103.54 122.01 55.63 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.652 -179.668 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.472 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 4.6 t80 -120.75 106.98 12.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.877 0.37 . . . . 0.0 111.201 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.447 ' HG2' ' CD1' ' A' ' 9' ' ' PHE . 41.9 mm-40 67.98 49.09 0.92 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.864 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.4 mttp 72.25 -3.76 2.2 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.459 ' O ' HG23 ' A' ' 8' ' ' ILE . 19.9 t -101.21 150.3 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 CA-C-O 121.074 0.464 . . . . 0.0 110.458 179.563 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.427 ' HA ' HD12 ' A' ' 8' ' ' ILE . 95.8 p -107.12 114.86 29.18 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.877 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.517 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -134.0 -155.98 7.77 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.028 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.566 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 16.6 mm -122.83 131.96 72.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.872 0.367 . . . . 0.0 111.375 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.917 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.4 OUTLIER -100.94 113.67 37.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 177.752 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.534 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -122.18 116.61 24.48 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.553 0.692 . . . . 0.0 110.854 -179.177 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.477 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 17.5 mt -82.63 142.53 13.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 114.721 -1.127 . . . . 0.0 112.338 -178.209 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.594 ' O ' HG23 ' A' ' 22' ' ' VAL . 2.4 m120 -117.4 92.84 3.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.026 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.402 ' HB2' ' CD2' ' A' ' 3' ' ' HIS . 0.1 OUTLIER -82.64 -0.3 46.51 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.353 -179.733 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -83.38 1.3 42.02 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.442 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.594 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -100.87 -162.56 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.908 0.385 . . . . 0.0 110.988 -179.998 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 t -177.98 101.05 0.22 Allowed Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.168 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.403 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 15.7 Cg_exo -66.34 161.62 73.7 Favored 'Cis proline' 0 C--N 1.346 0.408 0 C-N-CA 123.46 -1.475 . . . . 0.0 112.608 0.373 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.727 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -55.29 -172.38 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.872 179.472 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -163.27 142.15 8.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.486 0.66 . . . . 0.0 112.352 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.704 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 3.0 tt -108.37 149.13 29.12 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.829 -1.078 . . . . 0.0 108.744 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.57 HG23 HG23 ' A' ' 39' ' ' THR . 0.6 OUTLIER -146.35 104.11 3.76 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -178.798 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.489 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 83.3 t90 -92.06 110.54 21.91 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.777 178.356 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.474 ' O ' ' N ' ' A' ' 15' ' ' ILE . 42.8 ttt180 -109.66 131.18 55.3 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.777 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.3 t -49.85 155.99 0.79 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.688 0.28 . . . . 0.0 110.597 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.6 m -74.08 -34.63 64.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.317 0.579 . . . . 0.0 109.843 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -87.12 -16.58 35.07 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.054 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.78 33.75 10.86 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.333 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -86.9 -25.02 24.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.673 0.273 . . . . 0.0 111.476 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.17 164.22 2.7 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.285 0.564 . . . . 0.0 111.491 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.489 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.7 OUTLIER -145.64 147.93 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.961 -178.851 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.428 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 58.2 m80 -122.72 120.76 34.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.654 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.57 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.46 145.06 26.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.77 -179.884 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.704 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.1 t -128.49 139.03 52.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.624 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.438 ' O ' HG12 ' A' ' 45' ' ' ILE . 23.0 t -104.0 94.22 3.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 177.483 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.493 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.6 OUTLIER -42.22 -22.85 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.212 -0.449 . . . . 0.0 112.027 -178.783 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.403 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -76.79 -49.75 15.12 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.954 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.415 HG23 ' HB ' ' A' ' 41' ' ' VAL . 30.2 p -64.94 -28.22 69.38 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 178.599 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.895 HD12 ' HB3' ' A' ' 62' ' ' LEU . 31.3 mm -56.4 105.73 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.548 178.884 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -51.8 -31.72 28.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.188 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.451 ' HG3' HG12 ' A' ' 63' ' ' ILE . 3.2 pttt -172.61 166.94 5.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.574 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 1.06 HD11 HD13 ' A' ' 104' ' ' LEU . 11.9 tp -109.0 121.87 46.06 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.047 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.911 ' HG3' HD11 ' A' ' 63' ' ' ILE . 25.2 mm100 -110.41 138.34 46.93 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.289 179.495 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.716 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -156.85 140.27 15.75 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.61 0.243 . . . . 0.0 111.05 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.545 HG23 ' HB2' ' A' ' 59' ' ' MET . 33.5 p . . . . . 0 CA--C 1.53 0.184 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.895 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.4 ' HE3' ' HB2' ' A' ' 94' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.879 0.371 . . . . 0.0 110.732 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.545 ' HB2' HG23 ' A' ' 51' ' ' THR . 3.5 mpp? -149.64 138.65 21.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.656 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.716 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 39.0 mt -124.8 149.83 46.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.29 178.653 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.427 ' N ' ' O ' ' A' ' 49' ' ' GLN . 11.0 mtp180 -151.02 156.0 40.22 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.938 0.399 . . . . 0.0 111.604 -179.533 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.895 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -127.9 118.72 24.15 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.106 178.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.911 HD11 ' HG3' ' A' ' 49' ' ' GLN . 6.6 mm -77.29 153.93 5.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.775 0.321 . . . . 0.0 111.049 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.298 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.494 180.0 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.489 HG22 ' N ' ' A' ' 67' ' ' ASP . 13.3 p . . . . . 0 N--CA 1.457 -0.095 0 CA-C-O 120.897 0.38 . . . . 0.0 111.417 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.489 ' N ' HG22 ' A' ' 66' ' ' VAL . 4.2 m-20 -99.9 47.45 0.94 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.588 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -68.32 -11.39 59.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.478 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.3 m -53.98 -25.1 19.2 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.853 0.358 . . . . 0.0 111.087 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 42.3 mmtt -77.17 -70.18 0.48 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.668 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.9 ptmt 42.63 81.43 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.363 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.403 ' CD ' ' N ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -145.47 -174.16 4.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.052 -179.945 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 78' ' ' ASN . 6.2 mptt -102.8 -171.29 1.93 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.959 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -113.94 -36.51 4.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.017 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 167.89 -30.3 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.149 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -97.02 29.21 3.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.238 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 61.72 16.9 52.82 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.841 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.443 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 15.5 m-20 -67.2 -152.61 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.401 ' HG2' HG12 ' A' ' 81' ' ' VAL . 2.5 tt0 -153.28 118.97 5.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.769 0.319 . . . . 0.0 110.826 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.2 t -94.38 -66.9 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.439 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.455 ' O ' HG13 ' A' ' 81' ' ' VAL . 5.0 p 33.15 80.2 0.26 Allowed Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.639 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -41.66 124.56 2.6 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 123.005 2.47 . . . . 0.0 112.844 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 31.4 mttt -73.21 159.9 83.94 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.908 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.422 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.3 Cg_exo . . . . . 0 N--CA 1.46 -0.484 0 C-N-CA 123.52 2.814 . . . . 0.0 112.384 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.746 0.308 . . . . 0.0 110.768 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.465 ' CE1' HG22 ' A' ' 40' ' ' VAL . 4.9 m80 -92.04 111.57 23.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.401 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 12.2 ttt -98.99 134.26 42.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.148 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.917 ' CD2' HD11 ' A' ' 16' ' ' ILE . 2.7 m-85 -136.04 122.36 20.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.792 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.8 114.28 26.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.884 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.546 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 11.1 m-85 -91.35 145.18 24.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.88 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -99.24 34.83 2.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.605 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.674 ' HB3' HG23 ' A' ' 96' ' ' VAL . 1.1 m-20 -178.99 118.06 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.609 -179.684 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.423 ' HA ' ' CG ' ' A' ' 97' ' ' MET . 0.7 OUTLIER -60.06 -15.38 22.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.691 179.477 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.13 -43.07 58.88 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.066 0.46 . . . . 0.0 110.024 179.555 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.674 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -65.93 -51.76 57.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.295 179.061 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.423 ' CG ' ' HA ' ' A' ' 94' ' ' ARG . 0.5 OUTLIER -61.49 -36.32 80.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.285 179.372 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.406 ' HB2' ' O ' ' A' ' 94' ' ' ARG . 8.2 t70 -66.59 -34.23 77.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.112 0.482 . . . . 0.0 110.086 179.36 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.418 ' O ' ' OG1' ' A' ' 103' ' ' THR . 53.4 m-20 -81.82 -26.43 34.34 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.531 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.464 HD12 ' CG2' ' A' ' 16' ' ' ILE . 2.2 mm -86.15 -59.79 2.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.088 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 9.9 ttmt -44.51 -30.32 0.86 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.168 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.424 ' HG3' ' N ' ' A' ' 103' ' ' THR . 19.8 ptp -78.86 -39.29 35.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.326 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.518 HG21 ' HA ' ' A' ' 3' ' ' HIS . 0.3 OUTLIER -58.4 -60.07 4.36 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.846 179.737 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 1.06 HD13 HD11 ' A' ' 48' ' ' LEU . 2.7 mt -48.0 -57.43 5.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.912 179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -57.13 -41.43 79.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.969 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -54.67 -35.04 63.14 Favored 'General case' 0 C--O 1.231 0.132 0 CA-C-O 121.165 0.507 . . . . 0.0 110.337 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.04 HG22 ' HE1' ' A' ' 111' ' ' TYR . 11.9 mt -85.74 -51.03 13.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.468 179.445 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.656 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -42.45 -58.13 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.486 179.356 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -47.13 -27.52 1.44 Allowed 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.296 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.463 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 0.0 OUTLIER -73.38 -24.67 60.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.001 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 1.04 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -74.59 -34.96 62.98 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.425 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.765 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.63 -43.32 17.11 Favored 'General case' 0 CA--C 1.504 -0.804 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 179.38 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ASP . . . . . 0.404 ' HB2' ' HA ' ' A' ' 110' ' ' ARG . 1.2 m-20 -62.31 -32.06 72.75 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 113.973 -1.467 . . . . 0.0 108.99 178.193 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.463 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.383 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.64 178.588 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.5 m170 . . . . . 0 CA--C 1.528 0.119 0 CA-C-O 120.519 0.2 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.575 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 49.7 p -156.3 152.85 28.18 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.193 0.52 . . . . 0.0 111.503 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.524 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . -174.91 179.93 45.9 Favored Glycine 0 N--CA 1.448 -0.562 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.521 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -120.6 129.27 53.68 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 117.738 0.769 . . . . 0.0 111.459 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.707 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -141.41 171.15 14.45 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.889 -178.801 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.652 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -100.61 121.92 51.98 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.018 179.853 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.47 ' HB2' ' CE2' ' A' ' 29' ' ' TRP . 0.7 OUTLIER -120.26 106.02 11.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.03 0.443 . . . . 0.0 111.86 179.531 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 68.16 52.71 0.65 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.562 178.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 71.19 -4.25 1.85 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.913 179.552 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.471 ' O ' HG23 ' A' ' 8' ' ' ILE . 25.2 t -103.52 148.56 8.34 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.566 0 CA-C-O 121.239 0.542 . . . . 0.0 110.527 179.535 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.481 ' HA ' HD12 ' A' ' 8' ' ' ILE . 1.0 OUTLIER -115.32 113.76 24.25 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.086 -179.962 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.855 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -133.63 -122.22 2.27 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.922 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.855 HD13 ' O ' ' A' ' 14' ' ' GLY . 18.7 mm -141.74 136.58 31.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.766 0.317 . . . . 0.0 111.146 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.913 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.82 141.76 16.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 106.301 -1.74 . . . . 0.0 106.301 176.543 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.575 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.32 115.73 5.09 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.393 -0.923 . . . . 0.0 111.55 -178.736 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.894 HD13 HG22 ' A' ' 103' ' ' THR . 5.0 mt -86.68 132.3 32.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.908 -178.52 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.595 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.5 t-20 -110.72 92.82 4.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.265 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -81.39 0.51 37.06 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.517 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -82.55 0.69 41.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.259 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.595 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -101.9 -162.93 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.885 0.374 . . . . 0.0 110.88 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.3 p -174.75 101.51 0.27 Allowed Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.333 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.463 ' HB3' ' HB3' ' A' ' 43' ' ' SER . 11.3 Cg_exo -69.52 166.34 73.67 Favored 'Cis proline' 0 C--N 1.347 0.474 0 C-N-CA 123.604 -1.415 . . . . 0.0 112.562 0.467 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.551 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -61.07 176.67 0.4 Allowed 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.143 179.805 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.476 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.78 135.07 4.65 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.24 179.326 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.791 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.96 129.43 55.11 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.88 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.791 HG22 ' CG2' ' A' ' 37' ' ' VAL . 0.3 OUTLIER -113.36 110.41 20.29 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -178.653 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.57 ' HD1' HG13 ' A' ' 16' ' ' ILE . 72.7 t90 -91.77 113.56 25.86 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.519 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.505 ' O ' ' N ' ' A' ' 15' ' ' ILE . 2.6 ptm180 -114.21 134.61 54.8 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.914 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.461 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 0.2 OUTLIER -49.9 168.5 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.47 179.868 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 54.8 m -76.98 -39.08 51.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.347 0.594 . . . . 0.0 109.903 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -84.85 -14.91 46.49 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.178 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.81 33.89 12.09 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.383 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -83.19 -29.84 28.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.752 0.311 . . . . 0.0 111.332 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.0 157.54 18.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.344 0.592 . . . . 0.0 111.349 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.791 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.9 OUTLIER -145.73 130.34 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.718 -178.823 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.461 ' CB ' ' CE2' ' A' ' 9' ' ' PHE . 2.7 m80 -107.71 122.76 47.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.944 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.659 HG23 HG23 ' A' ' 28' ' ' THR . 0.3 OUTLIER -96.51 129.83 43.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.794 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.559 HG22 ' CE1' ' A' ' 87' ' ' HIS . 1.0 OUTLIER -117.4 139.9 42.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.338 -179.649 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.749 HG12 ' OG ' ' A' ' 43' ' ' SER . 2.8 t -103.88 95.86 4.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 177.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.793 HD11 HD22 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -42.13 -24.8 0.05 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.062 -178.919 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.749 ' OG ' HG12 ' A' ' 41' ' ' VAL . 3.1 p -74.94 -48.75 22.87 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 179.236 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.474 HG23 ' HB ' ' A' ' 41' ' ' VAL . 44.9 p -64.71 -28.01 69.31 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.508 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.87 HD12 ' HB3' ' A' ' 62' ' ' LEU . 33.8 mm -57.15 105.69 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.533 178.584 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.474 ' N ' ' O ' ' A' ' 63' ' ' ILE . 2.6 t0 -47.87 -33.55 7.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.805 0.336 . . . . 0.0 111.071 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.415 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 0.2 OUTLIER -172.47 163.39 5.48 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.805 179.63 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.859 HD11 HD13 ' A' ' 104' ' ' LEU . 14.0 tp -109.11 124.85 51.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.01 -179.61 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.495 ' CD ' HD11 ' A' ' 63' ' ' ILE . 4.7 mt-30 -119.99 144.93 47.23 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.611 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.666 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.06 147.88 21.63 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.7 -0.227 . . . . 0.0 110.793 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.409 HG23 ' HB2' ' A' ' 59' ' ' MET . 71.2 p . . . . . 0 C--N 1.333 -0.135 0 CA-C-O 120.741 0.305 . . . . 0.0 111.144 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.423 ' HG2' ' HB2' ' A' ' 91' ' ' PHE . 1.0 OUTLIER . . . . . 0 N--CA 1.463 0.185 0 CA-C-O 120.919 0.39 . . . . 0.0 111.698 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.409 ' HB2' HG23 ' A' ' 51' ' ' THR . 24.0 mtm -150.09 138.52 20.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.432 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.666 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 20.9 mt -117.8 142.19 47.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.225 178.566 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.443 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 13.8 ttm180 -142.51 150.01 39.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.984 0.421 . . . . 0.0 111.846 -179.399 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.87 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -128.4 117.32 21.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.949 178.527 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.861 HG23 ' HG2' ' A' ' 86' ' ' ARG . 10.3 mm -76.47 146.07 9.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.764 -179.686 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.408 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.386 179.972 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.48 HG22 ' N ' ' A' ' 67' ' ' ASP . 13.2 p . . . . . 0 N--CA 1.457 -0.113 0 CA-C-O 120.814 0.34 . . . . 0.0 111.258 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.48 ' N ' HG22 ' A' ' 66' ' ' VAL . 5.2 m-20 -101.13 39.39 1.41 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.772 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.41 -23.03 64.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.113 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.1 t -60.39 -20.41 59.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.105 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt -83.24 -67.32 0.8 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.867 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.437 ' HG3' HG23 ' A' ' 81' ' ' VAL . 28.3 mttt 60.17 92.35 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.764 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.74 -179.02 4.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.065 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.8 mttp -131.82 -167.2 1.83 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.708 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -136.86 -178.67 5.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.893 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -57.32 -22.09 39.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.408 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -108.73 34.8 3.48 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.855 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 55.22 25.22 39.23 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.558 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -67.42 -169.95 0.12 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.797 0.332 . . . . 0.0 110.903 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -136.62 122.01 19.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.637 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.6 t -91.1 -64.91 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.357 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.437 HG23 ' HG3' ' A' ' 71' ' ' LYS . 4.4 p 34.85 78.09 0.35 Allowed Pre-proline 0 CA--C 1.531 0.212 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.958 179.692 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -42.73 125.31 3.79 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 123.125 2.55 . . . . 0.0 112.648 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.402 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -60.59 161.42 14.53 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.076 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 5.0 Cg_exo . . . . . 0 N--CA 1.461 -0.394 0 C-N-CA 123.578 2.852 . . . . 0.0 112.363 -179.152 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.861 ' HG2' HG23 ' A' ' 63' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.601 0.238 . . . . 0.0 110.734 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.559 ' CE1' HG22 ' A' ' 40' ' ' VAL . 19.4 m80 -96.87 112.56 24.26 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.09 119.17 32.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.97 0.414 . . . . 0.0 111.391 -179.236 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.913 ' CD1' HD11 ' A' ' 16' ' ' ILE . 89.7 m-85 -122.94 116.75 24.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.58 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.416 ' HB3' ' HB ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.52 114.57 28.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.785 0.326 . . . . 0.0 110.628 179.936 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.707 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 30.7 m-85 -93.5 152.63 18.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.371 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -110.39 28.47 8.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.603 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.458 ' CB ' HG23 ' A' ' 96' ' ' VAL . 9.0 m-20 -171.59 112.16 0.33 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.635 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.446 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 2.5 ttp85 -55.87 -19.48 11.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.911 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.22 -47.35 61.81 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.684 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.466 HG11 ' H ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -66.67 -46.1 86.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.959 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.451 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -63.27 -36.35 83.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.918 179.329 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.451 ' N ' ' HG3' ' A' ' 97' ' ' MET . 11.0 m-20 -62.6 -34.14 76.4 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.148 0.499 . . . . 0.0 110.047 179.19 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -81.84 -35.06 29.8 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.527 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.612 HG23 HD11 ' A' ' 18' ' ' ILE . 9.4 mm -76.45 -59.83 2.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.717 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.418 ' HG3' ' CB ' ' A' ' 50' ' ' ALA . 5.8 ttmt -51.62 -29.69 18.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.148 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.42 ' HG3' ' N ' ' A' ' 103' ' ' THR . 9.4 ptp -82.49 -37.98 24.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.92 -179.683 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.894 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -70.29 -42.09 72.52 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.018 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.859 HD13 HD11 ' A' ' 48' ' ' LEU . 28.4 mt -55.14 -52.1 64.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.016 0.436 . . . . 0.0 110.017 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.41 -46.22 91.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.26 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 -47.06 -34.14 5.55 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.12 0.485 . . . . 0.0 110.864 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.047 HG22 ' HE1' ' A' ' 111' ' ' TYR . 12.3 mt -85.62 -52.27 12.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.264 179.304 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.689 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.48 -57.65 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.497 179.323 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -47.55 -26.06 1.32 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.347 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.455 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 0.0 OUTLIER -75.69 -24.8 56.29 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.925 179.865 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 1.047 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -73.69 -34.35 64.83 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 179.233 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.757 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.53 -43.24 17.37 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 179.058 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -62.01 -32.16 72.62 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 113.898 -1.501 . . . . 0.0 109.022 178.144 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.455 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.437 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.611 178.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.414 ' O ' ' N ' ' A' ' 18' ' ' ILE . 34.6 m170 . . . . . 0 CA--C 1.531 0.247 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.566 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 4.0 p -152.67 153.89 34.2 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.125 0.488 . . . . 0.0 111.333 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.502 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 172.07 138.93 2.67 Favored Glycine 0 C--O 1.225 -0.421 0 N-CA-C 110.731 -0.948 . . . . 0.0 110.731 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.565 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -83.13 145.98 28.91 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -178.5 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.58 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -157.5 171.27 20.67 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.162 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.68 HD12 ' HA ' ' A' ' 13' ' ' SER . 5.2 mm -101.24 127.58 54.37 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.477 ' CZ ' ' CD2' ' A' ' 38' ' ' HIS . 5.9 t80 -124.39 108.23 11.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.996 0.427 . . . . 0.0 111.041 178.046 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 6.8 mm-40 68.67 49.2 0.74 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.829 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp 72.82 -6.25 1.7 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.135 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.529 ' O ' HG23 ' A' ' 8' ' ' ILE . 14.3 t -101.04 144.91 12.21 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.497 0 CA-C-O 121.219 0.533 . . . . 0.0 110.562 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.68 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -99.16 114.18 26.81 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.938 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -136.46 -170.42 11.98 Favored Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.886 -0.673 . . . . 0.0 111.846 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.565 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 14.5 mm -105.76 136.11 41.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 120.788 0.327 . . . . 0.0 111.186 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.826 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.51 140.62 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 176.962 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.566 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.3 117.9 5.74 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.716 -0.794 . . . . 0.0 111.554 -178.671 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.632 HD12 ' HB ' ' A' ' 103' ' ' THR . 22.5 mt -82.02 142.81 13.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 114.461 -1.245 . . . . 0.0 112.184 -178.682 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.67 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.5 OUTLIER -118.2 92.82 3.92 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.972 179.14 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.29 -0.82 42.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.314 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -82.45 0.62 41.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.661 0.267 . . . . 0.0 111.184 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.67 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.46 -162.34 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 120.824 0.345 . . . . 0.0 110.654 179.994 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.1 t -176.29 101.6 0.24 Allowed Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.4 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.45 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 9.7 Cg_exo -70.98 161.37 89.87 Favored 'Cis proline' 0 C--N 1.347 0.492 0 C-N-CA 123.682 -1.382 . . . . 0.0 112.673 0.431 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.456 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -54.64 178.23 0.03 OUTLIER 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.498 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.525 ' HG2' HG21 ' A' ' 22' ' ' VAL . 7.9 pt-20 -163.63 135.18 4.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.135 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.802 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.9 130.44 55.02 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.123 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.471 HG22 ' CG2' ' A' ' 37' ' ' VAL . 10.4 m -113.46 113.06 24.63 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.418 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.496 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 73.2 t90 -91.92 110.38 21.73 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.439 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.8 ttt180 -106.25 131.0 54.0 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.838 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.7 m -49.96 153.89 1.24 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.706 0.289 . . . . 0.0 110.562 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 18.8 m -72.97 -33.69 66.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.281 0.563 . . . . 0.0 109.7 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -87.96 -17.16 31.9 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.002 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.89 33.61 10.88 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.31 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -88.48 -24.39 22.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.645 0.259 . . . . 0.0 111.485 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.04 166.61 2.98 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.383 0.611 . . . . 0.0 111.465 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.496 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.6 OUTLIER -143.66 155.48 16.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.919 -178.865 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.477 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 37.8 m80 -130.15 119.39 22.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.695 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.43 129.05 43.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.763 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.577 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -116.78 139.72 42.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.379 -179.543 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.429 ' HB ' HG23 ' A' ' 44' ' ' THR . 25.3 t -103.97 95.37 3.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 177.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.72 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -42.59 -23.95 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.953 -178.849 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.45 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.8 OUTLIER -76.42 -48.15 20.71 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 179.257 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.429 HG23 ' HB ' ' A' ' 41' ' ' VAL . 34.8 p -64.53 -27.84 69.24 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.444 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.823 HD12 ' HB3' ' A' ' 62' ' ' LEU . 48.0 mm -56.46 110.56 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.548 178.82 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 63' ' ' ILE . 9.0 t0 -54.34 -31.65 54.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.794 0.33 . . . . 0.0 110.935 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.424 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 10.8 pttt -172.66 164.34 5.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.827 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 1.049 HD11 HD13 ' A' ' 104' ' ' LEU . 18.8 tp -109.02 117.35 33.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.409 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -113.2 147.45 37.43 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.551 0.215 . . . . 0.0 110.691 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.652 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.2 152.01 25.68 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.662 -0.244 . . . . 0.0 111.162 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.515 HG23 ' HB2' ' A' ' 59' ' ' MET . 17.7 p . . . . . 0 C--N 1.331 -0.209 0 CA-C-O 120.796 0.331 . . . . 0.0 111.168 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.405 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 1.8 mpt? . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.774 0.321 . . . . 0.0 111.153 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.515 ' HB2' HG23 ' A' ' 51' ' ' THR . 37.9 mtm -149.81 138.3 20.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.033 0.444 . . . . 0.0 111.73 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.652 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 17.2 mt -122.11 141.96 50.87 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.572 178.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 87' ' ' HIS . 42.1 ttp180 -142.48 150.74 40.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.104 0.478 . . . . 0.0 112.284 -178.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.823 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.6 mp -128.15 115.51 18.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.565 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.424 ' HB ' ' HG2' ' A' ' 47' ' ' LYS . 7.8 mm -76.42 156.5 5.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.623 0.249 . . . . 0.0 111.046 -179.518 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.498 -179.934 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.537 HG22 ' N ' ' A' ' 67' ' ' ASP . 13.1 p . . . . . 0 CA--C 1.528 0.097 0 CA-C-O 120.808 0.337 . . . . 0.0 110.994 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.537 ' N ' HG22 ' A' ' 66' ' ' VAL . 11.6 p30 -130.31 51.55 2.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.697 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.793 ' HA ' HG13 ' A' ' 81' ' ' VAL . 6.1 pt-20 -64.63 -16.44 62.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.401 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.1 m -105.81 33.61 3.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.904 0.383 . . . . 0.0 110.793 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.76 -40.78 0.69 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.967 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.3 mttp 63.45 95.44 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.955 0.407 . . . . 0.0 110.771 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.39 133.84 40.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.984 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.415 ' CG ' ' HA2' ' A' ' 77' ' ' GLY . 0.0 OUTLIER -68.28 149.21 49.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.131 -179.856 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.403 ' O ' ' CB ' ' A' ' 75' ' ' ASN . 0.6 OUTLIER -94.37 -36.19 12.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.834 179.793 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ASN . . . . . 0.403 ' CB ' ' O ' ' A' ' 74' ' ' ASP . 0.7 OUTLIER 165.41 -28.42 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.115 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -116.55 30.78 7.13 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.385 -179.533 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.415 ' HA2' ' CG ' ' A' ' 73' ' ' LYS . . . 54.93 29.4 51.03 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.569 -0.824 . . . . 0.0 112.576 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -78.48 -0.86 31.06 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 55.64 108.81 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.821 0.343 . . . . 0.0 111.625 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 7.6 t -115.24 142.38 28.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.386 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.793 HG13 ' HA ' ' A' ' 68' ' ' GLU . 96.3 t -112.41 83.96 5.79 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.467 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -44.36 142.62 4.24 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.714 2.276 . . . . 0.0 112.489 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.5 mttt -89.32 164.96 28.22 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.018 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo . . . . . 0 N--CA 1.462 -0.376 0 C-N-CA 123.624 2.882 . . . . 0.0 112.019 -179.239 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.627 0.251 . . . . 0.0 110.476 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.533 ' CE1' HG22 ' A' ' 40' ' ' VAL . 4.7 m80 -95.9 111.65 23.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.783 0.325 . . . . 0.0 110.501 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 3.8 ttt -93.95 137.85 32.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.98 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.826 ' CD1' HD11 ' A' ' 16' ' ' ILE . 87.9 m-85 -136.26 116.88 13.89 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.938 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.551 ' HB2' HG12 ' A' ' 8' ' ' ILE . 1.1 m -91.0 114.74 27.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.827 0.346 . . . . 0.0 110.64 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.47 ' CE2' HG13 ' A' ' 100' ' ' ILE . 9.3 m-85 -92.62 135.78 33.79 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.569 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -101.75 31.03 4.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.475 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.454 ' CB ' HG23 ' A' ' 96' ' ' VAL . 4.6 m-20 -176.42 120.68 0.15 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.757 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.485 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -59.89 -16.66 31.06 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.67 179.544 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -74.37 -50.75 17.38 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 120.95 0.405 . . . . 0.0 110.402 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.454 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -66.22 -40.13 86.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.687 179.323 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.485 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -68.41 -37.97 80.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.038 179.531 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.427 ' N ' ' HG3' ' A' ' 97' ' ' MET . 17.8 t0 -65.9 -26.67 67.72 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.998 178.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.425 ' O ' ' OG1' ' A' ' 103' ' ' THR . 79.7 m-20 -81.66 -65.71 0.98 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.412 179.454 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.715 HG22 HD11 ' A' ' 104' ' ' LEU . 15.1 mm -48.28 -57.87 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-O 121.115 0.483 . . . . 0.0 110.623 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.63 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 17.2 ttpp -46.77 -39.18 11.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.983 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 30.3 mtm -78.01 -43.75 28.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.497 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.632 ' HB ' HD12 ' A' ' 18' ' ' ILE . 0.2 OUTLIER -56.96 -53.61 56.03 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.084 -179.991 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 1.049 HD13 HD11 ' A' ' 48' ' ' LEU . 3.4 mt -49.99 -53.27 27.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.993 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.87 -46.28 81.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.007 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -49.9 -35.04 22.22 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 121.176 0.512 . . . . 0.0 110.3 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.036 HG22 ' HE1' ' A' ' 111' ' ' TYR . 10.2 mt -85.66 -51.83 12.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.379 179.293 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.686 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.28 -57.2 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.37 179.338 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -46.95 -28.22 1.54 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.253 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.538 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.0 OUTLIER -72.89 -24.89 60.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.28 179.896 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 1.036 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -75.08 -34.79 61.82 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.665 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.76 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.47 -43.68 16.94 Favored 'General case' 0 CA--C 1.505 -0.752 0 N-CA-C 107.918 -1.142 . . . . 0.0 107.918 179.114 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -61.39 -31.36 71.27 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 113.883 -1.508 . . . . 0.0 109.027 178.172 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.456 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.449 -0.488 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.56 178.707 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.2 m170 . . . . . 0 CA--C 1.528 0.097 0 CA-C-O 120.599 0.238 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.535 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 8.1 p -161.52 159.76 28.27 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.199 0.523 . . . . 0.0 111.37 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . 168.32 136.84 2.12 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.109 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.567 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -80.83 142.48 33.64 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -178.55 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.656 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -148.08 171.31 16.05 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.402 -179.145 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.678 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -104.1 122.64 57.17 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.439 -179.766 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.469 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 5.1 t80 -122.77 107.64 12.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.942 0.401 . . . . 0.0 111.153 178.795 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 8.0 mt-10 68.34 48.4 0.88 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.92 179.11 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.9 mttm 73.15 -4.73 2.11 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.451 ' O ' HG23 ' A' ' 8' ' ' ILE . 18.9 t -100.91 149.45 6.25 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 CA-C-O 121.094 0.473 . . . . 0.0 110.54 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.402 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -110.42 114.03 27.14 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.8 179.834 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.862 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -130.91 -138.19 4.23 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.206 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.862 HD13 ' O ' ' A' ' 14' ' ' GLY . 15.4 mm -135.64 131.87 51.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.725 0.298 . . . . 0.0 111.551 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.865 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -101.33 115.54 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 177.524 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.535 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -125.36 116.1 21.36 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.589 0.709 . . . . 0.0 110.936 -179.157 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.881 HD13 HG22 ' A' ' 103' ' ' THR . 7.2 mt -82.25 142.74 13.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.824 -178.537 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.596 ' O ' HG23 ' A' ' 22' ' ' VAL . 2.4 m120 -117.66 93.92 4.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.368 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.403 ' CG ' HG12 ' A' ' 107' ' ' ILE . 1.2 tm-20 -81.61 -0.16 41.13 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.397 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -83.64 1.36 42.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.561 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.596 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -100.55 -162.48 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.959 0.409 . . . . 0.0 111.045 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.6 t -176.86 101.04 0.23 Allowed Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.32 179.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.427 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 38.1 Cg_endo -67.98 161.87 79.35 Favored 'Cis proline' 0 C--N 1.347 0.457 0 C-N-CA 123.349 -1.521 . . . . 0.0 112.422 0.552 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.562 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -53.48 -174.71 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.868 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -161.23 144.09 12.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.564 0.697 . . . . 0.0 112.312 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.707 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 3.0 tt -108.25 149.14 29.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.753 -1.112 . . . . 0.0 108.541 178.854 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.1 m -147.42 104.65 3.66 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.168 -0.613 . . . . 0.0 112.557 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.499 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 84.9 t90 -92.02 110.44 21.81 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.727 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.479 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.5 ttm180 -110.69 130.59 55.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.925 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.3 t -49.86 156.81 0.67 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.66 0.267 . . . . 0.0 110.533 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.416 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 28.4 m -74.52 -35.71 63.18 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.438 0.637 . . . . 0.0 109.817 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -85.6 -16.01 40.69 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.119 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.62 34.22 12.03 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.358 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -87.37 -24.37 24.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.706 0.289 . . . . 0.0 111.54 -179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.27 163.01 2.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.293 0.568 . . . . 0.0 111.521 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.7 148.58 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.033 -178.864 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -123.58 120.08 31.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.61 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.49 146.42 24.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.856 0.36 . . . . 0.0 110.934 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.707 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.2 t -131.17 139.13 51.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.494 -179.373 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.416 HG12 ' HB3' ' A' ' 43' ' ' SER . 46.4 t -103.95 95.91 4.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 177.245 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.909 HD11 ' CD2' ' A' ' 104' ' ' LEU . 1.1 mm? -42.46 -22.2 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.568 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.427 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 2.1 t -77.21 -48.26 18.05 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 43.2 p -64.95 -28.11 69.3 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.85 HD12 ' HB3' ' A' ' 62' ' ' LEU . 46.1 mm -56.6 108.63 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.648 178.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.428 ' N ' ' O ' ' A' ' 63' ' ' ILE . 1.6 t0 -54.15 -31.81 53.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.886 0.374 . . . . 0.0 110.971 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.427 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 0.7 OUTLIER -171.67 164.59 6.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.75 179.814 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.862 HD11 HD13 ' A' ' 104' ' ' LEU . 11.4 tp -109.05 118.22 36.22 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.874 -179.602 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.482 ' O ' ' N ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -108.75 139.12 44.01 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.299 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.716 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -156.86 143.92 18.7 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.759 0.314 . . . . 0.0 111.291 -179.551 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.419 ' CG2' ' HB2' ' A' ' 59' ' ' MET . 7.0 p . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.414 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.467 ' HG2' ' CA ' ' A' ' 94' ' ' ARG . 2.2 mpt? . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.898 0.38 . . . . 0.0 111.235 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.624 ' HG3' ' HA ' ' A' ' 90' ' ' SER . 0.0 OUTLIER -149.95 137.88 20.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.572 -179.859 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.716 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 29.6 mt -127.8 148.89 50.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.971 178.346 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.482 ' N ' ' O ' ' A' ' 49' ' ' GLN . 12.6 ttt180 -153.17 152.4 31.2 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -179.154 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.85 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.4 mp -128.21 116.73 20.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.717 178.224 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.625 HG23 ' HG2' ' A' ' 86' ' ' ARG . 19.0 mm -76.59 156.72 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.723 0.297 . . . . 0.0 111.257 -179.365 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.435 ' N ' HG22 ' A' ' 63' ' ' ILE . . . . . . . . 0 N--CA 1.452 -0.236 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.31 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.492 HG22 ' N ' ' A' ' 67' ' ' ASP . 12.2 p . . . . . 0 N--CA 1.457 -0.108 0 CA-C-O 120.801 0.334 . . . . 0.0 111.319 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.492 ' N ' HG22 ' A' ' 66' ' ' VAL . 11.6 p-10 -122.29 53.2 1.25 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.661 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -62.95 -15.14 54.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.464 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.0 t -53.38 -25.04 13.93 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.948 0.404 . . . . 0.0 111.24 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.7 mmtm -74.12 -69.1 0.47 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.693 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.1 ptpt 42.57 81.13 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.419 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.429 ' NH1' HG11 ' A' ' 80' ' ' VAL . 0.0 OUTLIER -148.76 -175.94 5.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.16 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.41 ' HG3' ' O ' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -108.44 -173.14 2.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.898 -179.736 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -105.79 -41.19 5.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.987 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 168.17 -31.32 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.05 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -98.5 39.3 1.26 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.003 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 59.5 18.8 45.55 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.64 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.41 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 12.7 m120 -61.58 -156.45 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 110.46 -0.2 . . . . 0.0 110.46 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -162.22 114.43 1.69 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.803 0.335 . . . . 0.0 110.767 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.799 HG12 ' HD3' ' A' ' 82' ' ' PRO . 42.8 t -96.3 -69.94 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.494 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.5 HG22 ' O ' ' A' ' 81' ' ' VAL . 4.1 p 35.46 70.55 0.97 Allowed Pre-proline 0 CA--C 1.53 0.203 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.584 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.799 ' HD3' HG12 ' A' ' 80' ' ' VAL . 4.7 Cg_exo -40.18 128.79 2.25 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 123.435 2.757 . . . . 0.0 112.76 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.9 pttm -94.98 164.7 18.71 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.946 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.455 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 4.3 Cg_exo . . . . . 0 N--CA 1.461 -0.389 0 C-N-CA 123.603 2.869 . . . . 0.0 112.255 -179.117 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.625 ' HG2' HG23 ' A' ' 63' ' ' ILE . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.602 0.239 . . . . 0.0 110.528 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.474 ' CE1' HG22 ' A' ' 40' ' ' VAL . 4.2 m80 -93.7 111.21 22.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.343 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.404 ' HA ' ' HG3' ' A' ' 61' ' ' ARG . 0.1 OUTLIER -107.07 137.36 45.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.971 0.415 . . . . 0.0 111.149 -179.637 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.865 ' CD2' HD11 ' A' ' 16' ' ' ILE . 1.1 m-85 -137.0 128.84 29.05 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.775 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.624 ' HA ' ' HG3' ' A' ' 59' ' ' MET . 0.9 OUTLIER -97.22 114.42 26.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.727 179.718 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.656 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 33.1 m-85 -91.12 145.58 24.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.109 0.48 . . . . 0.0 111.496 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -108.31 27.65 9.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.487 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -165.67 111.02 0.88 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.851 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.467 ' CA ' ' HG2' ' A' ' 58' ' ' MET . 0.0 OUTLIER -58.71 -23.62 59.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.429 179.696 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -72.95 -44.07 61.57 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.8 179.152 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.41 HG13 ' CA ' ' A' ' 5' ' ' GLY . 37.7 t -65.43 -51.96 57.49 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.445 178.508 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.419 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -60.67 -36.0 77.63 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.853 179.209 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.408 ' N ' ' HG3' ' A' ' 97' ' ' MET . 4.0 m-20 -61.05 -33.75 73.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.089 179.076 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -81.64 -25.23 35.8 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.578 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.581 HG22 HD12 ' A' ' 104' ' ' LEU . 9.1 mm -84.87 -60.14 2.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.002 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.419 ' HG3' ' CB ' ' A' ' 50' ' ' ALA . 2.7 ttmm -53.31 -27.48 23.32 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.766 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.457 ' HG3' ' N ' ' A' ' 103' ' ' THR . 9.5 ptp -81.57 -39.96 23.79 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.75 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.881 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -74.95 -32.91 61.86 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-O 120.984 0.421 . . . . 0.0 110.023 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.909 ' CD2' HD11 ' A' ' 42' ' ' LEU . 11.2 mt -60.71 -58.6 7.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.458 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.445 ' HA ' HG13 ' A' ' 108' ' ' ILE . 6.1 pt20 -68.34 -33.19 73.85 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.892 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -52.8 -34.72 54.93 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.273 0.559 . . . . 0.0 109.993 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.964 HG22 ' HE1' ' A' ' 111' ' ' TYR . 6.1 mt -84.95 -52.14 12.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.141 179.095 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.604 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.75 -57.81 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.334 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.091 178.961 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.403 ' HA ' ' HG2' ' A' ' 112' ' ' LYS . 0.1 OUTLIER -47.04 -26.29 1.02 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.131 179.757 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 6.0 mtt-85 -73.05 -25.04 60.78 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.35 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.964 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -76.59 -36.15 57.7 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.727 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -79.68 -43.75 22.13 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.903 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -61.73 -31.01 71.15 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 113.913 -1.494 . . . . 0.0 108.99 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.453 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.447 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.698 178.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.418 ' O ' ' N ' ' A' ' 18' ' ' ILE . 37.1 m80 . . . . . 0 CA--C 1.53 0.204 0 N-CA-C 111.49 0.182 . . . . 0.0 111.49 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.57 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 4.9 p -152.26 153.07 33.02 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 121.205 0.526 . . . . 0.0 111.262 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.489 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 173.03 139.07 2.75 Favored Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 110.707 -0.957 . . . . 0.0 110.707 -179.539 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.552 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.84 142.51 31.46 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -178.444 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.569 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -151.81 171.1 18.26 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.179 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.653 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.77 127.05 55.58 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.266 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.554 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.493 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 7.2 t80 -128.08 110.53 12.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.957 0.408 . . . . 0.0 111.093 178.182 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 3.7 mm-40 67.46 50.09 0.96 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.892 179.131 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 69.83 -4.42 1.46 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.187 179.254 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.478 ' O ' HG23 ' A' ' 8' ' ' ILE . 17.9 t -101.38 149.05 6.66 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 CA-C-O 121.122 0.487 . . . . 0.0 110.561 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.454 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -111.85 113.49 25.86 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.033 179.991 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.879 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.98 -133.05 3.4 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.952 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.879 HD13 ' O ' ' A' ' 14' ' ' GLY . 18.7 mm -135.89 136.11 50.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 120.688 0.28 . . . . 0.0 111.255 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.864 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.68 140.52 19.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 106.425 -1.695 . . . . 0.0 106.425 176.7 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.57 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.54 118.01 5.68 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 119.629 -0.829 . . . . 0.0 111.591 -178.631 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.64 HD12 ' HB ' ' A' ' 103' ' ' THR . 20.9 mt -81.52 142.88 13.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 114.501 -1.227 . . . . 0.0 112.164 -178.753 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.618 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -119.5 92.7 3.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.914 179.034 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.68 -0.2 41.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.319 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -82.49 0.37 42.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.647 -0.251 . . . . 0.0 111.096 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.618 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.31 -163.01 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.823 0.344 . . . . 0.0 110.775 179.92 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.6 p -175.1 101.48 0.26 Allowed Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.369 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.441 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 12.4 Cg_exo -69.48 166.34 73.54 Favored 'Cis proline' 0 C--N 1.346 0.445 0 C-N-CA 123.612 -1.411 . . . . 0.0 112.704 0.348 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.484 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -59.53 178.57 0.15 Allowed 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.342 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.522 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.73 134.52 4.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.209 179.042 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.797 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.93 129.12 55.12 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.904 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.54 HG22 ' CG2' ' A' ' 37' ' ' VAL . 6.8 m -112.33 113.41 25.61 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -178.356 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.533 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 76.3 t90 -91.79 110.36 21.7 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.261 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.492 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.5 ttt180 -109.41 130.33 55.5 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.727 0.298 . . . . 0.0 111.204 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.401 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 31.1 m -49.9 159.83 0.37 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.508 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.422 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 48.3 m -75.98 -37.58 58.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.333 0.587 . . . . 0.0 109.845 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -85.56 -12.91 50.46 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.155 -0.929 . . . . 0.0 111.233 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 83.73 35.4 16.41 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.361 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -87.56 -24.87 23.89 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.709 0.29 . . . . 0.0 111.383 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.75 163.94 2.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.321 0.581 . . . . 0.0 111.427 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.54 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.6 OUTLIER -143.77 155.45 16.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.981 -178.903 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.406 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 17.0 m-70 -130.69 119.56 22.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.795 179.707 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.56 128.54 43.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.739 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.592 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -114.94 141.55 31.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.46 -179.629 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.434 ' HB ' HG23 ' A' ' 44' ' ' THR . 21.5 t -104.07 95.92 4.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 177.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.794 HD11 HD22 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -44.18 -21.94 0.05 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.835 -179.114 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.441 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER -76.92 -47.14 21.89 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.083 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.434 HG23 ' HB ' ' A' ' 41' ' ' VAL . 51.5 p -64.52 -28.08 69.41 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.321 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.869 HD12 ' HB3' ' A' ' 62' ' ' LEU . 49.9 mm -56.68 103.57 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.411 178.48 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.416 ' N ' ' O ' ' A' ' 63' ' ' ILE . 24.2 t70 -58.26 -20.26 40.74 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.807 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.471 ' HG2' HG12 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -172.6 160.18 4.59 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.105 0.478 . . . . 0.0 111.453 -179.877 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.799 HD21 ' HB2' ' A' ' 104' ' ' LEU . 12.2 tp -109.03 120.33 42.23 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.334 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' A' ' 61' ' ' ARG . 0.4 OUTLIER -122.52 145.59 48.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.63 0.252 . . . . 0.0 111.295 -179.641 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.618 ' CB ' HD22 ' A' ' 60' ' ' LEU . . . -157.3 149.86 23.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.667 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.585 HG23 ' HB2' ' A' ' 59' ' ' MET . 43.3 p . . . . . 0 CA--C 1.53 0.179 0 C-N-CA 121.045 -0.262 . . . . 0.0 110.87 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.77 0.319 . . . . 0.0 110.585 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.585 ' HB2' HG23 ' A' ' 51' ' ' THR . 23.8 mtm -143.97 142.93 30.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.861 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.618 HD22 ' CB ' ' A' ' 50' ' ' ALA . 17.9 mt -118.17 146.25 44.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.044 178.715 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.41 ' N ' ' O ' ' A' ' 49' ' ' GLN . 18.6 ttp180 -143.12 145.59 32.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.972 0.415 . . . . 0.0 112.119 -178.747 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.869 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -128.19 109.07 11.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.889 178.231 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.471 HG12 ' HG2' ' A' ' 47' ' ' LYS . 7.8 mm -76.64 156.41 5.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.994 -0.282 . . . . 0.0 110.891 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.356 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.417 179.939 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.446 HG22 ' N ' ' A' ' 67' ' ' ASP . 9.3 p . . . . . 0 CA--C 1.528 0.119 0 CA-C-O 120.707 0.289 . . . . 0.0 110.994 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.446 ' N ' HG22 ' A' ' 66' ' ' VAL . 6.5 t70 -136.99 38.36 2.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.197 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 44.67 30.16 0.49 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.312 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 64.6 m -102.1 -22.76 14.17 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.215 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 30.7 mmtm -56.4 -82.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.971 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.7 mttm 55.09 89.81 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.865 0.364 . . . . 0.0 111.129 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.41 ' HG2' ' CG ' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -124.57 134.42 52.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.863 179.95 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.7 mmtt -73.51 148.52 43.02 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.776 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -103.93 -31.74 9.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.037 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 168.57 -31.38 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.101 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -105.11 20.46 18.82 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.327 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 53.84 36.93 56.49 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.532 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -83.6 2.97 34.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.701 0.286 . . . . 0.0 111.646 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 79' ' ' GLU . 9.5 pt-20 42.39 74.38 0.11 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.223 -0.444 . . . . 0.0 112.008 179.539 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.448 HG12 ' N ' ' A' ' 81' ' ' VAL . 40.5 t -76.87 155.41 5.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.32 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.448 ' N ' HG12 ' A' ' 80' ' ' VAL . 52.3 t -110.9 78.96 1.73 Allowed Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.341 179.363 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.41 ' CG ' ' HG2' ' A' ' 72' ' ' ARG . 93.9 Cg_exo -41.24 156.02 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.907 2.405 . . . . 0.0 112.795 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.9 ptpp? -44.69 164.94 0.16 Allowed Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.217 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.438 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.8 Cg_exo . . . . . 0 N--CA 1.462 -0.335 0 C-N-CA 123.543 2.828 . . . . 0.0 112.771 -178.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.61 0.243 . . . . 0.0 110.6 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.564 ' CE1' HG22 ' A' ' 40' ' ' VAL . 7.4 m80 -93.13 111.18 22.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.73 0.3 . . . . 0.0 110.303 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 16.6 ttt -94.18 118.26 31.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.283 -179.432 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.864 ' CD1' HD11 ' A' ' 16' ' ' ILE . 92.8 m-85 -116.98 116.63 27.76 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.654 179.656 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.439 ' HB3' ' HB ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -94.57 114.58 26.58 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.972 0.415 . . . . 0.0 110.545 179.931 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.518 ' CE1' ' HB2' ' A' ' 7' ' ' ALA . 5.8 m-85 -89.63 147.32 23.97 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.394 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -109.47 29.14 7.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.0 179.133 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.428 ' CB ' HG23 ' A' ' 96' ' ' VAL . 7.5 m-20 -174.97 117.69 0.18 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.585 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.481 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -59.47 -14.93 14.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.778 179.614 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.02 -50.83 18.02 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.025 0.44 . . . . 0.0 110.267 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.428 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -64.43 -43.71 97.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.658 179.247 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.481 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -64.38 -36.94 85.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.931 179.381 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -62.88 -28.73 70.24 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.817 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.455 ' O ' ' HG2' ' A' ' 102' ' ' MET . 5.4 m120 -81.69 -65.41 1.02 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.276 179.265 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.642 HG22 HD11 ' A' ' 104' ' ' LEU . 22.6 mm -47.32 -57.64 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.212 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.432 ' HA ' HD12 ' A' ' 104' ' ' LEU . 0.1 OUTLIER -50.03 -35.46 24.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.733 -179.416 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.531 ' HG3' ' N ' ' A' ' 103' ' ' THR . 9.0 ptp -83.04 -41.49 18.6 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.647 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.64 ' HB ' HD12 ' A' ' 18' ' ' ILE . 0.2 OUTLIER -56.85 -50.76 71.47 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 120.822 0.344 . . . . 0.0 110.564 179.505 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.799 ' HB2' HD21 ' A' ' 48' ' ' LEU . 5.5 mt -52.73 -52.5 55.99 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 179.086 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.71 ' HG2' HD23 ' A' ' 48' ' ' LEU . 58.6 mm-40 -55.46 -47.76 75.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.017 179.493 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -49.62 -34.8 19.06 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 121.134 0.492 . . . . 0.0 110.607 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.012 HG22 ' HE1' ' A' ' 111' ' ' TYR . 9.2 mt -85.69 -52.07 12.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.49 179.42 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.667 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -42.52 -57.06 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.622 179.484 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.449 ' HA ' ' HG2' ' A' ' 112' ' ' LYS . 10.1 t -47.98 -26.95 1.96 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.942 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.452 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 11.7 mtp-105 -72.36 -25.03 61.37 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.022 179.728 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 1.012 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -75.54 -34.95 60.79 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.599 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.767 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.73 -43.17 17.12 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.987 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -61.3 -32.36 72.21 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 113.815 -1.539 . . . . 0.0 108.99 178.183 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.452 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.449 -0.481 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.727 178.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.415 ' CD2' ' HG2' ' A' ' 20' ' ' GLU . 16.4 m80 . . . . . 0 CA--C 1.529 0.17 0 CA-C-O 120.542 0.21 . . . . 0.0 111.249 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.546 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 6.5 p -156.54 136.96 13.03 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 121.196 0.522 . . . . 0.0 111.145 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.517 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -171.73 138.54 4.89 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 110.751 -0.939 . . . . 0.0 110.751 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.565 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -81.29 142.75 32.81 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.409 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.516 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -155.74 170.98 20.79 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.364 -179.323 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.607 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -100.85 126.17 54.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.239 -179.826 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.537 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 58.4 t80 -117.25 108.6 15.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.047 0.451 . . . . 0.0 111.569 178.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 67.1 mt-10 58.49 55.55 4.82 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.84 178.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.4 mtmm 71.99 -6.66 1.44 Allowed 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.46 ' O ' HG23 ' A' ' 8' ' ' ILE . 34.0 t -101.73 150.16 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.549 0 CA-C-O 121.235 0.54 . . . . 0.0 110.545 179.383 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.438 ' HA ' HD12 ' A' ' 8' ' ' ILE . 90.4 p -106.1 144.76 32.35 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.003 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.908 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -171.67 -141.86 3.51 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.034 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.908 HD13 ' O ' ' A' ' 14' ' ' GLY . 13.8 mm -132.38 136.19 56.66 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.475 0 CA-C-O 120.938 0.399 . . . . 0.0 111.465 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.8 HD11 ' CG ' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.76 141.37 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 N-CA-C 106.332 -1.729 . . . . 0.0 106.332 176.759 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.546 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.61 118.59 5.85 Favored 'General case' 0 C--N 1.313 -1.002 0 C-N-CA 119.663 -0.815 . . . . 0.0 111.478 -178.498 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.626 HD12 ' HB ' ' A' ' 103' ' ' THR . 20.1 mt -82.0 142.99 12.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.255 -178.668 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.643 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -119.8 92.51 3.8 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.872 178.871 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.415 ' HG2' ' CD2' ' A' ' 3' ' ' HIS . 0.7 OUTLIER -82.85 0.92 41.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.376 -179.651 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -82.79 0.81 42.06 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.06 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.643 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.39 -162.07 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.852 0.358 . . . . 0.0 110.709 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.407 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 11.6 p -175.01 101.23 0.26 Allowed Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.541 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.434 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 9.8 Cg_exo -70.98 165.94 78.69 Favored 'Cis proline' 0 C--N 1.348 0.504 0 C-N-CA 123.617 -1.41 . . . . 0.0 112.634 0.395 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.44 ' CB ' HG21 ' A' ' 107' ' ' ILE . . . -59.66 177.92 0.19 Allowed 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.406 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.561 ' HG2' HG21 ' A' ' 22' ' ' VAL . 6.7 pt-20 -163.68 137.15 5.55 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.003 179.077 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.775 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.86 127.67 53.93 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 178.99 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.617 HG22 ' CG2' ' A' ' 37' ' ' VAL . 3.1 m -109.67 111.15 22.44 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 -178.521 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.537 ' CE2' ' HB3' ' A' ' 9' ' ' PHE . 65.6 t90 -91.95 113.68 26.02 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 116.233 -0.439 . . . . 0.0 109.868 178.651 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.433 ' O ' ' N ' ' A' ' 15' ' ' ILE . 2.5 ttt180 -106.91 133.52 51.43 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.658 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 27.3 m -49.72 166.49 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.251 -0.277 . . . . 0.0 110.251 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.0 m -76.8 -43.23 37.51 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.479 0.657 . . . . 0.0 109.894 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -83.96 -13.78 52.51 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.185 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.22 34.22 10.93 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.276 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.79 -23.08 29.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.684 0.278 . . . . 0.0 111.574 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.9 163.59 2.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.32 0.581 . . . . 0.0 111.422 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.617 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.6 146.03 19.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.985 -178.747 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.448 ' ND1' ' CZ ' ' A' ' 9' ' ' PHE . 1.4 m-70 -122.04 123.53 41.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.828 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.51 126.32 41.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.814 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.568 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -112.47 140.16 33.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.265 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.43 ' HB ' HG23 ' A' ' 44' ' ' THR . 23.3 t -104.01 96.49 4.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 177.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.73 HD11 HD22 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -43.05 -24.28 0.07 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.774 -179.019 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.434 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.8 OUTLIER -74.95 -47.95 26.89 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.281 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.43 HG23 ' HB ' ' A' ' 41' ' ' VAL . 48.7 p -64.64 -28.11 69.39 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 178.438 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.875 HD12 ' HB3' ' A' ' 62' ' ' LEU . 41.8 mm -57.59 99.83 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.526 178.563 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.453 ' N ' ' O ' ' A' ' 63' ' ' ILE . 16.5 t70 -47.48 -28.72 2.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.7 0.286 . . . . 0.0 111.31 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.45 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 1.4 pttt -172.72 156.97 3.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.894 0.378 . . . . 0.0 110.741 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.959 HD11 HD13 ' A' ' 104' ' ' LEU . 3.6 tp -109.1 122.47 47.36 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.714 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.616 ' OE1' HD11 ' A' ' 63' ' ' ILE . 17.9 mt-30 -118.75 151.99 37.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.793 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.661 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.16 150.47 23.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.78 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.594 HG23 ' HB2' ' A' ' 59' ' ' MET . 25.9 p . . . . . 0 C--N 1.332 -0.156 0 CA-C-O 120.63 0.252 . . . . 0.0 110.84 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.419 ' HG2' ' CB ' ' A' ' 94' ' ' ARG . 1.6 mpp? . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.764 0.316 . . . . 0.0 110.833 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.594 ' HB2' HG23 ' A' ' 51' ' ' THR . 14.2 mtm -149.69 143.6 25.57 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.648 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.661 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 24.0 mt -120.27 140.15 51.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.084 178.721 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.401 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 0.6 OUTLIER -135.42 148.84 49.45 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 120.917 0.389 . . . . 0.0 111.842 -179.169 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.875 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.4 mp -127.87 113.14 15.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.876 178.577 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.832 HG23 ' HG2' ' A' ' 86' ' ' ARG . 8.8 mm -76.66 145.53 10.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.649 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.381 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.558 -179.991 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.467 HG22 ' N ' ' A' ' 67' ' ' ASP . 11.5 p . . . . . 0 N--CA 1.457 -0.122 0 CA-C-O 120.878 0.37 . . . . 0.0 111.318 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.467 ' N ' HG22 ' A' ' 66' ' ' VAL . 4.8 m-20 -123.01 43.49 2.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.762 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.1 -20.87 57.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.17 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.32 -21.98 51.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.073 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.1 mmtm -67.11 -65.82 0.63 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.881 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.1 ptmt 43.15 80.78 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.453 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.16 164.41 17.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.942 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.3 mttp -116.68 154.93 29.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.921 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -86.96 170.72 11.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.933 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -59.88 -20.4 56.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.244 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -98.15 31.8 2.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.938 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 59.35 24.63 59.34 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.488 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 12.7 m-20 -78.88 -167.62 1.18 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.727 0.298 . . . . 0.0 110.779 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -147.0 126.82 13.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.867 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 59.6 t -95.07 -65.54 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.373 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.435 ' O ' HG13 ' A' ' 81' ' ' VAL . 4.5 p 34.11 78.26 0.33 Allowed Pre-proline 0 CA--C 1.53 0.188 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.855 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -44.02 124.14 4.58 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.891 2.394 . . . . 0.0 112.676 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.404 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 3.6 mtpt -84.59 159.57 58.08 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.965 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 4.1 Cg_exo . . . . . 0 N--CA 1.46 -0.487 0 C-N-CA 123.533 2.822 . . . . 0.0 112.402 -179.101 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.832 ' HG2' HG23 ' A' ' 63' ' ' ILE . 37.4 mtt180 . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.565 0.222 . . . . 0.0 110.541 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.554 ' CE1' HG22 ' A' ' 40' ' ' VAL . 13.7 m80 -97.32 111.32 23.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.69 0.281 . . . . 0.0 110.349 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 7.5 ttt -94.08 112.97 24.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.997 0.427 . . . . 0.0 111.175 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.8 ' CG ' HD11 ' A' ' 16' ' ' ILE . 90.8 m-85 -116.04 116.63 28.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.628 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -99.2 114.5 27.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.973 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.516 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 5.4 m-85 -95.04 133.66 38.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.149 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 37.5 m-20 -93.64 43.67 1.12 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.685 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.521 ' CB ' HG23 ' A' ' 96' ' ' VAL . 4.5 m-20 176.8 109.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.409 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.459 ' O ' ' HG3' ' A' ' 97' ' ' MET . 0.0 OUTLIER -52.96 -21.06 3.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.959 -179.995 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.34 -44.97 70.55 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 120.831 0.348 . . . . 0.0 110.633 179.767 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.521 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -66.17 -49.84 73.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.882 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.459 ' HG3' ' O ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -62.73 -36.57 83.43 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.351 179.5 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.453 ' O ' ' HG2' ' A' ' 102' ' ' MET . 8.6 t70 -67.6 -35.1 78.33 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.047 0.451 . . . . 0.0 110.053 179.445 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 68.6 m-20 -82.23 -29.58 31.25 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.712 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.517 HD11 ' N ' ' A' ' 5' ' ' GLY . 1.2 mm -83.19 -59.91 2.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.471 -179.512 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 6.6 ttmt -44.41 -28.69 0.58 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.328 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.453 ' HG2' ' O ' ' A' ' 98' ' ' ASP . 6.3 ptm -79.85 -40.29 28.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.424 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.626 ' HB ' HD12 ' A' ' 18' ' ' ILE . 0.2 OUTLIER -57.79 -58.89 6.38 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.715 179.563 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.959 HD13 HD11 ' A' ' 48' ' ' LEU . 4.7 mt -47.16 -50.48 20.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.76 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.462 ' HG2' ' CD2' ' A' ' 48' ' ' LEU . 6.6 mm100 -56.65 -50.59 71.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.316 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.432 ' HG2' HG13 ' A' ' 107' ' ' ILE . 1.2 pt20 -50.88 -31.3 17.02 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 121.022 0.439 . . . . 0.0 110.921 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.038 HG22 ' HE1' ' A' ' 111' ' ' TYR . 8.4 mt -85.61 -52.94 11.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.652 179.508 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.715 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.51 -56.78 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.808 179.614 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.427 ' HA ' ' HG2' ' A' ' 112' ' ' LYS . 41.2 t -47.83 -26.57 1.7 Allowed 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.264 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 0.0 OUTLIER -74.75 -24.84 58.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.715 179.816 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 1.038 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -74.08 -34.2 63.91 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 179.154 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.765 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.76 -43.22 17.01 Favored 'General case' 0 CA--C 1.505 -0.753 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 179.059 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -61.67 -32.2 72.37 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.901 -1.5 . . . . 0.0 108.992 178.121 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.453 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.435 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.556 178.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.411 ' NE2' ' HB2' ' A' ' 20' ' ' GLU . 26.1 m170 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.777 0.323 . . . . 0.0 111.055 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.553 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 50.7 p -160.99 155.18 22.9 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.081 0.467 . . . . 0.0 111.087 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.439 ' O ' ' HB ' ' A' ' 16' ' ' ILE . . . 172.67 136.36 2.14 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.284 -179.63 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.576 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -79.79 138.08 37.16 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.102 0.477 . . . . 0.0 112.086 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.67 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -147.11 171.6 15.06 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.535 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.651 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.15 129.95 51.35 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.254 -179.884 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.538 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 62.2 t80 -124.34 109.81 13.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.979 0.418 . . . . 0.0 111.418 178.644 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 61.59 45.35 8.23 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.643 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.7 mtpp 78.19 -4.48 2.2 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 179.208 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.467 ' O ' HG23 ' A' ' 8' ' ' ILE . 28.2 t -99.94 150.82 5.19 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.466 0 CA-C-O 121.119 0.485 . . . . 0.0 110.369 179.345 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.403 ' HA ' HD12 ' A' ' 8' ' ' ILE . 90.5 p -105.69 116.0 31.19 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.127 -179.65 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.425 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -138.54 -158.55 7.77 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.13 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.576 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 18.7 mm -119.8 131.82 71.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.765 0.317 . . . . 0.0 111.325 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.861 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.4 OUTLIER -101.19 114.02 39.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.949 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -123.1 115.89 22.57 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.582 0.706 . . . . 0.0 110.831 -179.262 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.766 HD13 HG22 ' A' ' 103' ' ' THR . 15.7 mt -85.25 142.9 12.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 114.749 -1.114 . . . . 0.0 111.891 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.602 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.7 m120 -117.77 97.44 5.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.279 179.416 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.411 ' HB2' ' NE2' ' A' ' 3' ' ' HIS . 0.0 OUTLIER -84.1 -1.81 55.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.299 -179.757 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -82.92 1.37 39.94 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.486 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -98.35 -162.41 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.846 0.355 . . . . 0.0 110.943 180.0 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.0 p -173.97 99.98 0.3 Allowed Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.345 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.476 ' CG ' ' HB2' ' A' ' 43' ' ' SER . 56.6 Cg_endo -71.09 164.29 83.34 Favored 'Cis proline' 0 C--N 1.346 0.427 0 C-N-CA 123.605 -1.415 . . . . 0.0 112.867 0.361 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.582 ' CB ' HG21 ' A' ' 107' ' ' ILE . . . -54.99 -175.84 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.978 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -163.53 147.11 10.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.629 0.728 . . . . 0.0 112.482 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.693 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 2.8 tt -108.2 149.01 29.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.646 -1.161 . . . . 0.0 108.466 178.847 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.755 HG23 HG23 ' A' ' 39' ' ' THR . 0.2 OUTLIER -145.42 102.6 3.73 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -178.676 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.538 ' CE2' ' HB3' ' A' ' 9' ' ' PHE . 78.4 t90 -92.13 114.04 26.48 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.735 178.304 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.457 ' O ' ' N ' ' A' ' 15' ' ' ILE . 12.6 ptp180 -114.83 135.13 54.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.639 0.256 . . . . 0.0 110.534 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.5 m -49.81 158.24 0.5 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.717 0.294 . . . . 0.0 110.499 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 32.4 m -72.49 -36.0 68.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.416 0.627 . . . . 0.0 109.707 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -86.13 -18.26 32.78 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.024 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.76 32.56 9.94 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.439 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -85.79 -21.58 28.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.592 0.234 . . . . 0.0 111.52 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.1 158.71 2.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.356 0.598 . . . . 0.0 111.422 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.488 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.68 140.39 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.945 -178.72 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.496 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 0.6 OUTLIER -115.86 125.51 52.75 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.587 179.539 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.755 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -98.07 146.19 25.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.054 -179.677 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.693 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.2 t -129.91 136.7 58.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.144 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.422 ' O ' HG12 ' A' ' 45' ' ' ILE . 47.8 t -104.04 95.86 4.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.427 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.678 HD11 HD22 ' A' ' 104' ' ' LEU . 0.9 OUTLIER -41.93 -24.97 0.05 Allowed 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.642 -178.81 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.476 ' HB2' ' CG ' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -72.99 -51.27 18.91 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 178.621 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 30.8 p -64.93 -28.41 69.51 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 178.3 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.849 HD12 ' HB3' ' A' ' 62' ' ' LEU . 42.1 mm -56.39 103.31 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.22 178.682 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 63' ' ' ILE . 16.9 t70 -54.53 -31.93 57.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.154 -0.476 . . . . 0.0 112.048 -179.19 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.427 ' O ' ' CG2' ' A' ' 45' ' ' ILE . 53.2 mtmt -157.6 162.97 38.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.539 0.685 . . . . 0.0 112.285 -179.463 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.675 HD13 HD11 ' A' ' 108' ' ' ILE . 9.0 tp -111.52 121.68 45.82 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.118 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.615 ' NE2' HD11 ' A' ' 63' ' ' ILE . 12.0 mt-30 -125.01 136.44 53.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.62 0.247 . . . . 0.0 111.181 -179.511 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.671 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.07 141.23 16.37 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.041 179.61 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.642 HG23 ' HB3' ' A' ' 59' ' ' MET . 37.4 p . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.241 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.429 ' HB2' ' HG2' ' A' ' 97' ' ' MET . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.085 0 CA-C-O 121.177 0.513 . . . . 0.0 111.351 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.642 ' HB3' HG23 ' A' ' 51' ' ' THR . 7.8 ttp -149.95 138.03 20.34 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.845 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.671 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 26.7 mt -119.51 150.18 40.68 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.117 178.726 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.561 ' N ' ' O ' ' A' ' 49' ' ' GLN . 2.3 ttt180 -150.91 148.18 28.11 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -178.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.849 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.3 mp -128.6 118.78 23.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.896 178.293 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.615 HD11 ' NE2' ' A' ' 49' ' ' GLN . 25.0 mm -76.53 156.45 5.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.649 0.262 . . . . 0.0 111.033 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.445 ' N ' HG22 ' A' ' 63' ' ' ILE . . . . . . . . 0 N--CA 1.452 -0.297 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.524 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.48 HG22 ' N ' ' A' ' 67' ' ' ASP . 12.9 p . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.767 0.318 . . . . 0.0 111.081 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.48 ' N ' HG22 ' A' ' 66' ' ' VAL . 16.6 m-20 -115.66 40.24 2.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.009 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.506 ' HA ' HG13 ' A' ' 81' ' ' VAL . 20.8 pt-20 -64.6 -21.06 66.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.058 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 41.5 t -88.69 -22.81 23.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.106 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.6 mmmt -83.97 -41.01 17.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.865 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.609 ' HG2' HG22 ' A' ' 81' ' ' VAL . 16.1 mtmt 61.98 93.23 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.028 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.408 ' N ' ' O ' ' A' ' 80' ' ' VAL . 0.0 OUTLIER -61.83 -176.46 0.09 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.708 179.862 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -141.75 -170.54 3.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.795 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -125.21 -68.08 0.86 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.12 0.486 . . . . 0.0 111.043 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 179.24 -33.36 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.105 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -95.95 38.47 1.18 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.931 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 72.13 8.24 69.17 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.768 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -60.02 -173.74 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.809 0.338 . . . . 0.0 110.924 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -154.11 137.12 15.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.864 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.408 ' O ' ' N ' ' A' ' 72' ' ' ARG . 2.1 t -128.35 145.13 35.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.35 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.609 HG22 ' HG2' ' A' ' 71' ' ' LYS . 81.5 t -123.46 69.96 43.89 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.129 179.231 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_exo -43.1 124.7 3.87 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.789 2.326 . . . . 0.0 112.724 -179.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.3 mmtt -59.56 164.32 5.56 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.094 0.473 . . . . 0.0 110.978 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.439 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 4.6 Cg_exo . . . . . 0 N--CA 1.46 -0.454 0 C-N-CA 123.601 2.867 . . . . 0.0 112.284 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.477 ' NE ' HD12 ' A' ' 63' ' ' ILE . 30.2 mtt180 . . . . . 0 C--O 1.232 0.163 0 N-CA-C 110.286 -0.265 . . . . 0.0 110.286 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.585 ' CE1' HG22 ' A' ' 40' ' ' VAL . 10.6 m80 -97.82 111.52 23.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.637 0.256 . . . . 0.0 110.558 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.85 122.45 42.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.941 0.401 . . . . 0.0 110.899 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.861 ' CD1' HD11 ' A' ' 16' ' ' ILE . 79.5 m-85 -125.58 116.87 22.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.775 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.437 ' HA ' ' HG3' ' A' ' 59' ' ' MET . 0.8 OUTLIER -95.83 114.55 26.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.145 -179.788 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.67 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 23.6 m-85 -91.42 158.63 16.4 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.169 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 -115.61 29.94 7.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.552 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.5 ' CB ' HG23 ' A' ' 96' ' ' VAL . 4.2 m-20 -173.43 115.84 0.25 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.532 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.449 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 10.4 ttp85 -58.95 -15.92 15.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.017 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.45 -43.7 54.99 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 121.03 0.443 . . . . 0.0 110.174 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.5 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -67.75 -48.48 75.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.437 179.102 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.449 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -62.05 -36.08 80.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.998 179.153 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.424 ' N ' ' HG3' ' A' ' 97' ' ' MET . 2.0 m-20 -62.57 -33.87 75.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.255 179.335 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 16.6 m-20 -81.87 -30.44 32.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.613 179.42 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.529 HG23 HD11 ' A' ' 18' ' ' ILE . 3.7 mm -79.53 -60.28 2.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.982 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.411 ' HG3' ' CB ' ' A' ' 50' ' ' ALA . 12.0 ttmt -51.85 -28.19 15.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.537 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 12.4 mtm -81.88 -29.39 32.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.941 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.766 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -82.42 -41.44 19.88 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.123 179.894 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.678 HD22 HD11 ' A' ' 42' ' ' LEU . 32.6 mt -56.81 -52.5 64.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.017 0.437 . . . . 0.0 109.855 179.131 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.662 ' HG2' HD23 ' A' ' 48' ' ' LEU . 5.3 mm-40 -61.98 -48.05 82.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.012 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -47.24 -33.06 5.07 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.985 0.422 . . . . 0.0 111.014 -179.562 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.043 HG22 ' HE1' ' A' ' 111' ' ' TYR . 3.5 mt -85.77 -52.14 12.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.68 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.716 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.14 -59.34 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.63 179.758 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -47.08 -24.89 0.73 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.228 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.447 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 49.8 mtp85 -74.69 -25.31 59.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.385 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 1.043 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -76.18 -34.19 59.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.184 0.516 . . . . 0.0 109.611 179.656 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.739 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.21 -43.61 19.0 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 178.98 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -62.29 -31.67 72.3 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 113.737 -1.574 . . . . 0.0 109.07 178.263 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.447 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.449 -0.487 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.676 178.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.407 ' NE2' ' HB2' ' A' ' 20' ' ' GLU . 29.8 m170 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.571 0.224 . . . . 0.0 111.359 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.57 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 3.5 p -152.65 155.28 37.0 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.046 0.451 . . . . 0.0 111.051 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.499 ' O ' ' HB ' ' A' ' 16' ' ' ILE . . . 174.29 139.97 3.13 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 111.101 -0.799 . . . . 0.0 111.101 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.555 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -84.04 143.99 29.38 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.206 0.527 . . . . 0.0 112.333 -178.694 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.55 ' C ' HD13 ' A' ' 8' ' ' ILE . . . -153.48 171.26 18.96 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.19 -179.27 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.668 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.99 123.49 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.563 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.468 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.6 t80 -123.85 109.55 13.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.978 0.418 . . . . 0.0 111.082 178.317 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 30.6 mt-10 67.84 51.27 0.79 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.735 179.087 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.8 mmtp 69.07 -2.74 1.69 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.264 -0.425 . . . . 0.0 112.12 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.476 ' O ' HG23 ' A' ' 8' ' ' ILE . 20.1 t -102.81 148.79 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.47 0 CA-C-O 121.096 0.474 . . . . 0.0 110.625 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.459 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -111.22 112.47 24.27 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.941 179.835 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.89 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.42 -134.62 3.63 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.829 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.89 HD13 ' O ' ' A' ' 14' ' ' GLY . 18.0 mm -135.85 135.62 50.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.721 0.296 . . . . 0.0 111.332 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.94 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.57 141.23 17.77 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.66 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 176.476 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.57 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -150.93 117.44 5.73 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 119.574 -0.851 . . . . 0.0 111.489 -178.741 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.958 HD13 HG22 ' A' ' 103' ' ' THR . 6.2 mt -87.12 142.28 13.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 114.565 -1.198 . . . . 0.0 111.703 -178.785 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.633 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.5 t-20 -120.13 92.99 3.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.467 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.407 ' HB2' ' NE2' ' A' ' 3' ' ' HIS . 0.1 OUTLIER -80.69 -0.05 36.54 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.411 -179.862 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -82.93 0.53 43.97 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.289 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.633 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -101.59 -162.5 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.844 0.354 . . . . 0.0 110.853 179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.5 t -174.06 101.33 0.3 Allowed Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.504 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.439 ' HB3' ' OG ' ' A' ' 43' ' ' SER . 61.1 Cg_endo -73.15 160.3 95.95 Favored 'Cis proline' 0 C--N 1.347 0.486 0 C-N-CA 123.455 -1.477 . . . . 0.0 112.758 0.367 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.412 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -52.15 175.39 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.52 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.466 ' CG ' HG21 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -163.65 136.31 5.24 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.14 179.343 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.815 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.99 149.15 28.74 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.787 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.709 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.5 m -135.15 112.97 10.92 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -178.368 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.556 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 79.4 t90 -92.04 110.64 22.02 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 178.318 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 15' ' ' ILE . 4.2 ttt180 -110.4 131.23 55.24 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.972 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.7 t -49.83 158.86 0.44 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.475 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.416 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 46.1 m -74.74 -37.18 62.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.459 0.647 . . . . 0.0 109.773 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -84.37 -15.96 44.53 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.124 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.59 34.55 11.55 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.322 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -85.37 -26.8 26.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.742 0.306 . . . . 0.0 111.309 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.31 164.24 3.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.319 0.58 . . . . 0.0 111.441 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.709 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.64 147.0 18.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.041 -178.769 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 36.9 m-70 -121.01 119.86 33.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.587 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.43 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.43 142.85 28.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.803 -179.905 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.522 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.1 t -131.54 140.22 48.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.49 -179.437 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.416 ' O ' HG12 ' A' ' 45' ' ' ILE . 49.9 t -103.79 96.43 4.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 177.663 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.782 HD11 HD22 ' A' ' 104' ' ' LEU . 0.8 OUTLIER -41.94 -24.77 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.931 -178.819 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.439 ' OG ' ' HB3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -74.54 -49.09 23.3 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.535 -0.542 . . . . 0.0 109.535 179.218 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 46.6 p -64.64 -27.82 69.19 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.481 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.878 HD12 ' HB3' ' A' ' 62' ' ' LEU . 43.2 mm -56.66 106.92 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.623 178.85 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.424 ' N ' ' O ' ' A' ' 63' ' ' ILE . 19.5 t70 -52.56 -30.88 33.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.119 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.436 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 11.0 pttt -172.49 163.8 5.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.97 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.993 HD11 HD13 ' A' ' 104' ' ' LEU . 21.2 tp -108.95 116.68 32.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.56 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -110.92 144.14 40.46 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.61 0.243 . . . . 0.0 110.439 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.642 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.09 148.9 22.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.619 0.247 . . . . 0.0 111.277 -179.588 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.623 HG23 ' HB2' ' A' ' 59' ' ' MET . 19.6 p . . . . . 0 C--N 1.331 -0.216 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.888 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.402 ' HG2' ' CA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.805 0.336 . . . . 0.0 110.875 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.623 ' HB2' HG23 ' A' ' 51' ' ' THR . 1.8 mpp? -144.58 138.49 27.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.286 -179.805 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.642 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 15.2 mt -118.71 140.37 50.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.313 178.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.403 ' HD3' ' CB ' ' A' ' 88' ' ' MET . 25.5 ttp180 -141.33 150.42 42.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.076 0.465 . . . . 0.0 112.017 -179.106 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.878 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -128.41 114.13 16.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.836 178.407 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.488 ' HA ' ' HB3' ' A' ' 86' ' ' ARG . 6.7 mm -76.77 156.52 5.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.659 0.266 . . . . 0.0 111.043 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.509 -179.886 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.482 HG22 ' N ' ' A' ' 67' ' ' ASP . 13.3 p . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.862 0.363 . . . . 0.0 111.312 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.482 ' N ' HG22 ' A' ' 66' ' ' VAL . 19.7 p-10 -100.39 43.94 1.04 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.798 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.95 -12.07 61.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.308 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -55.0 -24.36 23.88 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.937 0.399 . . . . 0.0 111.115 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.6 mmmt -74.98 -69.36 0.47 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.687 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 42.97 82.31 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.241 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.402 ' HD3' ' C ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -129.33 168.01 16.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.277 -179.925 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 18.0 mmtp -80.45 -166.91 1.17 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.699 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -109.42 -48.65 3.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.057 0.456 . . . . 0.0 110.931 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 168.87 -31.46 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.089 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -100.13 -16.57 17.78 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.324 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 135.54 -7.05 4.25 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.95 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -57.61 -166.11 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.734 0.302 . . . . 0.0 110.904 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -146.39 131.11 17.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.743 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.4 t -95.08 -66.51 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.5 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.444 ' O ' HG13 ' A' ' 81' ' ' VAL . 4.4 p 34.53 81.24 0.24 Allowed Pre-proline 0 CA--C 1.53 0.199 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.684 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_exo -42.11 128.25 4.16 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.954 2.436 . . . . 0.0 112.823 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.0 159.07 85.68 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.949 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo . . . . . 0 N--CA 1.461 -0.44 0 C-N-CA 123.492 2.795 . . . . 0.0 112.488 -179.125 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.488 ' HB3' ' HA ' ' A' ' 63' ' ' ILE . 23.2 ptt-85 . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.579 0.228 . . . . 0.0 110.798 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.418 ' CE1' HG22 ' A' ' 40' ' ' VAL . 2.7 m80 -99.74 111.01 23.37 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.403 ' CB ' ' HD3' ' A' ' 61' ' ' ARG . 15.4 ttt -94.19 136.31 34.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.071 0.462 . . . . 0.0 111.818 -179.04 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.94 ' CD2' HD11 ' A' ' 16' ' ' ILE . 19.3 m-85 -133.51 116.69 16.27 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.365 179.397 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.422 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.8 OUTLIER -87.1 115.94 24.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.968 0.413 . . . . 0.0 110.793 -179.959 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.47 ' CE2' HG13 ' A' ' 100' ' ' ILE . 8.6 m-85 -91.1 137.54 32.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.592 -179.653 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -101.62 29.4 4.9 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.532 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.463 ' CB ' HG23 ' A' ' 96' ' ' VAL . 4.9 m-20 -175.97 119.95 0.16 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.432 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.474 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 10.7 ttp85 -60.98 -15.06 27.26 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.718 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -75.67 -47.57 25.71 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.954 0.407 . . . . 0.0 110.387 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.463 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -66.91 -42.86 89.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.722 179.286 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.474 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -65.76 -36.95 85.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.953 179.415 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.412 ' N ' ' HG3' ' A' ' 97' ' ' MET . 6.4 m-20 -65.25 -27.24 68.51 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.269 179.047 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.452 ' O ' ' HG2' ' A' ' 102' ' ' MET . 66.9 m-20 -81.74 -52.49 7.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.599 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.835 HG22 HD11 ' A' ' 104' ' ' LEU . 12.6 mm -63.16 -59.3 4.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.094 0.473 . . . . 0.0 110.488 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.52 ' HA ' HD12 ' A' ' 104' ' ' LEU . 6.4 ttmt -47.33 -36.31 9.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.415 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.452 ' HG2' ' O ' ' A' ' 99' ' ' ASN . 7.7 ptp -83.47 -37.78 22.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.726 -179.23 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.958 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -70.9 -27.68 63.97 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.181 -178.954 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.993 HD13 HD11 ' A' ' 48' ' ' LEU . 5.4 mt -71.22 -43.34 67.53 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.41 ' HA ' HG13 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -62.97 -50.39 70.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.243 -0.889 . . . . 0.0 112.449 -179.448 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.49 ' HG3' ' O ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -49.29 -30.29 7.17 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.072 0.463 . . . . 0.0 110.656 -179.295 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.02 HG22 ' HE1' ' A' ' 111' ' ' TYR . 9.0 mt -85.03 -52.72 12.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.412 179.314 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.674 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.39 -56.75 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.298 179.396 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -46.88 -28.15 1.49 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.295 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.542 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.0 OUTLIER -73.46 -25.01 60.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.177 179.73 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 1.02 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -74.04 -35.22 64.32 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 179.576 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.751 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.28 -42.89 18.23 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 179.019 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -61.54 -32.03 72.08 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.014 -1.448 . . . . 0.0 108.957 178.076 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.444 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.449 -0.483 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.752 178.675 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.662 ' HA ' HG21 ' A' ' 103' ' ' THR . 1.6 t-160 . . . . . 0 CA--C 1.528 0.099 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.462 ' C ' HD11 ' A' ' 100' ' ' ILE . 0.5 OUTLIER -137.99 161.7 36.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.023 0.44 . . . . 0.0 110.875 179.881 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.531 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 171.54 138.76 2.61 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 111.168 -0.773 . . . . 0.0 111.168 -179.612 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.556 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -84.13 140.95 31.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.075 0.464 . . . . 0.0 112.228 -178.732 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.563 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -149.65 171.25 16.97 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.254 -179.309 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.661 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.93 125.12 56.12 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.707 -179.667 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.476 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.5 t80 -125.28 109.49 12.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.912 0.387 . . . . 0.0 111.12 178.452 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 47.1 mt-10 67.51 49.15 1.03 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.9 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 mmmt 71.76 -4.88 1.8 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.225 -0.443 . . . . 0.0 112.17 179.249 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.462 ' O ' HG23 ' A' ' 8' ' ' ILE . 17.1 t -100.91 148.72 6.75 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.458 0 CA-C-O 121.087 0.47 . . . . 0.0 110.526 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.459 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -111.6 113.09 25.27 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.898 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.877 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.4 -133.29 3.47 Favored Glycine 0 N--CA 1.445 -0.713 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.03 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.877 HD13 ' O ' ' A' ' 14' ' ' GLY . 19.4 mm -136.31 135.9 49.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 120.648 0.261 . . . . 0.0 111.297 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.879 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.81 140.8 18.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 106.452 -1.684 . . . . 0.0 106.452 176.637 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.447 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.32 117.17 5.49 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 121.687 0.756 . . . . 0.0 111.244 -178.803 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.825 HD13 ' HB ' ' A' ' 103' ' ' THR . 7.5 mt -81.73 143.22 12.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 114.481 -1.236 . . . . 0.0 112.578 -178.275 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -126.17 111.71 14.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.245 179.23 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.451 ' HG2' ' NE2' ' A' ' 3' ' ' HIS . 0.0 OUTLIER -100.41 -2.58 33.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.261 -179.541 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.87 -4.87 40.48 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.985 0.421 . . . . 0.0 110.241 178.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.437 HG21 ' CG ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -92.29 -159.7 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.176 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.427 179.784 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.428 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 33.4 p -179.27 99.29 0.2 Allowed Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.545 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.451 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 10.6 Cg_exo -71.04 164.97 81.54 Favored 'Cis proline' 0 C--N 1.347 0.471 0 C-N-CA 123.697 -1.376 . . . . 0.0 112.625 0.322 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.439 ' CB ' HG21 ' A' ' 107' ' ' ILE . . . -56.14 176.15 0.08 Allowed 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.562 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.518 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.84 139.6 6.41 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.017 178.97 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.777 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.4 OUTLIER -107.71 146.37 32.19 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 178.722 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.69 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.0 OUTLIER -128.49 112.93 14.87 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -178.201 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.535 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 78.5 t90 -92.13 110.63 22.01 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.04 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.488 ' O ' ' N ' ' A' ' 15' ' ' ILE . 18.9 ttm180 -110.6 131.55 54.95 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.67 0.271 . . . . 0.0 110.934 -179.802 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.3 m -49.97 159.33 0.42 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.489 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.415 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 42.5 m -74.91 -37.1 62.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.358 0.599 . . . . 0.0 109.737 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -84.91 -15.96 42.76 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.184 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.94 34.28 11.23 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.311 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -85.26 -26.22 26.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.722 0.296 . . . . 0.0 111.386 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.43 164.79 3.18 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.24 0.543 . . . . 0.0 111.546 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.69 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.35 146.89 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.051 -178.822 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 30.9 m-70 -121.04 120.33 35.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.614 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.62 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.42 138.8 33.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.691 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.572 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -125.32 140.43 48.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.458 -179.623 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.538 ' CG1' HG23 ' A' ' 44' ' ' THR . 44.1 t -104.08 94.42 3.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 177.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.665 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.6 OUTLIER -42.1 -24.8 0.05 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.088 -0.506 . . . . 0.0 112.031 -178.864 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.451 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 1.2 t -76.02 -48.62 20.28 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.361 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.538 HG23 ' CG1' ' A' ' 41' ' ' VAL . 30.0 p -64.58 -27.88 69.25 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 178.485 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.86 HD12 ' HB3' ' A' ' 62' ' ' LEU . 44.8 mm -56.54 109.12 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.536 178.693 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 63' ' ' ILE . 24.3 t0 -53.22 -31.84 45.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.829 0.347 . . . . 0.0 110.933 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.414 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 11.2 pttt -172.66 164.65 5.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.836 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 1.054 HD11 HD13 ' A' ' 104' ' ' LEU . 8.2 tp -108.88 116.36 31.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.611 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -110.04 144.86 38.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.638 0.256 . . . . 0.0 110.542 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.656 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -156.98 145.74 19.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.634 0.254 . . . . 0.0 111.082 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.533 HG23 ' HB2' ' A' ' 59' ' ' MET . 54.5 p . . . . . 0 C--N 1.332 -0.193 0 CA-C-O 120.724 0.297 . . . . 0.0 110.978 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.2 mpp? . . . . . 0 C--O 1.23 0.057 0 CA-C-O 120.819 0.342 . . . . 0.0 110.771 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.533 ' HB2' HG23 ' A' ' 51' ' ' THR . 29.8 mtm -149.5 142.31 24.67 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.637 -179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.656 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 18.7 mt -119.47 143.37 47.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.065 178.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.421 ' HG3' ' O ' ' A' ' 87' ' ' HIS . 24.3 ttp180 -143.59 150.58 39.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.968 0.413 . . . . 0.0 111.699 -179.049 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.86 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.7 mp -128.02 115.18 18.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.776 178.631 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.458 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 6.4 mm -76.53 156.44 5.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.661 0.267 . . . . 0.0 110.89 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.356 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.484 -179.799 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.509 HG22 ' N ' ' A' ' 67' ' ' ASP . 14.6 p . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.962 0.411 . . . . 0.0 111.313 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.509 ' N ' HG22 ' A' ' 66' ' ' VAL . 21.0 p-10 -108.01 55.62 0.64 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.877 -0.602 . . . . 0.0 109.857 179.173 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.95 41.45 1.0 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.371 -179.451 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 32.8 t -110.52 -19.68 12.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.082 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.9 mmtp -81.54 -55.43 4.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.857 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.477 ' HA ' HG23 ' A' ' 81' ' ' VAL . 0.6 OUTLIER 61.34 93.07 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.899 179.974 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -95.37 -173.71 2.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.918 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.432 ' CA ' HG23 ' A' ' 80' ' ' VAL . 0.0 OUTLIER -128.0 -176.63 3.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.712 179.779 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -106.09 -39.58 5.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.988 0.423 . . . . 0.0 110.81 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 165.14 -30.14 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.821 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -108.56 40.11 1.85 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.032 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 69.35 11.4 64.53 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.47 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.408 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 0.6 OUTLIER -56.6 -165.69 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.108 0 CA-C-O 120.692 0.282 . . . . 0.0 110.84 179.893 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -135.54 120.88 19.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.858 0.361 . . . . 0.0 111.016 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.432 HG23 ' CA ' ' A' ' 73' ' ' LYS . 63.0 t -91.99 -63.52 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.494 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.661 ' O ' HG12 ' A' ' 81' ' ' VAL . 0.9 OUTLIER 40.7 94.21 0.05 OUTLIER Pre-proline 0 CA--C 1.535 0.38 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.093 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -50.66 134.11 39.8 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.515 2.144 . . . . 0.0 112.478 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.73 161.53 73.93 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.915 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo . . . . . 0 N--CA 1.461 -0.426 0 C-N-CA 123.563 2.842 . . . . 0.0 112.278 -179.182 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.701 0.286 . . . . 0.0 110.761 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.487 ' CE1' HG22 ' A' ' 40' ' ' VAL . 2.5 m80 -100.73 111.34 23.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.834 0.349 . . . . 0.0 110.262 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.3 142.14 27.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.149 0.5 . . . . 0.0 111.406 -179.338 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.879 ' CD2' HD11 ' A' ' 16' ' ' ILE . 61.0 m-85 -139.86 116.83 11.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.574 179.792 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -91.22 115.16 27.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.926 0.393 . . . . 0.0 110.596 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.458 ' CE2' HG13 ' A' ' 100' ' ' ILE . 8.7 m-85 -91.05 136.85 32.8 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.533 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 20.2 m-20 -100.24 29.52 4.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.424 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.46 ' CB ' HG23 ' A' ' 96' ' ' VAL . 5.2 m-20 -175.58 116.74 0.15 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.541 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.481 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -57.2 -16.48 8.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.957 179.803 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.43 -49.75 21.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.852 0.358 . . . . 0.0 110.265 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.46 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -65.82 -41.52 90.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.637 179.26 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.481 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -66.67 -37.94 85.8 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.955 179.472 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.429 ' N ' ' HG3' ' A' ' 97' ' ' MET . 20.1 m-20 -66.67 -24.64 66.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.112 0.482 . . . . 0.0 109.921 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -81.71 -63.24 1.43 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.358 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.761 HG22 HD11 ' A' ' 104' ' ' LEU . 14.3 mm -53.48 -53.85 22.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.579 179.485 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.454 ' HA ' HD12 ' A' ' 104' ' ' LEU . 0.2 OUTLIER -51.4 -29.55 16.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.924 179.908 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 5.1 mtm -83.08 -48.11 10.94 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.132 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.825 ' HB ' HD13 ' A' ' 18' ' ' ILE . 0.2 OUTLIER -53.38 -58.11 8.27 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.109 179.554 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 1.054 HD13 HD11 ' A' ' 48' ' ' LEU . 3.9 mt -46.34 -53.34 11.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.192 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -58.33 -45.58 87.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.167 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.438 ' HG2' HG13 ' A' ' 107' ' ' ILE . 0.5 OUTLIER -51.34 -32.95 27.4 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.048 0.452 . . . . 0.0 110.287 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.029 HG22 ' HE1' ' A' ' 111' ' ' TYR . 10.3 mt -85.82 -52.11 12.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.51 179.217 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.695 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.14 -57.22 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.56 179.623 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.25 -27.05 1.37 Allowed 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.597 -0.728 . . . . 0.0 111.067 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.439 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 27.1 mtt180 -73.25 -25.08 60.57 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.359 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 1.029 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -75.68 -34.15 60.42 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.734 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.762 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.66 -43.35 17.02 Favored 'General case' 0 CA--C 1.507 -0.7 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.945 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -61.44 -32.07 72.03 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 113.858 -1.519 . . . . 0.0 108.987 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.439 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.454 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.666 178.729 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 29.6 m170 . . . . . 0 CA--C 1.529 0.148 0 N-CA-C 111.456 0.169 . . . . 0.0 111.456 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.558 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 2.6 p -154.0 150.41 28.24 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.303 0.573 . . . . 0.0 111.335 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.471 ' O ' ' HB ' ' A' ' 16' ' ' ILE . . . 178.64 138.68 3.25 Favored Glycine 0 N--CA 1.448 -0.511 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 -179.677 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.58 145.74 29.55 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.4 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.556 ' C ' HD13 ' A' ' 8' ' ' ILE . . . -154.41 171.38 19.43 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.337 -179.11 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.666 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.63 122.58 55.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.82 -179.466 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.454 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.6 t80 -123.1 109.35 13.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.949 0.404 . . . . 0.0 111.237 178.514 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.426 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 24.8 mt-10 68.11 49.07 0.89 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.812 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 13.1 mttm 71.5 -3.82 2.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.237 -0.438 . . . . 0.0 112.137 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.436 ' O ' HG23 ' A' ' 8' ' ' ILE . 18.2 t -101.68 148.5 7.37 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.55 0 CA-C-O 121.123 0.487 . . . . 0.0 110.587 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.456 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -110.7 112.89 25.08 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.806 179.865 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.888 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.5 -135.12 3.69 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.006 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.888 HD13 ' O ' ' A' ' 14' ' ' GLY . 18.2 mm -135.87 134.93 51.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.543 0 CA-C-O 120.608 0.242 . . . . 0.0 111.435 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.897 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.43 141.71 16.85 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.649 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 176.388 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.558 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -150.87 118.62 6.15 Favored 'General case' 0 C--N 1.31 -1.117 0 C-N-CA 119.64 -0.824 . . . . 0.0 111.542 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.764 HD13 ' HB ' ' A' ' 103' ' ' THR . 11.0 mt -86.71 142.02 13.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 114.697 -1.138 . . . . 0.0 111.887 -178.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.626 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.7 OUTLIER -118.97 93.1 3.98 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.316 179.452 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -80.79 0.02 36.64 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.33 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -82.66 0.6 42.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.624 0.249 . . . . 0.0 111.304 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.626 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.04 -162.76 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.807 0.337 . . . . 0.0 110.832 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.4 t -175.97 101.75 0.25 Allowed Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.339 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.446 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 11.0 Cg_exo -69.95 161.46 86.7 Favored 'Cis proline' 0 C--N 1.347 0.483 0 C-N-CA 123.597 -1.418 . . . . 0.0 112.619 0.282 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.647 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -54.76 178.49 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.3 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.457 ' CG ' HG21 ' A' ' 22' ' ' VAL . 2.5 pp20? -163.67 133.92 4.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.331 179.415 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.853 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.92 144.5 35.09 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 178.706 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.722 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.3 m -131.48 113.64 13.93 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.702 0.631 . . . . 0.0 112.702 -178.213 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.553 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 78.8 t90 -92.06 110.43 21.8 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 178.263 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.462 ' O ' ' N ' ' A' ' 15' ' ' ILE . 22.4 ttt-85 -110.2 131.11 55.35 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.674 0.274 . . . . 0.0 110.822 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.1 m -49.91 158.22 0.53 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.626 0.25 . . . . 0.0 110.493 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.416 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 44.7 m -74.1 -37.0 64.29 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.421 0.629 . . . . 0.0 109.751 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.48 -16.25 43.14 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.021 -0.991 . . . . 0.0 111.087 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.66 34.42 11.59 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.302 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -85.88 -25.76 26.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.688 0.28 . . . . 0.0 111.425 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.68 164.18 2.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.314 0.578 . . . . 0.0 111.35 -179.779 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.722 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.65 147.91 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.048 -178.767 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 50.0 m-70 -122.09 119.19 30.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.734 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.428 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.49 141.2 30.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.831 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.552 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -127.5 141.01 47.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.449 -179.511 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.449 ' O ' HG12 ' A' ' 45' ' ' ILE . 21.1 t -103.89 93.54 2.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 178.138 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.713 HD11 HD22 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -41.23 -25.12 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.09 -0.504 . . . . 0.0 112.11 -178.827 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.446 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER -74.66 -49.79 20.11 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 179.175 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.408 HG23 ' HB ' ' A' ' 41' ' ' VAL . 30.0 p -64.66 -27.51 68.98 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.58 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.9 HD12 ' HB3' ' A' ' 62' ' ' LEU . 34.5 mm -56.6 109.24 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.661 179.044 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.414 ' N ' ' O ' ' A' ' 63' ' ' ILE . 12.6 t70 -51.76 -34.01 37.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.137 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.43 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 0.7 OUTLIER -169.64 165.41 10.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.089 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.763 HD11 HD13 ' A' ' 104' ' ' LEU . 45.1 tp -108.77 118.3 36.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.499 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.412 ' HB3' ' HB3' ' A' ' 61' ' ' ARG . 4.4 tt0 -115.76 147.22 41.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.602 0.239 . . . . 0.0 110.512 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.664 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.14 137.2 12.62 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.148 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.422 HG23 ' HB2' ' A' ' 59' ' ' MET . 42.8 p . . . . . 0 CA--C 1.53 0.207 0 CA-C-O 120.58 0.229 . . . . 0.0 110.865 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.427 ' HB2' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.645 0.26 . . . . 0.0 110.632 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.435 ' O ' HD23 ' A' ' 60' ' ' LEU . 35.2 mtm -149.65 155.51 40.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.132 0.491 . . . . 0.0 111.983 -179.365 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.664 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 28.6 mt -123.38 149.76 44.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.165 178.419 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.412 ' HB3' ' HB3' ' A' ' 49' ' ' GLN . 28.4 ttp180 -146.18 150.87 36.67 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.916 0.389 . . . . 0.0 112.029 -179.131 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.9 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.3 mp -128.34 116.87 20.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.175 178.545 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.8 HD12 ' HD3' ' A' ' 86' ' ' ARG . 22.6 mm -76.64 156.47 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.683 0.277 . . . . 0.0 111.011 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.425 ' N ' HG22 ' A' ' 63' ' ' ILE . . . . . . . . 0 N--CA 1.451 -0.354 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.352 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.435 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 10.2 p . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.595 0.236 . . . . 0.0 110.613 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.432 ' N ' HG22 ' A' ' 66' ' ' VAL . 10.9 t0 -128.02 35.75 4.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.757 0.313 . . . . 0.0 111.411 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 40.31 31.87 0.11 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.522 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.8 m -95.32 -26.61 15.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.877 0.37 . . . . 0.0 110.986 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.09 -77.74 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.751 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.6 mtpm? 56.15 89.95 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.002 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.99 123.15 48.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.823 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -75.38 159.93 30.85 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.851 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -97.32 -64.04 1.08 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.085 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -178.05 -34.71 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.172 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -92.0 40.8 1.05 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.115 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 59.43 18.01 42.02 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.777 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -90.97 118.21 30.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.746 0.307 . . . . 0.0 110.836 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -87.57 115.8 25.25 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.822 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 17.4 t -111.79 139.25 37.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.638 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.419 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 35.9 t -96.34 90.12 0.68 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.462 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 81' ' ' VAL . 1.4 Cg_endo -45.44 151.0 1.12 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.861 2.374 . . . . 0.0 112.759 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 18.1 mttt -46.47 166.34 0.17 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.543 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.435 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 7.8 Cg_exo . . . . . 0 N--CA 1.464 -0.22 0 C-N-CA 123.72 2.947 . . . . 0.0 112.294 -179.104 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.8 ' HD3' HD12 ' A' ' 63' ' ' ILE . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.676 0.274 . . . . 0.0 110.776 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.41 ' CE1' HG22 ' A' ' 40' ' ' VAL . 3.3 m80 -102.84 111.26 23.5 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 179.485 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 2.8 ttt -109.34 131.5 55.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.269 -179.388 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.897 ' CD2' HD11 ' A' ' 16' ' ' ILE . 0.3 OUTLIER -131.05 117.18 18.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.376 179.684 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.13 114.32 21.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.231 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.508 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 7.8 m-85 -91.17 136.36 33.14 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.945 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 59.3 m-20 -93.52 43.46 1.12 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.789 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.602 ' HB3' HG23 ' A' ' 96' ' ' VAL . 1.8 m-20 175.2 113.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.229 -179.814 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.438 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -56.16 -17.41 7.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.079 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.95 -45.66 56.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.1 0.476 . . . . 0.0 110.171 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.602 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -65.32 -49.57 77.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.396 179.087 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.448 ' O ' HD11 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -62.62 -37.09 84.92 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.727 179.731 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.408 ' HA ' ' HG2' ' A' ' 101' ' ' LYS . 69.1 m-20 -73.35 -31.08 63.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.029 0.442 . . . . 0.0 110.445 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -80.25 -27.92 38.57 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.291 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.536 HG23 HD11 ' A' ' 18' ' ' ILE . 1.6 mm -85.13 -52.82 11.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.699 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.408 ' HG2' ' HA ' ' A' ' 98' ' ' ASP . 8.6 ptpt -48.59 -28.97 3.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.796 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.415 ' HG2' ' N ' ' A' ' 103' ' ' THR . 0.8 OUTLIER -78.11 -39.81 40.19 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.081 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.764 ' HB ' HD13 ' A' ' 18' ' ' ILE . 0.2 OUTLIER -59.05 -61.03 2.94 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.501 179.551 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.763 HD13 HD11 ' A' ' 48' ' ' LEU . 7.3 mt -46.76 -56.09 6.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.715 179.397 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.67 -45.51 77.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.054 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -51.92 -35.36 45.42 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-O 121.168 0.508 . . . . 0.0 110.57 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.042 HG22 ' HE1' ' A' ' 111' ' ' TYR . 11.3 mt -85.75 -51.08 13.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.669 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.678 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -42.25 -57.03 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.585 179.654 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.15 -28.47 1.83 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.261 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.521 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 3.1 mtt180 -72.44 -24.89 61.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.28 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 1.042 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -74.57 -36.11 63.05 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 179.77 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.752 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.46 -43.45 17.24 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 107.875 -1.158 . . . . 0.0 107.875 179.039 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -60.96 -30.35 70.19 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 113.93 -1.486 . . . . 0.0 108.922 178.231 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.456 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.438 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.594 178.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.427 ' CE1' ' HB2' ' A' ' 20' ' ' GLU . 30.5 m170 . . . . . 0 CA--C 1.528 0.123 0 N-CA-C 111.5 0.185 . . . . 0.0 111.5 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.56 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 2.7 p -151.85 154.69 36.66 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.222 0.534 . . . . 0.0 111.242 179.553 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.515 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 172.37 137.98 2.47 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 -179.522 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.571 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.94 144.34 30.08 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -178.595 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.673 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . . . -155.38 171.38 19.97 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.062 -179.312 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.711 HD12 ' HA ' ' A' ' 13' ' ' SER . 4.8 mm -102.16 128.82 54.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.459 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.8 t80 -127.29 109.38 11.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.0 0.429 . . . . 0.0 110.889 177.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 22.4 mt-10 69.0 50.38 0.59 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.747 179.242 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.6 mttt 69.77 -4.76 1.36 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.134 -0.484 . . . . 0.0 112.084 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.531 ' O ' HG23 ' A' ' 8' ' ' ILE . 13.8 t -101.55 144.24 13.39 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.476 0 CA-C-O 121.201 0.524 . . . . 0.0 110.745 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.711 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -99.25 113.83 26.31 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.898 179.957 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -136.04 -168.1 11.42 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.84 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.571 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 14.0 mm -107.59 136.21 43.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.76 0.314 . . . . 0.0 111.285 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.912 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.73 141.37 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 176.808 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.56 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.52 117.25 5.44 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 119.634 -0.827 . . . . 0.0 111.469 -178.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.878 HD11 HG23 ' A' ' 100' ' ' ILE . 5.3 mt -85.63 142.75 12.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.629 -178.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.64 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.1 t-20 -119.45 96.37 5.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.609 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.558 ' HG3' HD11 ' A' ' 107' ' ' ILE . 1.5 mt-10 -79.86 -0.86 36.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.261 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -81.86 -0.06 41.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.612 0.244 . . . . 0.0 111.387 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.64 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -100.97 -162.45 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.82 0.343 . . . . 0.0 110.74 179.883 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 53.8 p -176.51 100.23 0.24 Allowed Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.37 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.435 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 13.4 Cg_exo -68.91 165.82 73.18 Favored 'Cis proline' 0 C--N 1.346 0.409 0 C-N-CA 123.626 -1.406 . . . . 0.0 112.723 0.36 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.686 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -56.79 178.03 0.07 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.153 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.431 ' HG2' ' HA ' ' A' ' 41' ' ' VAL . 9.1 mt-10 -163.4 133.49 4.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.429 179.458 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.808 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -108.11 140.78 40.8 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.58 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.511 HG22 ' CG2' ' A' ' 37' ' ' VAL . 8.2 m -126.08 112.86 16.34 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -178.314 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.511 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 73.8 t90 -91.98 110.4 21.76 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.522 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 15' ' ' ILE . 15.3 ttt180 -107.35 131.03 54.69 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.668 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 27.1 t -49.88 156.21 0.77 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.718 0.294 . . . . 0.0 110.654 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 21.4 m -73.77 -34.35 64.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.223 0.535 . . . . 0.0 109.832 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -87.36 -16.58 34.58 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.187 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.35 33.72 11.39 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.306 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -87.61 -25.83 23.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.694 0.283 . . . . 0.0 111.451 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.53 165.1 3.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.308 0.575 . . . . 0.0 111.537 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.511 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.5 OUTLIER -142.42 155.43 18.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.934 -178.853 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -130.03 119.33 22.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.709 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.48 138.9 33.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.599 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.553 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -126.16 141.12 46.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.5 -179.5 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.527 ' CG1' HG23 ' A' ' 44' ' ' THR . 41.7 t -103.87 94.39 3.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.057 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.749 HD11 HD22 ' A' ' 104' ' ' LEU . 0.5 OUTLIER -41.94 -25.49 0.06 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.836 -179.085 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.435 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -74.88 -49.2 21.24 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 179.236 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.527 HG23 ' CG1' ' A' ' 41' ' ' VAL . 30.3 p -64.7 -27.54 68.98 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.451 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.861 HD12 ' HB3' ' A' ' 62' ' ' LEU . 39.9 mm -56.32 104.44 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.357 178.821 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' A' ' 63' ' ' ILE . 31.5 t70 -47.98 -31.73 5.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.841 0.353 . . . . 0.0 111.297 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.426 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 1.1 pttt -172.54 162.13 5.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.792 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.979 HD11 HD13 ' A' ' 104' ' ' LEU . 10.6 tp -108.91 122.42 47.18 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.757 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.476 ' OE1' HD11 ' A' ' 63' ' ' ILE . 11.6 mt-30 -119.65 146.31 45.68 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.567 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.683 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.08 138.86 14.21 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.673 -0.239 . . . . 0.0 111.101 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 37.1 p . . . . . 0 C--N 1.332 -0.167 0 CA-C-O 120.643 0.259 . . . . 0.0 110.894 -179.903 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.419 ' HG2' ' N ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.674 0.273 . . . . 0.0 110.75 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 25.1 mtm -149.79 138.38 20.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.073 0.463 . . . . 0.0 112.012 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.683 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 22.3 mt -118.06 145.01 45.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.712 178.272 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.44 ' HG3' ' HA ' ' A' ' 88' ' ' MET . 10.5 ttm-85 -143.43 147.38 34.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.005 0.431 . . . . 0.0 112.131 -179.004 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.861 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.6 mp -128.3 115.05 17.7 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.662 178.436 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.476 HD11 ' OE1' ' A' ' 49' ' ' GLN . 6.8 mm -76.76 156.19 5.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 C-N-CA 121.02 -0.272 . . . . 0.0 111.016 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.242 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.551 -179.782 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.508 HG22 ' N ' ' A' ' 67' ' ' ASP . 15.0 p . . . . . 0 N--CA 1.456 -0.148 0 CA-C-O 121.047 0.451 . . . . 0.0 111.431 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.508 ' N ' HG22 ' A' ' 66' ' ' VAL . 0.5 OUTLIER -109.19 57.22 0.61 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.82 179.076 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -88.25 33.67 0.74 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.555 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 67.8 p -81.88 -19.1 41.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.793 0.33 . . . . 0.0 111.067 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.3 mmtp -79.82 -78.33 0.16 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.855 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.697 ' HG2' HG23 ' A' ' 81' ' ' VAL . 6.2 mttt 58.89 91.84 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.765 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.21 -178.32 7.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.197 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.6 mmtt -82.43 -178.93 7.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.762 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.447 ' O ' ' ND2' ' A' ' 75' ' ' ASN . 1.0 OUTLIER -113.38 -37.34 4.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.032 0.444 . . . . 0.0 111.039 -179.99 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ASN . . . . . 0.447 ' ND2' ' O ' ' A' ' 74' ' ' ASP . 0.9 OUTLIER 168.88 -32.3 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.019 179.841 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -105.68 38.56 1.96 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.926 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.26 16.31 57.84 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.651 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 36.2 m-20 -72.9 -166.19 0.28 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.705 0.288 . . . . 0.0 110.742 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -139.19 108.03 5.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.876 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.401 ' O ' ' C ' ' A' ' 81' ' ' VAL . 59.2 t -77.88 -66.05 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.283 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.697 HG23 ' HG2' ' A' ' 71' ' ' LYS . 4.7 p 33.22 83.58 0.2 Allowed Pre-proline 0 CA--C 1.531 0.24 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.674 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -41.32 124.79 2.4 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.947 2.431 . . . . 0.0 112.869 -179.465 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 10.3 mtmt -78.05 162.33 67.58 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.051 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo . . . . . 0 N--CA 1.46 -0.476 0 C-N-CA 123.629 2.886 . . . . 0.0 112.388 -179.065 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.47 ' HB3' ' HA ' ' A' ' 63' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.527 0.085 0 CA-C-O 120.673 0.273 . . . . 0.0 110.747 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.522 ' CE1' HG22 ' A' ' 40' ' ' VAL . 7.4 m80 -96.72 111.66 23.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.335 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.44 ' HA ' ' HG3' ' A' ' 61' ' ' ARG . 6.6 ttt -94.13 124.63 38.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.095 0.474 . . . . 0.0 111.282 -179.54 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.912 ' CD1' HD11 ' A' ' 16' ' ' ILE . 89.8 m-85 -122.93 116.85 24.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.551 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.523 ' HB3' HG12 ' A' ' 8' ' ' ILE . 0.3 OUTLIER -92.2 114.66 27.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.837 0.351 . . . . 0.0 110.849 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.673 ' CE1' ' HB2' ' A' ' 7' ' ' ALA . 31.1 m-85 -97.34 143.54 27.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.111 0.481 . . . . 0.0 111.399 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 20.1 m-20 -106.57 38.29 2.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.777 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.521 ' CB ' HG23 ' A' ' 96' ' ' VAL . 5.3 m-20 -179.87 122.92 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.991 -179.689 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.459 ' HA ' ' HG3' ' A' ' 97' ' ' MET . 20.0 tpt85 -65.83 -14.41 61.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.474 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.91 -43.07 56.28 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 121.211 0.529 . . . . 0.0 110.023 179.452 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.521 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -62.6 -51.74 68.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.145 179.059 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.459 ' HG3' ' HA ' ' A' ' 94' ' ' ARG . 0.9 OUTLIER -51.87 -44.87 63.87 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.392 178.656 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.446 ' O ' ' HB2' ' A' ' 102' ' ' MET . 1.2 m-20 -53.41 -29.44 35.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.975 179.03 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.5 m-20 -82.48 -53.83 5.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.125 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.878 HG23 HD11 ' A' ' 18' ' ' ILE . 11.0 mm -70.88 -60.46 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.963 -179.318 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.452 ' HA ' HD12 ' A' ' 104' ' ' LEU . 10.6 ttmt -48.6 -35.38 13.45 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.516 -179.152 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.446 ' HB2' ' O ' ' A' ' 98' ' ' ASP . 33.3 mtm -83.45 -29.62 27.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.715 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.865 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -76.36 -45.35 32.41 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.485 -179.648 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.979 HD13 HD11 ' A' ' 48' ' ' LEU . 5.4 mt -53.53 -53.86 45.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.038 0.447 . . . . 0.0 109.923 179.32 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -56.7 -47.43 79.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.146 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -47.28 -36.01 8.59 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 121.26 0.552 . . . . 0.0 110.37 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.039 HG22 ' HE1' ' A' ' 111' ' ' TYR . 12.3 mt -85.75 -51.81 12.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.143 179.094 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.683 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.4 -59.19 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.34 179.129 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -46.76 -27.38 1.18 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.228 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.459 ' HB3' ' O ' ' A' ' 107' ' ' ILE . 0.0 OUTLIER -73.97 -24.79 59.67 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.88 179.964 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 1.039 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -73.98 -37.08 64.57 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.265 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.726 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -80.23 -43.62 21.12 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 179.14 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -61.4 -30.78 70.77 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.886 -1.507 . . . . 0.0 109.051 178.054 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.452 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.393 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.631 178.745 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 25.6 m170 . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.617 0.246 . . . . 0.0 111.11 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.533 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 0.5 OUTLIER -160.09 160.57 33.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.206 0.526 . . . . 0.0 111.282 179.747 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.535 ' HA3' HG12 ' A' ' 96' ' ' VAL . . . 166.73 135.73 1.91 Allowed Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -179.502 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.577 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -80.32 148.46 30.68 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.521 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.568 ' C ' HD13 ' A' ' 8' ' ' ILE . . . -154.52 171.23 19.75 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.462 -179.045 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.673 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -103.0 120.67 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.582 -179.644 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.477 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 4.5 t80 -119.6 106.67 12.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.899 0.38 . . . . 0.0 111.361 178.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 16.6 mt-10 67.71 49.42 0.96 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.928 179.123 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.3 mtmt 72.64 -3.56 2.33 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 179.169 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.451 ' O ' HG23 ' A' ' 8' ' ' ILE . 22.5 t -102.08 151.17 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 CA-C-O 121.066 0.46 . . . . 0.0 110.483 179.61 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.425 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.8 OUTLIER -107.16 114.08 27.92 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.843 179.982 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.458 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -133.55 -158.55 8.72 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.061 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.577 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 17.0 mm -120.21 132.23 70.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.77 0.319 . . . . 0.0 111.38 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.88 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -101.19 114.87 41.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 177.843 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.533 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -124.03 115.79 21.76 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.539 0.685 . . . . 0.0 110.784 -179.248 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.919 HD13 HG22 ' A' ' 103' ' ' THR . 7.8 mt -82.47 142.75 13.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 114.709 -1.132 . . . . 0.0 112.031 -178.384 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.578 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.5 t-20 -118.45 93.12 4.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.201 179.294 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.07 0.5 44.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.414 -179.689 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -83.36 1.46 41.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.35 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.578 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -100.86 -162.46 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.864 0.364 . . . . 0.0 110.972 -179.828 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 94.1 p -176.15 100.36 0.25 Allowed Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.324 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.411 ' HG2' ' CB ' ' A' ' 43' ' ' SER . 14.6 Cg_exo -66.81 165.06 67.43 Favored 'Cis proline' 0 C--N 1.347 0.475 0 C-N-CA 123.644 -1.398 . . . . 0.0 112.474 0.473 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.54 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -57.34 -171.83 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.663 179.482 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -163.36 141.75 7.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.443 0.64 . . . . 0.0 112.249 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.707 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 3.1 tt -108.17 149.05 29.04 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.984 -1.007 . . . . 0.0 108.574 178.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.47 HG23 HG23 ' A' ' 39' ' ' THR . 1.3 m -146.9 104.19 3.69 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -178.788 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.495 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 82.2 t90 -92.13 110.59 21.97 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.683 178.341 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.469 ' O ' ' N ' ' A' ' 15' ' ' ILE . 2.3 ttt180 -108.75 130.33 55.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.852 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.8 m -49.96 154.44 1.11 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.696 0.284 . . . . 0.0 110.607 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 21.6 m -72.94 -34.42 66.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.354 0.597 . . . . 0.0 109.703 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -87.03 -16.9 34.27 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.123 179.612 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.01 34.08 11.34 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.338 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 57.7 m-20 -89.54 -22.63 22.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.644 0.259 . . . . 0.0 111.542 -179.626 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.96 162.66 2.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.38 0.61 . . . . 0.0 111.434 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.495 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.61 144.95 20.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.025 -178.871 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.427 ' CG ' ' CZ ' ' A' ' 9' ' ' PHE . 20.6 m-70 -118.92 120.2 36.58 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.613 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.47 HG23 HG23 ' A' ' 28' ' ' THR . 0.3 OUTLIER -96.51 144.43 26.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.724 -179.934 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.707 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.2 t -128.75 138.76 53.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.559 -179.401 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.428 ' HB ' HG23 ' A' ' 44' ' ' THR . 21.7 t -103.86 94.3 3.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 177.568 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.852 HD11 HD23 ' A' ' 104' ' ' LEU . 0.9 OUTLIER -42.29 -22.88 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.226 -0.443 . . . . 0.0 112.171 -178.744 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.411 ' CB ' ' HG2' ' A' ' 24' ' ' PRO . 0.4 OUTLIER -76.03 -49.93 16.2 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.858 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.428 HG23 ' HB ' ' A' ' 41' ' ' VAL . 29.6 p -65.15 -28.01 69.12 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.369 178.576 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.847 HD12 ' HB3' ' A' ' 62' ' ' LEU . 44.5 mm -56.46 109.92 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.591 179.082 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -53.76 -37.33 63.29 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.847 0.356 . . . . 0.0 110.835 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.417 ' HG3' HG12 ' A' ' 63' ' ' ILE . 1.3 pttt -167.37 168.57 13.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.834 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.778 HD11 HD13 ' A' ' 104' ' ' LEU . 11.6 tp -109.01 115.62 30.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.706 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.481 ' O ' ' N ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -106.7 141.93 37.16 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 179.728 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.678 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.01 139.2 14.61 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.664 0.269 . . . . 0.0 111.308 -179.712 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.461 HG23 ' HB2' ' A' ' 59' ' ' MET . 71.6 p . . . . . 0 C--N 1.331 -0.203 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.102 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.422 ' HE2' ' CB ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.712 0.291 . . . . 0.0 110.85 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.461 ' HB2' HG23 ' A' ' 51' ' ' THR . 35.2 mtm -149.78 151.66 33.94 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.005 0.431 . . . . 0.0 111.868 -179.446 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.678 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 33.6 mt -123.95 152.46 42.46 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.3 178.544 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.481 ' N ' ' O ' ' A' ' 49' ' ' GLN . 24.0 ttm180 -151.9 151.56 31.42 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -179.357 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.861 HD21 HD22 ' A' ' 104' ' ' LEU . 1.4 mp -126.65 117.84 23.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.856 178.313 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.871 HD12 ' HD3' ' A' ' 86' ' ' ARG . 10.6 mm -76.62 156.52 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.765 0.317 . . . . 0.0 111.055 -179.571 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.293 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.434 179.979 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.514 HG22 ' N ' ' A' ' 67' ' ' ASP . 13.9 p . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.836 0.35 . . . . 0.0 111.097 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.514 ' N ' HG22 ' A' ' 66' ' ' VAL . 9.6 m-20 -114.14 63.44 0.66 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.799 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -63.22 -17.73 62.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.294 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.9 t -58.4 -21.9 52.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.198 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.7 mmmp? -75.46 -68.44 0.56 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.907 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.4 mttt 55.89 89.59 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.966 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.01 -179.93 4.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.908 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 10.7 mttt -133.76 -168.44 2.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.779 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -135.04 -175.39 3.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.858 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -57.58 -22.09 42.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.316 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 -110.0 33.72 4.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.953 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.14 24.52 44.12 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.474 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -62.46 -169.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.848 0.356 . . . . 0.0 110.899 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -135.65 114.99 12.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.638 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 96.3 t -86.89 -60.6 2.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.39 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.446 ' O ' HG13 ' A' ' 81' ' ' VAL . 4.2 p 34.98 88.29 0.1 OUTLIER Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.854 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.42 ' O ' HG21 ' A' ' 66' ' ' VAL . 92.6 Cg_exo -42.12 140.35 2.3 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.94 2.427 . . . . 0.0 112.775 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 46.4 mmtt -93.56 163.87 22.99 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.036 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.449 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.7 Cg_exo . . . . . 0 N--CA 1.461 -0.399 0 C-N-CA 123.602 2.868 . . . . 0.0 112.311 -179.05 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.871 ' HD3' HD12 ' A' ' 63' ' ' ILE . 55.9 mtt180 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.784 0.326 . . . . 0.0 110.721 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.406 ' CE1' HG22 ' A' ' 40' ' ' VAL . 4.2 m80 -95.39 111.53 23.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.568 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.404 ' CA ' ' HG3' ' A' ' 61' ' ' ARG . 4.5 ttt -109.19 134.56 51.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.066 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.88 ' CD2' HD11 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -135.08 116.81 15.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.77 179.821 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.69 114.42 23.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.871 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.499 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 7.9 m-85 -91.17 140.92 29.35 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.12 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -97.2 38.54 1.24 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.775 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.655 ' HB3' HG23 ' A' ' 96' ' ' VAL . 1.3 m-20 178.41 116.08 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.553 -179.719 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.427 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -57.49 -18.14 17.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.674 179.584 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.17 -42.22 66.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.177 0.513 . . . . 0.0 110.122 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.655 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -66.26 -53.01 40.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.287 179.012 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.427 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -61.2 -36.8 80.88 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.335 179.309 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.452 ' O ' ' HE2' ' A' ' 102' ' ' MET . 26.8 t70 -67.81 -32.56 73.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.097 0.475 . . . . 0.0 110.181 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 68.1 m-20 -81.63 -33.25 31.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.237 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.69 HG22 HD12 ' A' ' 104' ' ' LEU . 3.2 mm -79.39 -60.09 2.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.616 179.568 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.414 ' HG3' ' CB ' ' A' ' 50' ' ' ALA . 5.9 ttmt -49.0 -29.58 5.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.508 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.452 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 31.5 mtm -79.13 -32.02 44.32 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.701 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.919 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -86.51 -22.98 26.08 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 120.983 0.42 . . . . 0.0 110.235 179.623 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.861 HD22 HD21 ' A' ' 62' ' ' LEU . 9.5 mt -73.26 -44.73 58.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.803 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.533 ' HA ' HG13 ' A' ' 108' ' ' ILE . 7.1 pt20 -80.63 -33.1 35.99 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -179.431 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.542 ' HG2' ' HA ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -55.71 -36.34 67.09 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 121.309 0.576 . . . . 0.0 110.122 179.832 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.953 HG22 ' HE1' ' A' ' 111' ' ' TYR . 17.7 mt -75.96 -52.05 18.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.441 179.164 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.549 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -43.86 -55.61 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.267 0.556 . . . . 0.0 111.142 179.09 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -46.85 -28.07 1.44 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.237 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.516 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.3 OUTLIER -73.19 -24.76 60.58 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.146 179.751 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.953 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -74.47 -36.53 63.32 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 179.68 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.743 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -80.6 -43.62 20.25 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 179.211 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -61.45 -31.25 71.19 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 113.887 -1.506 . . . . 0.0 108.955 178.126 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.452 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.454 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.638 178.734 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.404 ' O ' ' N ' ' A' ' 18' ' ' ILE . 18.8 m80 . . . . . 0 CA--C 1.529 0.155 0 CA-C-O 120.522 0.201 . . . . 0.0 111.45 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.586 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 7.5 p -156.48 151.06 25.7 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.222 0.534 . . . . 0.0 111.209 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.495 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 175.2 140.04 3.24 Favored Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 -179.591 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.547 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -83.03 136.09 34.62 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -178.431 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.736 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -144.79 171.24 14.69 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.011 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.656 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.84 127.81 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-O 120.696 0.284 . . . . 0.0 111.664 -179.672 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.477 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.8 t80 -127.81 110.08 12.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.986 0.422 . . . . 0.0 111.288 178.382 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 59.7 mt-10 67.75 47.77 1.12 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.988 179.104 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp 72.29 -5.41 1.78 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.152 179.333 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.478 ' O ' HG23 ' A' ' 8' ' ' ILE . 14.3 t -99.75 148.14 6.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 CA-C-O 121.028 0.442 . . . . 0.0 110.424 179.699 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.442 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -110.47 113.1 25.47 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.023 179.975 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.876 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.67 -134.29 3.57 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.613 -0.722 . . . . 0.0 111.905 179.722 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.876 HD13 ' O ' ' A' ' 14' ' ' GLY . 17.3 mm -135.82 135.86 50.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.584 0.23 . . . . 0.0 111.405 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.937 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.41 140.52 19.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 106.295 -1.742 . . . . 0.0 106.295 176.61 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.586 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.33 119.07 6.12 Favored 'General case' 0 C--N 1.313 -0.997 0 C-N-CA 119.591 -0.844 . . . . 0.0 111.915 -178.341 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.715 HD12 ' HB ' ' A' ' 103' ' ' THR . 7.1 mt -82.59 142.82 13.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 114.57 -1.196 . . . . 0.0 112.142 -178.785 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.616 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -117.32 92.78 3.94 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.822 178.883 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.31 -0.85 42.89 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.348 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -82.7 0.56 42.81 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.132 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.616 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.87 -163.6 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.908 0.385 . . . . 0.0 110.694 179.939 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.426 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 1.8 t -175.08 102.29 0.26 Allowed Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.274 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.426 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 8.5 Cg_exo -70.48 162.41 86.21 Favored 'Cis proline' 0 C--N 1.345 0.38 0 C-N-CA 123.49 -1.462 . . . . 0.0 112.674 0.45 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.549 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -54.3 178.47 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.376 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.559 ' OE1' HG22 ' A' ' 41' ' ' VAL . 20.4 mt-10 -163.12 135.41 5.3 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.011 179.195 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.824 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.79 139.54 42.23 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 178.813 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.706 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.4 m -124.82 113.12 17.5 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -178.254 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.538 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 78.5 t90 -91.97 110.5 21.86 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 178.317 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.471 ' O ' ' N ' ' A' ' 15' ' ' ILE . 49.0 ttt180 -110.5 130.93 55.45 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.955 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.0 m -49.84 158.5 0.48 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.492 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.426 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 45.3 m -74.25 -37.05 63.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.371 0.605 . . . . 0.0 109.71 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -84.64 -16.03 43.36 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.992 -1.004 . . . . 0.0 111.114 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.51 34.5 11.79 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.315 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -85.51 -25.92 26.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.753 0.311 . . . . 0.0 111.408 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.5 164.22 3.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.352 0.596 . . . . 0.0 111.441 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.706 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.65 147.94 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.125 -178.793 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -123.16 121.19 35.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.825 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.51 139.98 31.81 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.838 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.576 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -127.07 140.43 49.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.467 -179.627 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.559 HG22 ' OE1' ' A' ' 26' ' ' GLU . 21.9 t -103.83 95.76 4.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 177.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.755 HD11 HD22 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -42.7 -23.78 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.85 -178.994 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.415 ' CB ' ' HG2' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -76.03 -48.81 19.49 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 179.242 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.416 HG23 ' HB ' ' A' ' 41' ' ' VAL . 40.6 p -64.47 -27.19 68.81 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.548 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.81 HD12 ' HB3' ' A' ' 62' ' ' LEU . 47.9 mm -56.36 107.38 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.472 178.849 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.434 ' N ' ' O ' ' A' ' 63' ' ' ILE . 15.6 t70 -53.25 -28.48 27.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.543 -179.782 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.441 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 0.0 OUTLIER -172.83 163.46 5.01 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.02 0.438 . . . . 0.0 110.963 179.852 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.792 HD11 HD13 ' A' ' 104' ' ' LEU . 15.0 tp -109.17 122.19 46.76 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.722 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.441 ' HB2' ' HB3' ' A' ' 61' ' ' ARG . 4.2 mt-30 -124.22 146.56 48.64 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-O 120.776 0.322 . . . . 0.0 111.177 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.655 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.16 145.1 19.16 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.61 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.436 ' O ' ' HE1' ' A' ' 97' ' ' MET . 72.4 p . . . . . 0 C--N 1.333 -0.124 0 CA-C-O 120.804 0.335 . . . . 0.0 111.182 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.409 ' HB3' ' HG2' ' A' ' 97' ' ' MET . 3.0 mpp? . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.837 0.351 . . . . 0.0 111.457 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.409 ' HB2' HG23 ' A' ' 51' ' ' THR . 3.0 mpp? -149.79 142.36 24.47 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.589 -179.758 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.655 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 21.8 mt -116.63 145.64 43.26 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.032 178.525 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.441 ' HB3' ' HB2' ' A' ' 49' ' ' GLN . 10.2 ttm180 -143.6 148.82 36.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.092 0.472 . . . . 0.0 112.237 -179.098 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.81 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -128.29 115.94 19.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.625 178.276 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.625 HG23 ' HG2' ' A' ' 86' ' ' ARG . 24.8 mm -76.41 156.5 5.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.807 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.421 ' N ' HG22 ' A' ' 63' ' ' ILE . . . . . . . . 0 N--CA 1.45 -0.372 0 C-N-CA 120.734 -0.745 . . . . 0.0 112.631 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.513 HG22 ' N ' ' A' ' 67' ' ' ASP . 14.8 p . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.759 0.314 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.513 ' N ' HG22 ' A' ' 66' ' ' VAL . 2.3 m-20 -112.28 75.87 0.94 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.767 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -62.79 -17.57 61.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.31 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.4 m -57.27 -22.77 43.85 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.144 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.9 mmtm -63.01 -65.38 0.69 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.79 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.7 mttp 58.23 92.25 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.851 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -110.32 166.98 10.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.873 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.2 mttp -133.95 -168.02 2.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.812 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -136.54 -176.69 4.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.879 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 -59.11 -20.86 57.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.326 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -105.86 29.07 6.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.016 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.31 26.08 35.5 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.551 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 26.8 m-20 -65.9 -163.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.699 0.285 . . . . 0.0 110.917 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -137.22 116.81 12.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.662 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.406 ' O ' ' O ' ' A' ' 81' ' ' VAL . 99.3 t -86.63 -60.67 2.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.613 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.63 ' O ' HG12 ' A' ' 81' ' ' VAL . 0.9 OUTLIER 43.6 98.84 0.03 OUTLIER Pre-proline 0 CA--C 1.537 0.452 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.109 179.868 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.478 ' O ' HG21 ' A' ' 66' ' ' VAL . 81.8 Cg_exo -45.01 149.64 1.17 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.591 2.194 . . . . 0.0 112.707 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.1 mtpt -105.14 162.17 20.54 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.953 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.411 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.9 Cg_exo . . . . . 0 N--CA 1.461 -0.393 0 C-N-CA 123.598 2.865 . . . . 0.0 112.269 -179.116 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.625 ' HG2' HG23 ' A' ' 63' ' ' ILE . 14.3 mtt180 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.633 0.254 . . . . 0.0 110.585 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.54 ' CE1' HG22 ' A' ' 40' ' ' VAL . 17.3 m80 -97.04 111.37 23.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.802 0.334 . . . . 0.0 110.216 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 3.1 mtp -94.3 126.36 39.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.339 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.937 ' CD1' HD11 ' A' ' 16' ' ' ILE . 88.8 m-85 -130.55 116.57 18.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.508 179.553 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.437 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -98.18 114.49 26.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.842 0.353 . . . . 0.0 110.661 179.863 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.736 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 43.0 m-85 -94.37 139.64 30.84 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.559 -179.632 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 -99.19 31.98 2.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.712 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.488 ' HB3' HG23 ' A' ' 96' ' ' VAL . 2.1 m-20 -175.41 113.68 0.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.722 -179.803 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.465 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 10.1 ttp85 -56.62 -19.28 15.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.784 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.62 -47.77 58.42 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-O 120.851 0.358 . . . . 0.0 110.752 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.488 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -67.0 -45.4 87.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 178.927 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.465 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -63.91 -37.24 86.67 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.755 179.202 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.456 ' N ' ' HG3' ' A' ' 97' ' ' MET . 9.3 m-20 -60.14 -30.18 69.13 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 121.179 0.514 . . . . 0.0 109.948 178.909 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -81.69 -63.26 1.43 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.169 179.243 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.663 HG22 HD11 ' A' ' 104' ' ' LEU . 9.0 mm -48.56 -59.89 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.948 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.438 ' HA ' HD12 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -48.54 -30.69 5.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.648 -179.997 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.401 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 17.1 mtm -83.45 -45.68 13.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.405 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.715 ' HB ' HD12 ' A' ' 18' ' ' ILE . 0.3 OUTLIER -57.23 -53.05 62.53 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.756 179.747 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.792 HD13 HD11 ' A' ' 48' ' ' LEU . 6.4 mt -49.87 -53.61 24.67 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.176 0.512 . . . . 0.0 109.924 179.296 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.697 ' HG2' HD23 ' A' ' 48' ' ' LEU . 7.6 mm100 -56.45 -47.56 78.87 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.963 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -49.82 -34.51 19.92 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-O 121.112 0.482 . . . . 0.0 110.494 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.027 HG22 ' HE1' ' A' ' 111' ' ' TYR . 3.4 mt -85.71 -51.73 13.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.374 179.337 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.705 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.48 -57.02 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.43 179.266 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.416 ' HA ' ' HG2' ' A' ' 112' ' ' LYS . 35.0 t -47.33 -28.54 2.06 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.209 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.525 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.7 OUTLIER -71.9 -24.99 61.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.12 179.879 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 1.027 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -74.85 -35.04 62.36 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.526 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.764 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.77 -43.02 17.24 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 178.985 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -61.42 -32.02 71.97 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 113.898 -1.501 . . . . 0.0 108.957 178.137 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.456 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.428 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.616 178.719 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.9 m170 . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.602 0.239 . . . . 0.0 111.153 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.532 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 12.5 p -156.66 159.49 38.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.2 0.524 . . . . 0.0 111.107 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.581 ' HA3' HG12 ' A' ' 96' ' ' VAL . . . 168.24 136.49 2.06 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.58 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.5 148.16 28.27 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -178.541 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.505 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -157.23 171.45 20.4 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.225 -179.076 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.648 HD12 ' HA ' ' A' ' 13' ' ' SER . 4.3 mm -101.7 122.77 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.982 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.492 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 3.7 t80 -118.44 105.27 11.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.951 0.405 . . . . 0.0 111.051 178.681 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 4.3 mm-40 67.45 54.75 0.67 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.756 179.283 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.1 mttm 70.19 -4.66 1.49 Allowed 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 179.311 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.515 ' O ' HG23 ' A' ' 8' ' ' ILE . 21.7 t -104.04 146.7 11.17 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.501 0 CA-C-O 121.134 0.492 . . . . 0.0 110.806 179.631 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.648 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -98.48 114.81 27.33 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.459 179.705 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -133.97 -177.37 14.89 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.365 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.58 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 15.5 mm -105.38 130.5 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-O 120.815 0.341 . . . . 0.0 111.237 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.876 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.4 OUTLIER -101.14 113.63 37.83 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.967 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.532 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -122.47 114.7 21.05 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 121.452 0.644 . . . . 0.0 110.623 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.77 HD13 HG22 ' A' ' 103' ' ' THR . 10.7 mt -82.41 142.82 13.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.906 -178.391 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.595 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.7 t-20 -116.94 94.78 4.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.292 179.471 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.31 0.69 40.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.384 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -82.78 0.61 42.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.385 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.595 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -100.93 -161.94 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.884 0.373 . . . . 0.0 110.911 -179.957 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.0 t -178.84 100.57 0.2 Allowed Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.307 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.433 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 16.8 Cg_exo -65.68 160.99 72.8 Favored 'Cis proline' 0 C--N 1.346 0.412 0 C-N-CA 123.526 -1.447 . . . . 0.0 112.585 0.301 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.766 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -55.77 -171.36 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.805 179.428 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -163.3 142.06 8.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.465 0.65 . . . . 0.0 112.193 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.707 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 2.7 tt -108.22 147.61 31.12 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.92 -1.036 . . . . 0.0 108.578 178.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.5 m -143.42 104.29 4.22 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.781 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.492 ' CH2' ' HB3' ' A' ' 9' ' ' PHE . 82.3 t90 -92.07 110.59 21.97 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.903 178.678 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -109.39 129.27 55.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.644 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.1 t -49.77 156.68 0.67 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.613 0.244 . . . . 0.0 110.514 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.0 m -72.28 -36.2 68.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.352 0.596 . . . . 0.0 109.75 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -82.27 -18.51 42.16 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.063 179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.58 34.81 15.18 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.435 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -93.03 -21.25 19.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.629 0.252 . . . . 0.0 111.62 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.24 161.24 6.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.341 0.591 . . . . 0.0 111.492 -179.774 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.478 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.64 148.95 16.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.107 -178.873 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.478 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 16.3 m80 -123.3 120.47 33.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.606 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.51 143.14 27.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.948 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.707 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.2 t -127.11 138.81 53.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.479 -179.479 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.445 ' O ' HG12 ' A' ' 45' ' ' ILE . 21.8 t -104.02 94.15 3.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 177.545 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.607 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.6 OUTLIER -41.31 -23.47 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.221 -178.698 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.433 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 1.2 t -77.34 -49.07 15.73 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.053 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.427 HG23 ' HB ' ' A' ' 41' ' ' VAL . 30.6 p -64.9 -27.73 69.06 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.488 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.886 HD12 ' HB3' ' A' ' 62' ' ' LEU . 40.6 mm -55.99 110.19 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.582 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -57.28 -29.56 63.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.519 -179.645 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.438 ' CG ' HG13 ' A' ' 63' ' ' ILE . 1.2 pttt -172.47 168.97 5.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.033 0.444 . . . . 0.0 111.09 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.765 HD22 ' OE1' ' A' ' 105' ' ' GLN . 1.1 tp -109.21 117.09 33.21 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.239 -179.621 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.527 ' O ' ' N ' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -111.17 138.85 47.1 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 179.033 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.674 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -156.84 141.44 16.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.71 0.29 . . . . 0.0 111.129 -179.594 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.515 HG23 ' HB2' ' A' ' 59' ' ' MET . 43.9 p . . . . . 0 CA--C 1.531 0.215 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.95 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.493 ' HE2' ' HB2' ' A' ' 94' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.815 0.34 . . . . 0.0 110.621 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.515 ' HB2' HG23 ' A' ' 51' ' ' THR . 32.8 mtm -149.59 146.6 27.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.484 -179.401 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.674 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 32.1 mt -121.53 152.73 38.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.793 178.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.527 ' N ' ' O ' ' A' ' 49' ' ' GLN . 6.9 ttm180 -151.78 145.3 24.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.802 -179.479 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.886 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.2 mp -120.46 118.16 29.55 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 178.281 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.611 HD12 ' HG2' ' A' ' 86' ' ' ARG . 26.8 mm -76.48 156.48 5.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.596 0.236 . . . . 0.0 111.058 -179.581 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.445 ' N ' HG22 ' A' ' 63' ' ' ILE . . . . . . . . 0 N--CA 1.452 -0.298 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.548 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.543 HG11 ' HG3' ' A' ' 84' ' ' PRO . 12.0 p . . . . . 0 N--CA 1.457 -0.113 0 CA-C-O 120.817 0.341 . . . . 0.0 111.074 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.539 ' N ' HG22 ' A' ' 66' ' ' VAL . 3.5 m-20 -132.9 64.39 1.61 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.536 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -65.39 -14.79 61.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.561 -179.6 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.8 m -108.75 34.95 3.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.709 0.29 . . . . 0.0 110.987 -179.777 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.9 mmmm -122.97 -65.85 1.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.167 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 32.9 mttt 66.1 96.86 0.05 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.394 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.76 132.56 55.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.181 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.8 mmtp -82.32 159.94 22.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.853 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 51.6 p30 -112.45 -173.48 2.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.893 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -60.05 -20.36 57.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.329 -179.839 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -101.05 24.13 9.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.126 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.21 21.89 34.4 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.731 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -89.79 117.07 28.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.697 0.284 . . . . 0.0 110.771 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -70.26 108.1 4.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.811 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.412 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 21.3 t -111.03 119.49 59.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.751 -179.674 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.657 ' O ' HG13 ' A' ' 81' ' ' VAL . 14.6 p -99.72 100.71 11.6 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.86 178.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.412 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 74.7 Cg_exo -38.58 143.66 0.23 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.829 2.353 . . . . 0.0 113.121 -178.893 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.458 ' CA ' HG23 ' A' ' 66' ' ' VAL . 8.7 pttt -112.06 166.36 11.08 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.997 -179.86 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.543 ' HG3' HG11 ' A' ' 66' ' ' VAL . 2.6 Cg_exo . . . . . 0 N--CA 1.462 -0.333 0 C-N-CA 123.621 2.881 . . . . 0.0 112.232 -179.034 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.611 ' HG2' HD12 ' A' ' 63' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.689 0.281 . . . . 0.0 110.835 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.433 ' CE1' HG22 ' A' ' 40' ' ' VAL . 2.2 m80 -100.82 111.41 23.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.378 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.419 ' CA ' ' HG3' ' A' ' 61' ' ' ARG . 1.0 OUTLIER -104.88 139.03 40.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.179 -179.622 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.876 ' CD2' HD11 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -140.04 120.33 13.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.977 179.888 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.524 ' HB2' HG12 ' A' ' 8' ' ' ILE . 1.2 m -88.66 114.72 25.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.275 -179.773 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.505 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 6.8 m-85 -95.2 133.61 38.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.9 0.381 . . . . 0.0 111.094 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 24.3 m-20 -92.55 43.76 1.14 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.706 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.704 ' HB3' HG23 ' A' ' 96' ' ' VAL . 1.1 m-20 174.77 114.49 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.293 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.493 ' HB2' ' HE2' ' A' ' 58' ' ' MET . 0.2 OUTLIER -57.32 -16.95 10.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.933 179.7 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.62 -42.48 64.42 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.18 0.514 . . . . 0.0 109.906 179.468 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.704 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -65.82 -54.25 29.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.266 178.905 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.43 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -59.35 -35.96 74.84 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.438 179.388 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.569 ' O ' ' HE2' ' A' ' 102' ' ' MET . 29.1 t70 -67.08 -31.72 72.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.066 0.46 . . . . 0.0 110.428 179.373 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 90.3 m-20 -81.74 -30.03 32.63 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.335 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.666 HG23 HD11 ' A' ' 18' ' ' ILE . 4.5 mm -83.23 -59.97 2.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.817 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.61 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 17.8 ttpp -47.55 -38.3 13.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.644 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.569 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 41.6 mtm -79.94 -25.62 40.4 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.242 -179.592 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.77 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -80.76 -40.74 24.66 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.126 179.962 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.607 ' CD2' HD11 ' A' ' 42' ' ' LEU . 13.2 mt -57.73 -53.01 63.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.267 -0.424 . . . . 0.0 109.993 179.271 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.765 ' OE1' HD22 ' A' ' 48' ' ' LEU . 13.4 mm100 -60.59 -43.66 97.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.433 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -47.18 -36.44 8.7 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 121.22 0.533 . . . . 0.0 110.512 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.037 HG22 ' HE1' ' A' ' 111' ' ' TYR . 14.4 mt -85.88 -51.59 13.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.512 179.193 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.673 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.21 -60.49 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.681 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.425 ' HA ' ' HG2' ' A' ' 112' ' ' LYS . 6.6 t -46.96 -25.87 0.88 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.25 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.459 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 15.7 mtt180 -72.26 -25.07 61.47 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.942 179.5 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 1.037 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -75.38 -36.7 60.87 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 179.698 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.737 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.59 -42.87 19.46 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.988 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -61.39 -30.24 70.42 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.007 -1.451 . . . . 0.0 108.967 177.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.459 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.456 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.54 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.419 ' CE1' ' HB2' ' A' ' 20' ' ' GLU . 25.2 m170 . . . . . 0 CA--C 1.529 0.158 0 CA-C-O 120.584 0.23 . . . . 0.0 111.119 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.56 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 8.9 p -156.33 142.31 18.05 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.139 0.495 . . . . 0.0 111.228 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.47 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -175.45 140.27 5.13 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 110.746 -0.942 . . . . 0.0 110.746 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.549 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -81.94 139.73 34.44 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.415 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.602 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -148.92 171.23 16.66 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.043 -179.586 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.647 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.96 128.72 55.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-O 120.827 0.346 . . . . 0.0 111.791 -179.55 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.491 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 7.1 t80 -129.19 110.62 12.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.111 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.431 ' HG2' ' CE1' ' A' ' 9' ' ' PHE . 5.6 mm-40 67.41 47.69 1.23 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.947 179.014 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.2 mmtm 72.25 -5.95 1.66 Allowed 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.466 ' O ' HG23 ' A' ' 8' ' ' ILE . 14.4 t -99.23 148.52 6.2 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 CA-C-O 121.034 0.445 . . . . 0.0 110.474 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.455 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -111.34 113.86 26.62 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.084 -179.924 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.874 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -132.31 -133.91 3.48 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.877 -0.678 . . . . 0.0 112.112 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.874 HD13 ' O ' ' A' ' 14' ' ' GLY . 17.5 mm -136.13 135.27 50.18 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.491 0 CA-C-O 120.81 0.338 . . . . 0.0 111.322 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.91 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.32 139.99 20.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 176.669 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.56 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -150.1 118.56 6.47 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 119.489 -0.884 . . . . 0.0 111.68 -178.305 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.586 HD12 ' HB ' ' A' ' 103' ' ' THR . 11.3 mt -81.57 142.92 13.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 114.469 -1.242 . . . . 0.0 112.053 -178.654 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.624 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -119.98 92.59 3.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.045 179.052 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.419 ' HB2' ' CE1' ' A' ' 3' ' ' HIS . 1.2 tt0 -82.46 -0.39 46.12 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.33 -179.645 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -83.08 1.31 40.83 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.336 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.624 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -102.58 -162.72 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.842 0.354 . . . . 0.0 110.819 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 8.3 p -174.28 101.08 0.29 Allowed Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.366 179.64 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.45 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 58.4 Cg_endo -71.84 165.56 81.51 Favored 'Cis proline' 0 C--N 1.346 0.41 0 C-N-CA 123.518 -1.451 . . . . 0.0 112.765 0.466 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.32 175.72 0.21 Allowed 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.549 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.497 ' HG2' HG21 ' A' ' 22' ' ' VAL . 6.6 pt-20 -163.71 138.71 6.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.112 179.179 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.81 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.72 143.92 35.55 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.861 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.724 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.2 m -127.52 113.55 16.28 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -178.404 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.534 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 77.9 t90 -92.0 110.33 21.69 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.422 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.73 130.97 55.43 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.68 0.276 . . . . 0.0 110.905 -179.812 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.3 t -49.84 158.52 0.48 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.561 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.415 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 48.1 m -73.76 -37.34 65.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.483 0.658 . . . . 0.0 109.69 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -84.2 -16.32 43.81 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.001 -1.0 . . . . 0.0 111.18 179.596 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.49 34.54 11.74 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.308 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -85.54 -25.61 26.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.677 0.275 . . . . 0.0 111.379 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.73 163.94 2.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.213 0.53 . . . . 0.0 111.423 -179.784 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.724 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.68 146.16 19.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.196 -178.729 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.402 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 26.8 m-70 -119.84 120.75 37.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.664 179.748 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.496 HG23 HG23 ' A' ' 28' ' ' THR . 0.3 OUTLIER -96.53 137.42 35.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.063 -179.76 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.562 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.1 t -126.53 139.31 52.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.221 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.467 ' CG1' HG23 ' A' ' 44' ' ' THR . 47.0 t -103.96 95.98 4.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 177.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.731 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.9 OUTLIER -41.16 -25.52 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.12 -178.919 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.45 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 2.0 t -76.14 -48.51 20.33 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.465 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.467 HG23 ' CG1' ' A' ' 41' ' ' VAL . 30.9 p -64.69 -27.86 69.2 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 178.449 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.849 HD12 ' HB3' ' A' ' 62' ' ' LEU . 42.0 mm -56.48 107.14 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.512 178.619 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.407 ' N ' ' O ' ' A' ' 63' ' ' ILE . 8.2 t70 -47.89 -33.98 8.3 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.926 0.393 . . . . 0.0 111.011 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.431 ' HG3' HG12 ' A' ' 63' ' ' ILE . 1.8 pttt -172.44 164.02 5.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.72 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 1.034 HD11 HD13 ' A' ' 104' ' ' LEU . 15.1 tp -108.65 123.29 48.74 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.61 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -119.53 148.56 43.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.537 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.674 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.1 148.37 22.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.573 0.225 . . . . 0.0 111.043 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.568 HG23 ' HB2' ' A' ' 59' ' ' MET . 35.7 p . . . . . 0 C--N 1.332 -0.18 0 CA-C-O 120.626 0.25 . . . . 0.0 110.985 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.401 ' HG2' ' CA ' ' A' ' 94' ' ' ARG . 2.1 mpp? . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.671 0.272 . . . . 0.0 110.855 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.568 ' HB2' HG23 ' A' ' 51' ' ' THR . 31.9 mtm -149.7 143.19 25.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.632 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.674 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 25.4 mt -120.48 145.55 47.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.096 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.434 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 14.7 ttm-85 -141.9 151.3 42.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.949 0.404 . . . . 0.0 111.857 -179.058 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.849 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -128.19 117.42 21.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.817 178.564 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.611 HD12 ' HG2' ' A' ' 86' ' ' ARG . 17.3 mm -76.6 156.52 5.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.792 0.329 . . . . 0.0 111.279 -179.354 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.416 ' N ' HG22 ' A' ' 63' ' ' ILE . . . . . . . . 0 N--CA 1.452 -0.284 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.447 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.458 HG22 ' N ' ' A' ' 67' ' ' ASP . 7.6 p . . . . . 0 N--CA 1.455 -0.198 0 CA-C-O 120.794 0.331 . . . . 0.0 111.313 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.458 ' N ' HG22 ' A' ' 66' ' ' VAL . 2.4 t0 -113.04 39.57 2.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.807 179.823 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.59 -21.91 65.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.187 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.2 m -80.02 -21.07 43.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.208 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.4 mmtp -79.63 -68.37 0.67 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.9 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.3 mtpt 60.04 89.25 0.07 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.818 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.28 -176.51 3.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.923 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 11.1 mttt -134.38 -167.74 2.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.674 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -135.91 -179.21 5.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.91 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -56.93 -22.32 36.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.347 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.73 33.49 4.04 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.989 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 55.5 26.17 44.35 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.51 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -66.8 -169.51 0.08 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.816 0.341 . . . . 0.0 111.001 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -135.58 119.39 17.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.568 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.2 t -89.28 -63.92 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.424 -179.704 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.446 ' O ' HG13 ' A' ' 81' ' ' VAL . 4.8 p 34.21 80.41 0.26 Allowed Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.849 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -45.51 124.69 6.85 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.848 2.365 . . . . 0.0 112.592 -179.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.425 ' O ' HG23 ' A' ' 66' ' ' VAL . 0.2 OUTLIER -72.09 161.62 77.9 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.018 179.976 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.409 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.5 Cg_exo . . . . . 0 N--CA 1.459 -0.519 0 C-N-CA 123.645 2.897 . . . . 0.0 112.42 -179.036 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.611 ' HG2' HD12 ' A' ' 63' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.634 0.255 . . . . 0.0 110.568 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.541 ' CE1' HG22 ' A' ' 40' ' ' VAL . 11.6 m80 -99.02 111.37 23.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.732 0.301 . . . . 0.0 110.372 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.81 121.04 35.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.008 0.432 . . . . 0.0 111.199 -179.532 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.91 ' CD1' HD11 ' A' ' 16' ' ' ILE . 92.9 m-85 -122.9 116.73 24.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.467 179.748 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.412 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -97.11 114.55 26.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.846 -179.937 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.602 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 17.0 m-85 -94.66 137.14 34.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.182 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 24.6 m-20 -97.08 39.26 1.19 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.823 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.497 ' CB ' HG23 ' A' ' 96' ' ' VAL . 5.4 m-20 179.59 111.17 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.553 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.428 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.3 OUTLIER -53.41 -21.67 6.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.781 179.795 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.79 -47.3 66.49 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-O 120.891 0.377 . . . . 0.0 110.834 179.79 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.497 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -65.76 -47.22 86.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 178.873 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.45 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -64.52 -37.42 87.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.372 179.539 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.45 ' N ' ' HG3' ' A' ' 97' ' ' MET . 35.7 t0 -68.75 -33.88 74.65 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.095 0.474 . . . . 0.0 109.965 179.278 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.435 ' O ' ' OG1' ' A' ' 103' ' ' THR . 53.2 m-20 -81.88 -26.86 33.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.475 179.294 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.47 HD11 ' N ' ' A' ' 5' ' ' GLY . 1.6 mm -86.4 -59.7 2.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.041 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 7.9 ttmt -44.15 -30.6 0.79 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.374 -179.508 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.77 -37.93 34.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.446 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.586 ' HB ' HD12 ' A' ' 18' ' ' ILE . 0.3 OUTLIER -59.33 -57.42 13.09 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.714 179.588 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 1.034 HD13 HD11 ' A' ' 48' ' ' LEU . 5.7 mt -47.97 -56.03 8.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.892 179.481 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -56.37 -44.99 80.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.883 179.444 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -52.19 -34.44 45.3 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-O 121.168 0.509 . . . . 0.0 110.404 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.989 HG22 ' HE1' ' A' ' 111' ' ' TYR . 5.0 mt -85.64 -51.91 12.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.328 179.291 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.693 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -42.26 -57.58 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.501 179.396 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.7 m -46.92 -26.12 0.92 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.178 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.438 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 14.4 mtp85 -74.06 -25.02 59.61 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.282 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.989 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -76.32 -34.34 59.01 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.748 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.01 -43.51 17.88 Favored 'General case' 0 CA--C 1.505 -0.776 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 178.851 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -61.65 -31.56 71.67 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 113.867 -1.515 . . . . 0.0 109.099 178.112 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.438 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.449 -0.516 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.697 178.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 33.8 m170 . . . . . 0 CA--C 1.53 0.183 0 CA-C-O 120.477 0.18 . . . . 0.0 111.434 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.571 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 3.4 p -151.25 155.39 38.69 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.162 0.506 . . . . 0.0 111.328 179.543 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.502 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 173.62 138.02 2.55 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.866 -0.894 . . . . 0.0 110.866 -179.623 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.558 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.22 133.41 35.25 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -178.53 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.711 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -141.6 171.23 14.35 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.182 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.646 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.66 127.99 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.827 -179.598 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.49 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 7.6 t80 -129.41 110.81 12.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.957 0.408 . . . . 0.0 111.155 178.309 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.411 ' HG3' ' CE1' ' A' ' 9' ' ' PHE . 36.8 mt-10 67.53 49.38 1.01 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.826 179.173 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 69.76 -4.69 1.37 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.214 179.412 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.454 ' O ' HG23 ' A' ' 8' ' ' ILE . 15.7 t -100.07 148.11 6.95 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.479 0 CA-C-O 121.108 0.48 . . . . 0.0 110.41 179.501 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.434 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -112.1 112.83 24.73 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.956 179.885 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.884 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -130.46 -128.97 3.04 Favored Glycine 0 N--CA 1.445 -0.71 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.958 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.884 HD13 ' O ' ' A' ' 14' ' ' GLY . 19.4 mm -138.66 135.48 43.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 120.692 0.282 . . . . 0.0 111.313 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.89 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.8 141.2 17.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 106.279 -1.748 . . . . 0.0 106.279 176.575 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.571 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.41 116.99 5.4 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 119.532 -0.867 . . . . 0.0 111.549 -178.715 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.916 HD13 HG22 ' A' ' 103' ' ' THR . 4.7 mt -85.28 137.81 20.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 114.553 -1.203 . . . . 0.0 111.85 -178.786 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.638 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.5 t-20 -116.6 93.43 4.21 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.316 179.545 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -80.36 0.08 34.62 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.475 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -82.7 0.41 43.51 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.36 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.638 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -101.75 -162.27 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.873 0.368 . . . . 0.0 110.886 179.89 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 t -175.73 101.23 0.25 Allowed Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.427 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.442 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 57.5 Cg_endo -71.31 160.23 92.71 Favored 'Cis proline' 0 C--N 1.346 0.434 0 C-N-CA 123.471 -1.47 . . . . 0.0 112.784 0.409 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.572 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -53.64 176.97 0.03 OUTLIER 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.421 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.504 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.64 135.0 4.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.43 179.309 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.81 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -108.08 130.57 55.09 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 178.736 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.738 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.4 m -114.52 113.44 24.44 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -178.201 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.535 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 78.1 t90 -91.94 110.58 21.94 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.246 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.505 ' O ' ' N ' ' A' ' 15' ' ' ILE . 1.5 ttt180 -110.83 131.27 55.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.199 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.413 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 17.1 m -49.91 160.6 0.31 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.424 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.424 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 45.9 m -75.66 -37.34 59.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.341 0.591 . . . . 0.0 109.751 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -85.42 -14.53 45.93 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.107 179.722 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.65 34.72 12.91 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.323 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.32 -26.1 26.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.812 0.339 . . . . 0.0 111.358 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.28 162.49 2.95 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.275 0.56 . . . . 0.0 111.411 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.738 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.61 145.63 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.035 -178.768 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 31.3 m-70 -120.03 120.99 37.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.779 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.4 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.51 128.52 43.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.708 -179.982 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.58 ' CG2' ' CE1' ' A' ' 87' ' ' HIS . 0.9 OUTLIER -114.72 140.25 36.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.522 -179.547 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.421 HG12 ' HB3' ' A' ' 43' ' ' SER . 28.3 t -104.03 96.29 4.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 177.818 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.81 HD11 HD22 ' A' ' 104' ' ' LEU . 0.5 OUTLIER -42.81 -24.46 0.06 Allowed 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.874 -178.89 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.442 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 1.5 t -74.84 -48.02 27.36 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.255 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.405 HG23 ' HB ' ' A' ' 41' ' ' VAL . 48.4 p -64.66 -27.71 69.11 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 108.976 -0.749 . . . . 0.0 108.976 178.414 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.877 HD12 ' HB3' ' A' ' 62' ' ' LEU . 44.6 mm -56.58 108.06 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.645 178.838 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.444 ' N ' ' O ' ' A' ' 63' ' ' ILE . 14.9 t0 -55.27 -28.13 51.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.395 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.431 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 2.7 ptpt -172.45 161.97 5.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.901 0.381 . . . . 0.0 110.873 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.695 HD11 HD13 ' A' ' 104' ' ' LEU . 46.5 tp -109.09 118.94 38.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.975 -179.607 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.414 ' HB3' ' HB3' ' A' ' 61' ' ' ARG . 3.2 tt0 -117.6 145.68 44.15 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.788 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.66 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.1 145.92 19.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.997 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.526 HG23 ' HB2' ' A' ' 59' ' ' MET . 72.7 p . . . . . 0 CA--C 1.53 0.173 0 CA-C-O 120.595 0.236 . . . . 0.0 110.954 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.835 0.35 . . . . 0.0 110.526 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.526 ' HB2' HG23 ' A' ' 51' ' ' THR . 47.8 mtm -149.6 146.29 27.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.615 -179.424 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.66 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 26.7 mt -119.8 148.75 43.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.596 178.797 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.429 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 1.7 ttt180 -144.52 147.19 32.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.879 0.371 . . . . 0.0 111.559 -179.621 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.877 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.6 mp -128.37 113.74 15.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.815 178.558 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.604 ' HA ' ' HB3' ' A' ' 86' ' ' ARG . 7.1 mm -76.7 156.48 5.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.747 0.308 . . . . 0.0 111.239 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.467 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.489 179.937 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.519 HG22 ' N ' ' A' ' 67' ' ' ASP . 11.2 p . . . . . 0 N--CA 1.457 -0.101 0 CA-C-O 120.871 0.367 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.519 ' N ' HG22 ' A' ' 66' ' ' VAL . 7.4 m-20 -91.7 74.22 5.82 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.138 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.51 ' CG ' HG11 ' A' ' 81' ' ' VAL . 9.9 mp0 -54.29 -21.01 8.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.603 -179.48 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.7 m -48.53 -27.46 2.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.882 0.372 . . . . 0.0 111.317 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.8 mmmt -67.46 -65.83 0.64 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.757 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.3 mttt 60.93 93.01 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.022 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.57 124.46 34.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.754 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -76.18 167.49 21.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.944 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -104.43 -50.48 3.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.203 0.525 . . . . 0.0 111.168 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.3 t30 174.36 -31.54 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.198 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -93.37 40.78 1.07 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.091 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 58.33 19.16 38.9 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.645 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -80.38 174.23 11.81 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.821 0.343 . . . . 0.0 110.8 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -133.29 111.99 11.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.825 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 24.4 t -103.33 141.58 18.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.432 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.51 HG11 ' CG ' ' A' ' 68' ' ' GLU . 45.4 t -110.65 90.6 10.81 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.633 179.646 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -44.55 145.51 2.6 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.681 2.254 . . . . 0.0 112.57 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.454 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -54.06 154.44 7.72 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.156 -179.889 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.477 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 4.2 Cg_exo . . . . . 0 N--CA 1.46 -0.486 0 C-N-CA 123.513 2.808 . . . . 0.0 112.351 -179.193 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.604 ' HB3' ' HA ' ' A' ' 63' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.697 0.284 . . . . 0.0 111.056 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.58 ' CE1' ' CG2' ' A' ' 40' ' ' VAL . 9.9 m80 -94.93 116.44 28.71 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.183 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.04 110.95 22.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.005 0.431 . . . . 0.0 111.186 -179.413 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.89 ' CD1' HD11 ' A' ' 16' ' ' ILE . 94.2 m-85 -110.93 116.61 31.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.501 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.417 ' HB2' HG12 ' A' ' 8' ' ' ILE . 0.8 OUTLIER -100.79 114.39 28.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.884 0.373 . . . . 0.0 110.711 179.928 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.711 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 42.6 m-85 -93.41 150.69 20.26 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.426 -179.751 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 -107.98 31.54 5.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.404 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.513 ' HB3' HG23 ' A' ' 96' ' ' VAL . 2.1 m-20 -175.93 113.68 0.12 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.468 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.438 ' O ' ' HG3' ' A' ' 97' ' ' MET . 0.0 OUTLIER -56.57 -19.07 14.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 179.77 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.92 -45.07 64.92 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.735 179.764 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.513 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -67.81 -48.27 76.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.966 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.438 ' HG3' ' O ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -62.07 -35.56 79.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.865 179.165 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.4 ' N ' ' HG3' ' A' ' 97' ' ' MET . 7.3 m-20 -61.15 -31.47 71.19 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.217 179.111 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.9 m-80 -81.73 -51.76 7.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.42 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.681 HG23 HD11 ' A' ' 18' ' ' ILE . 10.7 mm -58.46 -59.77 3.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.623 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.412 ' HG3' ' CB ' ' A' ' 50' ' ' ALA . 5.3 ttmt -51.18 -31.75 21.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.912 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 14.1 mtm -83.34 -31.44 26.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.592 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.916 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -82.32 -27.16 32.41 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.798 -179.568 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.81 HD22 HD11 ' A' ' 42' ' ' LEU . 19.3 mt -67.69 -42.08 82.63 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 179.322 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.42 ' HA ' HG13 ' A' ' 108' ' ' ILE . 2.1 mm100 -66.29 -48.72 69.48 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.603 -179.362 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.445 ' HG2' ' HA ' ' A' ' 103' ' ' THR . 11.1 pt20 -46.86 -33.39 4.48 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 121.087 0.47 . . . . 0.0 110.973 -178.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.036 HG22 ' HE1' ' A' ' 111' ' ' TYR . 11.3 mt -82.42 -53.36 11.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.603 179.278 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.686 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.24 -57.15 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.342 179.65 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -46.87 -26.92 1.08 Allowed 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.134 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.446 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 19.7 mtp180 -73.95 -25.05 59.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.29 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 1.036 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -76.1 -35.59 59.25 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.735 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.718 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -80.54 -43.78 20.14 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 178.911 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -61.54 -31.08 71.09 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 113.876 -1.511 . . . . 0.0 109.053 178.188 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.446 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.407 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.691 178.726 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.409 ' NE2' ' HB2' ' A' ' 20' ' ' GLU . 24.3 m170 . . . . . 0 CA--C 1.528 0.109 0 CA-C-O 120.567 0.222 . . . . 0.0 111.093 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.581 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 3.9 p -155.79 157.58 36.73 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.122 0.487 . . . . 0.0 111.218 179.736 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.513 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 171.33 139.15 2.7 Favored Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 111.119 -0.792 . . . . 0.0 111.119 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.78 144.2 30.33 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -178.569 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.556 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -153.28 171.19 18.94 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.054 -179.419 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.663 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.79 125.74 55.85 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 CA-C-O 120.745 0.307 . . . . 0.0 111.721 -179.68 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.478 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.2 t80 -125.17 109.16 12.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.938 0.399 . . . . 0.0 111.194 178.498 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.421 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 49.9 mt-10 67.5 48.06 1.16 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.888 179.025 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.6 mttt 73.3 -5.84 1.87 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.2 0.445 . . . . 0.0 112.2 179.2 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.459 ' O ' HG23 ' A' ' 8' ' ' ILE . 16.8 t -100.21 148.68 6.49 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.496 0 CA-C-O 121.174 0.511 . . . . 0.0 110.448 179.639 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.45 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -110.8 113.18 25.56 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.97 179.883 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.886 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.9 -133.86 3.51 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.803 -0.713 . . . . 0.0 111.983 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.886 HD13 ' O ' ' A' ' 14' ' ' GLY . 18.4 mm -135.93 135.68 50.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.682 0.277 . . . . 0.0 111.319 179.78 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.932 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.74 140.37 19.82 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 176.5 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.581 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -149.55 117.51 6.31 Favored 'General case' 0 C--N 1.31 -1.115 0 C-N-CA 119.607 -0.837 . . . . 0.0 111.614 -178.581 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.899 HD13 HG22 ' A' ' 103' ' ' THR . 4.3 mt -85.39 142.77 12.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.738 -178.753 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.613 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.5 t-20 -121.26 92.83 3.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.399 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.409 ' HB2' ' NE2' ' A' ' 3' ' ' HIS . 0.7 OUTLIER -81.18 0.42 36.57 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.487 -179.867 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -82.67 0.65 42.26 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.295 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.613 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -102.24 -162.56 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.924 0.392 . . . . 0.0 110.858 -179.962 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.414 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 10.1 p -174.43 101.07 0.28 Allowed Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.437 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.45 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 56.4 Cg_endo -70.71 165.64 78.76 Favored 'Cis proline' 0 C--N 1.347 0.461 0 C-N-CA 123.438 -1.484 . . . . 0.0 112.807 0.278 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.462 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -58.25 176.74 0.15 Allowed 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.308 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.478 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.7 135.46 4.87 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.287 179.287 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.804 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.85 147.37 31.01 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.786 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.737 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.2 m -132.73 113.65 13.22 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.431 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.551 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 79.7 t90 -91.96 110.5 21.86 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 178.331 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.468 ' O ' ' N ' ' A' ' 15' ' ' ILE . 8.8 ttt180 -110.51 131.0 55.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.961 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.5 m -49.87 158.92 0.44 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.53 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.411 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 48.4 m -74.42 -37.35 63.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.379 0.609 . . . . 0.0 109.674 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -84.21 -16.02 44.83 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.027 -0.988 . . . . 0.0 111.154 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.47 34.53 11.81 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.235 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.92 -25.53 26.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.638 0.256 . . . . 0.0 111.364 -179.665 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.78 163.75 2.86 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.31 0.576 . . . . 0.0 111.403 -179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.737 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.65 146.83 19.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.07 -178.757 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.43 ' ND1' ' CZ ' ' A' ' 9' ' ' PHE . 12.6 m-70 -120.48 120.18 35.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.698 179.711 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.525 HG23 HG23 ' A' ' 28' ' ' THR . 0.3 OUTLIER -96.43 141.45 29.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.805 -179.772 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.555 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -129.98 139.83 50.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.413 -179.507 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.418 ' O ' HG12 ' A' ' 45' ' ' ILE . 30.7 t -103.87 96.32 4.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 177.715 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.812 HD11 HD22 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -41.75 -24.21 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.127 -178.775 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.45 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 1.8 t -77.38 -48.59 16.9 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 179.388 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.7 p -64.49 -27.5 69.02 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.576 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.867 HD12 ' HB3' ' A' ' 62' ' ' LEU . 36.7 mm -56.48 112.59 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.595 178.836 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.418 ' N ' ' O ' ' A' ' 63' ' ' ILE . 1.4 t70 -52.37 -35.05 50.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.882 0.373 . . . . 0.0 111.034 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.412 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 12.6 pttt -172.34 167.44 5.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.813 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.631 HD11 HD13 ' A' ' 104' ' ' LEU . 15.1 tp -109.05 118.85 37.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.986 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.4 ' HB3' ' HB3' ' A' ' 61' ' ' ARG . 10.6 tt0 -114.27 145.92 41.12 Favored 'General case' 0 C--O 1.225 -0.224 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.423 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.629 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -156.97 151.07 24.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.129 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.674 HG23 ' HB2' ' A' ' 59' ' ' MET . 9.5 p . . . . . 0 C--N 1.331 -0.196 0 CA-C-O 120.657 0.265 . . . . 0.0 111.295 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.426 ' HG2' ' CA ' ' A' ' 94' ' ' ARG . 3.0 mpp? . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.83 0.348 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.674 ' HB2' HG23 ' A' ' 51' ' ' THR . 31.0 mtm -149.69 138.48 20.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.637 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.629 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 16.0 mt -117.68 143.54 46.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.054 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.513 ' HD3' HD13 ' A' ' 63' ' ' ILE . 0.3 OUTLIER -144.59 149.57 36.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.022 0.439 . . . . 0.0 112.023 -179.043 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.867 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.8 mp -128.08 118.05 22.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.819 178.533 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.711 HD12 ' HG2' ' A' ' 86' ' ' ARG . 10.0 mm -76.5 156.5 5.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.037 -179.631 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.284 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.53 -179.995 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.504 HG22 ' N ' ' A' ' 67' ' ' ASP . 14.5 p . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.747 0.308 . . . . 0.0 111.174 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.504 ' N ' HG22 ' A' ' 66' ' ' VAL . 14.0 p30 -101.71 73.11 1.41 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.623 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.529 ' HA ' HG13 ' A' ' 81' ' ' VAL . 9.4 mt-10 -54.92 -23.99 21.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.256 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.6 m -63.44 -21.77 66.49 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.0 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -63.33 -62.88 1.39 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.795 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.8 mttm 62.77 94.47 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.819 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.6 128.74 45.02 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.857 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.48 153.96 37.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.913 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.46 -42.16 7.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.984 0.421 . . . . 0.0 111.007 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 167.76 -29.66 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.166 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -101.6 20.79 15.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.356 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.21 36.05 56.29 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.555 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -90.29 0.38 57.26 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 54.77 110.42 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.901 0.381 . . . . 0.0 111.661 179.423 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 7.1 t -113.44 133.54 59.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.619 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.529 HG13 ' HA ' ' A' ' 68' ' ' GLU . 42.5 t -106.17 85.78 1.79 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.605 179.636 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 81' ' ' VAL . 1.5 Cg_endo -43.85 139.9 5.19 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.954 2.436 . . . . 0.0 112.633 -179.598 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -58.82 165.08 3.53 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.122 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.429 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.3 Cg_exo . . . . . 0 N--CA 1.46 -0.442 0 C-N-CA 123.683 2.922 . . . . 0.0 112.33 -179.094 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.711 ' HG2' HD12 ' A' ' 63' ' ' ILE . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.697 0.284 . . . . 0.0 110.751 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.541 ' CE1' HG22 ' A' ' 40' ' ' VAL . 7.0 m80 -99.09 111.33 23.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.756 0.312 . . . . 0.0 110.164 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.412 ' HA ' ' HG3' ' A' ' 61' ' ' ARG . 9.0 ttt -94.74 134.7 37.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.065 0.46 . . . . 0.0 111.586 -179.19 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.932 ' CD1' HD11 ' A' ' 16' ' ' ILE . 51.5 m-85 -135.31 116.62 14.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.667 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.443 ' HB3' ' HB ' ' A' ' 8' ' ' ILE . 0.5 OUTLIER -92.22 114.8 27.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.894 0.378 . . . . 0.0 110.491 179.775 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.476 ' CE1' ' HB2' ' A' ' 7' ' ' ALA . 9.0 m-85 -89.74 136.33 33.1 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.733 -179.368 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -101.08 27.79 5.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.306 179.242 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.441 ' CB ' HG23 ' A' ' 96' ' ' VAL . 9.9 m-20 -175.24 112.76 0.13 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.556 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.458 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -55.79 -19.39 11.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.927 179.72 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.21 -47.95 59.25 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.796 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.441 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -66.83 -45.37 87.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.006 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.458 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -63.9 -37.02 85.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.766 179.31 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.481 ' O ' ' HE2' ' A' ' 102' ' ' MET . 14.1 m-20 -61.14 -31.95 71.66 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.093 0.473 . . . . 0.0 109.941 178.854 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 -81.97 -54.04 5.64 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.502 179.317 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.538 HD12 ' CG2' ' A' ' 16' ' ' ILE . 15.3 mm -57.5 -60.01 2.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.896 179.724 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.404 ' HG3' ' CB ' ' A' ' 50' ' ' ALA . 0.4 OUTLIER -51.6 -37.3 49.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.269 -179.584 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.481 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 39.1 mtm -81.35 -27.72 34.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.218 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.899 HG22 HD13 ' A' ' 18' ' ' ILE . 1.0 OUTLIER -81.49 -31.44 32.9 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.852 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.812 HD22 HD11 ' A' ' 42' ' ' LEU . 33.7 mt -64.8 -55.95 16.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.96 179.181 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.401 ' HA ' HG13 ' A' ' 108' ' ' ILE . 6.2 pt20 -62.34 -35.9 80.54 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.926 179.64 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -50.39 -36.97 35.11 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-O 121.289 0.566 . . . . 0.0 109.811 179.287 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.015 HG22 ' HE1' ' A' ' 111' ' ' TYR . 12.4 mt -85.78 -52.08 12.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.02 178.828 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.67 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.53 -58.1 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.342 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.229 179.225 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.4 m -47.29 -25.98 1.11 Allowed 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.133 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.454 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 33.6 mtp180 -74.08 -25.04 59.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.214 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 1.015 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -75.41 -35.28 61.04 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.661 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.74 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.34 -43.46 19.03 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 178.873 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -61.66 -31.59 71.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 113.838 -1.528 . . . . 0.0 108.983 178.19 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.454 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.447 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.681 178.748 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.42 ' O ' ' N ' ' A' ' 18' ' ' ILE . 18.6 m80 . . . . . 0 CA--C 1.529 0.159 0 CA-C-O 120.62 0.248 . . . . 0.0 111.009 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.555 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 19.2 p -158.31 133.63 8.71 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 121.244 0.545 . . . . 0.0 111.212 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.534 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -170.29 138.78 5.17 Favored Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.566 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -80.26 142.28 34.75 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -178.415 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.507 ' C ' HD13 ' A' ' 8' ' ' ILE . . . -154.66 171.19 19.9 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.326 -179.35 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.645 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -99.08 127.59 51.58 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.388 -179.782 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.471 ' CB ' ' CE2' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -127.19 107.18 9.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.994 0.426 . . . . 0.0 111.545 179.122 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 68.04 53.87 0.62 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.221 179.101 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.06 -0.7 1.64 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.91 179.718 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.566 ' O ' HG23 ' A' ' 8' ' ' ILE . 37.1 t -105.15 151.91 7.22 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.481 0 CA-C-O 121.201 0.524 . . . . 0.0 110.576 179.415 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.471 ' HA ' HD12 ' A' ' 8' ' ' ILE . 54.7 p -114.09 115.84 28.19 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.136 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.729 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -138.04 -139.27 3.83 Favored Glycine 0 N--CA 1.444 -0.804 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.94 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.729 HD13 ' O ' ' A' ' 14' ' ' GLY . 15.9 mm -129.32 134.93 62.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.844 0.354 . . . . 0.0 111.219 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.845 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.36 140.62 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 176.703 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.555 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.46 118.1 5.74 Favored 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 119.537 -0.865 . . . . 0.0 111.507 -178.347 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.685 HD12 ' HB ' ' A' ' 103' ' ' THR . 6.9 mt -80.79 142.96 13.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 114.385 -1.28 . . . . 0.0 112.254 -178.651 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.642 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.3 t-20 -119.39 92.65 3.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.96 179.057 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.26 -0.95 47.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.305 -179.76 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -83.0 1.07 41.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.57 -0.287 . . . . 0.0 111.241 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.642 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -102.91 -162.92 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.837 0.351 . . . . 0.0 110.758 179.998 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.412 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 9.9 p -174.42 101.07 0.28 Allowed Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.333 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.456 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 58.5 Cg_endo -71.74 165.4 81.75 Favored 'Cis proline' 0 C--N 1.347 0.464 0 C-N-CA 123.569 -1.43 . . . . 0.0 112.905 0.396 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.55 176.57 0.13 Allowed 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.514 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.518 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 13.7 pt-20 -163.76 136.85 5.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.229 179.104 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.796 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.92 129.06 55.12 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.954 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.507 HG22 ' CG2' ' A' ' 37' ' ' VAL . 6.7 m -111.67 113.18 25.39 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.555 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.489 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 75.4 t90 -91.99 110.63 22.0 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.737 178.668 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -107.98 126.84 53.18 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.912 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.4 t -49.77 156.53 0.69 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.378 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.442 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 54.4 m -71.69 -38.04 70.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.433 0.635 . . . . 0.0 109.415 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -78.75 -9.99 59.62 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 114.897 -1.047 . . . . 0.0 111.184 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 69.77 42.38 70.77 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.276 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -101.98 -23.18 14.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.729 0.299 . . . . 0.0 111.262 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -168.19 153.85 6.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.385 0.612 . . . . 0.0 111.487 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.507 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.5 OUTLIER -140.97 155.47 21.74 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.072 -178.634 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.427 ' HB2' ' CE2' ' A' ' 9' ' ' PHE . 10.7 m-70 -131.2 121.96 25.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.491 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.42 127.23 42.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.0 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.567 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -113.11 138.94 40.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.16 -179.915 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.474 ' CG1' HG23 ' A' ' 44' ' ' THR . 44.5 t -103.86 95.85 4.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.067 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.727 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.7 OUTLIER -41.8 -25.09 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.123 -0.489 . . . . 0.0 112.008 -178.905 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.456 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 2.1 t -76.07 -48.64 20.06 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 179.352 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.474 HG23 ' CG1' ' A' ' 41' ' ' VAL . 31.0 p -64.68 -27.89 69.23 Favored 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.407 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.842 HD12 ' HB3' ' A' ' 62' ' ' LEU . 41.6 mm -56.43 108.15 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.471 178.724 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.423 ' N ' ' O ' ' A' ' 63' ' ' ILE . 50.5 t0 -48.74 -34.03 11.37 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.807 0.337 . . . . 0.0 111.143 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.414 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 2.3 pttt -172.56 165.02 5.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.853 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.77 HD11 HD13 ' A' ' 104' ' ' LEU . 8.3 tp -109.03 119.19 38.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.76 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.411 ' HB2' ' HB3' ' A' ' 61' ' ' ARG . 3.8 mt-30 -115.72 147.13 41.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.413 179.46 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.668 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.03 149.11 22.83 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.79 -0.187 . . . . 0.0 110.969 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.1 p . . . . . 0 CA--C 1.53 0.18 0 CA-C-O 120.628 0.251 . . . . 0.0 110.819 -179.968 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.799 0.333 . . . . 0.0 110.504 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.44 ' O ' HD23 ' A' ' 60' ' ' LEU . 46.2 mtm -149.6 143.03 25.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.755 -179.253 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.668 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 24.8 mt -121.78 145.19 48.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.205 178.794 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.442 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 14.8 ttm-85 -140.29 150.71 44.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.937 0.399 . . . . 0.0 111.6 -179.373 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.842 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.4 mp -128.07 117.75 22.22 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.958 178.778 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.46 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 21.4 mm -76.54 156.51 5.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.857 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.415 ' N ' HG22 ' A' ' 63' ' ' ILE . . . . . . . . 0 N--CA 1.452 -0.288 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.614 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.48 HG22 ' N ' ' A' ' 67' ' ' ASP . 11.7 p . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.854 0.359 . . . . 0.0 111.287 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.48 ' N ' HG22 ' A' ' 66' ' ' VAL . 3.0 m-20 -98.06 48.16 1.0 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.806 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.38 -20.41 54.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.262 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.0 m -59.33 -21.45 59.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.163 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.7 mmmt -72.82 -67.66 0.54 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.856 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.506 ' HA ' HG23 ' A' ' 81' ' ' VAL . 11.5 mttm 62.12 94.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.767 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.58 170.29 8.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.839 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -133.01 -166.7 1.8 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.737 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -138.32 -170.16 2.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.993 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.78 -21.28 55.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.303 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -110.25 29.09 7.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.01 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.63 26.17 38.14 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.639 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -62.44 -164.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.798 0.332 . . . . 0.0 110.934 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -133.45 115.41 14.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.581 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 90.1 t -86.98 -61.16 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.558 -179.667 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.676 ' O ' HG12 ' A' ' 81' ' ' VAL . 0.9 OUTLIER 40.85 95.98 0.04 OUTLIER Pre-proline 0 CA--C 1.536 0.414 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.128 179.904 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.499 ' HD2' ' HA ' ' A' ' 81' ' ' VAL . 9.6 Cg_endo -52.05 139.08 52.66 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.599 2.199 . . . . 0.0 112.398 -179.301 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.4 mmmm -69.09 155.97 92.49 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.946 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.42 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 2.3 Cg_endo . . . . . 0 N--CA 1.459 -0.534 0 C-N-CA 123.528 2.818 . . . . 0.0 112.444 -179.171 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.42 ' HG3' HG23 ' A' ' 63' ' ' ILE . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.509 0.195 . . . . 0.0 110.815 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.53 ' CE1' HG22 ' A' ' 40' ' ' VAL . 24.0 m80 -94.05 111.42 23.14 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 179.423 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.25 110.97 22.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.993 0.425 . . . . 0.0 111.241 -179.282 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.845 ' CD1' HD11 ' A' ' 16' ' ' ILE . 96.2 m-85 -115.16 116.6 28.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.537 179.755 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.63 114.53 28.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.637 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.467 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 3.7 m-85 -94.35 137.27 33.71 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.077 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -94.0 41.06 1.08 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.707 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.612 ' HB3' HG23 ' A' ' 96' ' ' VAL . 1.6 m-20 177.97 115.41 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.333 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.425 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -58.2 -16.47 13.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.829 179.721 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -73.19 -45.31 57.1 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-O 121.099 0.476 . . . . 0.0 110.12 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.612 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -65.24 -49.93 76.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.42 179.031 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.425 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -62.69 -36.24 82.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.49 179.523 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -70.43 -35.01 73.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.076 0.465 . . . . 0.0 110.191 179.528 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.404 ' O ' ' OG1' ' A' ' 103' ' ' THR . 15.3 m120 -81.75 -27.48 33.79 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.468 179.418 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.534 HD11 ' N ' ' A' ' 5' ' ' GLY . 1.3 mm -86.21 -59.19 2.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.959 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -43.98 -31.05 0.81 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.193 -179.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.416 ' HG3' ' N ' ' A' ' 103' ' ' THR . 19.8 ptp -77.83 -39.75 42.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.352 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.685 ' HB ' HD12 ' A' ' 18' ' ' ILE . 0.3 OUTLIER -60.13 -52.42 65.43 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.794 179.654 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.77 HD13 HD11 ' A' ' 48' ' ' LEU . 9.5 mt -51.5 -59.45 4.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.369 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.41 ' HA ' HG13 ' A' ' 108' ' ' ILE . 7.3 pt20 -60.49 -34.26 73.8 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.87 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -56.09 -36.22 67.89 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.232 0.539 . . . . 0.0 109.856 179.208 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.031 HG22 ' HE1' ' A' ' 111' ' ' TYR . 8.3 mt -85.76 -50.61 14.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.367 179.104 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.679 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.13 -56.4 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.427 179.433 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -46.26 -28.23 1.23 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.047 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.468 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 29.2 mtt180 -72.77 -25.04 61.03 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.346 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 1.031 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -76.34 -35.12 58.91 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 179.884 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.735 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.17 -44.01 18.5 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 178.954 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 54.7 t0 -61.87 -31.24 71.5 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 113.822 -1.535 . . . . 0.0 109.148 178.309 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.468 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.417 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.85 178.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.442 ' NE2' ' HB2' ' A' ' 20' ' ' GLU . 22.3 m170 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.613 0.244 . . . . 0.0 110.934 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.577 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 2.6 p -158.49 156.15 29.75 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.205 0.526 . . . . 0.0 111.295 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.493 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 172.75 139.44 2.85 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 110.898 -0.881 . . . . 0.0 110.898 -179.58 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.544 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -84.0 143.17 29.96 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.506 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.621 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . . . -152.46 171.15 18.52 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.079 -179.414 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.654 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.67 126.48 56.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-O 120.786 0.327 . . . . 0.0 111.715 -179.613 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.537 ' CE1' ' CE1' ' A' ' 38' ' ' HIS . 6.6 t80 -126.63 109.81 12.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.917 0.389 . . . . 0.0 111.128 178.388 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 3.8 mm-40 67.73 50.43 0.87 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.828 179.214 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.1 mttt 69.23 -3.42 1.55 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 179.365 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.493 ' O ' HG23 ' A' ' 8' ' ' ILE . 17.0 t -101.38 148.58 7.13 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 CA-C-O 121.097 0.475 . . . . 0.0 110.564 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.451 ' HA ' HD12 ' A' ' 8' ' ' ILE . 73.0 p -111.12 114.62 28.01 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.024 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.893 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -134.18 -133.99 3.38 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.953 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.893 HD13 ' O ' ' A' ' 14' ' ' GLY . 18.8 mm -136.35 136.49 48.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.683 0.278 . . . . 0.0 111.34 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.94 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.84 141.47 17.5 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.63 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 176.436 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.577 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.4 118.39 5.86 Favored 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.534 -178.608 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.935 HD13 HG22 ' A' ' 103' ' ' THR . 4.8 mt -85.33 142.73 12.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 114.537 -1.21 . . . . 0.0 111.796 -178.696 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.619 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -121.65 93.07 3.89 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.419 179.596 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.442 ' HB2' ' NE2' ' A' ' 3' ' ' HIS . 0.1 OUTLIER -81.19 1.09 33.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.532 -179.777 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -81.86 0.47 39.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.122 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.619 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -101.75 -161.99 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.801 0.334 . . . . 0.0 110.838 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.41 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 15.6 p -175.24 100.93 0.26 Allowed Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.455 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.442 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 10.5 Cg_exo -70.11 166.04 76.04 Favored 'Cis proline' 0 C--N 1.347 0.471 0 C-N-CA 123.55 -1.437 . . . . 0.0 112.512 0.296 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.459 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -60.04 176.99 0.27 Allowed 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.248 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.523 ' HG2' HG21 ' A' ' 22' ' ' VAL . 6.9 pt-20 -163.78 138.19 5.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.141 179.177 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.823 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.76 149.05 28.66 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.874 -0.788 . . . . 0.0 108.874 178.86 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.792 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.3 m -133.84 112.58 11.44 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -178.272 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.538 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 76.8 t90 -92.11 110.68 22.06 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.258 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.411 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.1 ptp180 -112.13 133.44 54.27 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.718 0.294 . . . . 0.0 110.761 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 25.4 m -49.82 161.02 0.26 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.593 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.407 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 53.5 m -74.22 -37.78 63.75 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.404 0.621 . . . . 0.0 109.659 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.72 -17.29 41.76 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.041 179.548 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.81 33.74 10.83 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.367 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -83.83 -27.85 28.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.714 0.292 . . . . 0.0 111.258 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.96 161.49 5.72 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.283 0.564 . . . . 0.0 111.348 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.792 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.69 140.82 22.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.036 -178.709 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.537 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 65.4 m80 -114.58 121.25 42.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.683 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.482 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.54 140.94 30.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.842 -179.856 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.567 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -127.79 140.47 49.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.329 -179.673 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.439 ' O ' HG12 ' A' ' 45' ' ' ILE . 41.1 t -103.95 95.94 4.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 177.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.771 HD11 HD22 ' A' ' 104' ' ' LEU . 0.7 OUTLIER -42.27 -23.83 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.972 -178.955 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.442 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -76.42 -48.32 20.13 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.255 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.411 HG23 ' CG1' ' A' ' 41' ' ' VAL . 38.9 p -64.53 -27.89 69.28 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 178.506 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.826 HD12 ' HB3' ' A' ' 62' ' ' LEU . 48.4 mm -56.9 108.49 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.582 178.73 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.414 ' N ' ' O ' ' A' ' 63' ' ' ILE . 8.3 t70 -51.93 -33.77 38.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.871 0.367 . . . . 0.0 110.819 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.422 ' HG3' HG12 ' A' ' 63' ' ' ILE . 13.8 pttt -171.23 165.04 7.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.703 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.725 HD11 HD13 ' A' ' 104' ' ' LEU . 16.6 tp -108.82 122.47 47.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.85 -179.554 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -115.49 141.56 47.89 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.473 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.658 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.06 141.15 16.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.075 -179.739 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.562 HG23 ' HB2' ' A' ' 59' ' ' MET . 44.6 p . . . . . 0 CA--C 1.53 0.174 0 CA-C-N 116.607 -0.27 . . . . 0.0 111.09 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.439 ' HE2' ' H ' ' A' ' 94' ' ' ARG . 1.3 mpt? . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.722 0.296 . . . . 0.0 110.857 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.562 ' HB2' HG23 ' A' ' 51' ' ' THR . 3.1 mpp? -149.88 138.52 20.81 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.93 0.395 . . . . 0.0 111.996 -179.517 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.661 HD12 ' CZ ' ' A' ' 91' ' ' PHE . 15.5 mt -120.0 140.73 50.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.615 178.246 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.464 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 13.0 ttm180 -143.38 151.67 40.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.032 0.444 . . . . 0.0 112.126 -178.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.826 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -128.52 117.63 21.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.95 178.491 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.479 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 14.2 mm -76.66 156.43 5.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.718 -0.219 . . . . 0.0 110.805 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.425 ' O ' ' HB2' ' A' ' 84' ' ' PRO . . . . . . . . 0 N--CA 1.452 -0.243 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.531 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.444 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 9.8 p . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.584 0.23 . . . . 0.0 110.771 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.444 ' N ' HG22 ' A' ' 66' ' ' VAL . 12.4 t70 -132.75 36.92 3.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.741 0.305 . . . . 0.0 111.44 -179.654 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 43.08 29.89 0.23 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.323 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 36.3 m -94.26 -28.15 15.76 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.974 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.6 mmtm -57.06 -79.88 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.708 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.0 mtpt 55.37 89.82 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.2 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.419 ' HG2' ' HG3' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -116.77 121.19 40.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.589 179.644 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -74.39 150.59 39.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.068 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -97.58 -166.19 1.35 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.833 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -65.72 -15.44 62.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.346 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -113.11 14.22 19.47 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.685 -0.234 . . . . 0.0 111.399 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.91 40.46 72.73 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.501 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -84.65 3.09 38.66 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.844 0.312 . . . . 0.0 111.844 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 79' ' ' GLU . 10.3 pt-20 42.24 97.2 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.09 0.472 . . . . 0.0 112.022 179.533 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.465 HG12 ' N ' ' A' ' 81' ' ' VAL . 13.9 t -109.83 157.66 10.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.721 -179.687 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.465 ' N ' HG12 ' A' ' 80' ' ' VAL . 52.8 t -111.92 82.24 4.01 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.326 179.288 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.419 ' HG3' ' HG2' ' A' ' 72' ' ' ARG . 83.1 Cg_exo -42.1 149.49 0.29 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.933 2.422 . . . . 0.0 112.954 -179.56 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -46.1 168.61 0.11 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.521 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.444 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 8.1 Cg_exo . . . . . 0 N--CA 1.464 -0.223 0 C-N-CA 123.705 2.937 . . . . 0.0 112.403 -178.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.438 ' CG ' HD12 ' A' ' 63' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.602 0.239 . . . . 0.0 111.028 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.542 ' CE1' HG22 ' A' ' 40' ' ' VAL . 22.3 m80 -96.5 111.18 23.39 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.283 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.28 128.01 42.81 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.076 0.465 . . . . 0.0 111.637 -178.866 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.94 ' CD2' HD11 ' A' ' 16' ' ' ILE . 58.5 m-85 -132.15 116.57 17.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.481 179.408 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.459 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -91.61 115.04 27.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.953 0.406 . . . . 0.0 110.632 179.867 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.661 ' CZ ' HD12 ' A' ' 60' ' ' LEU . 2.8 m-85 -91.53 137.72 32.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.162 -179.522 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 22.5 m-20 -102.04 34.87 2.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.743 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.6 ' HB3' HG23 ' A' ' 96' ' ' VAL . 10.3 t30 179.14 123.42 0.05 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.943 -179.732 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.526 ' HA ' ' HG3' ' A' ' 97' ' ' MET . 2.8 mmm-85 -61.85 -14.41 33.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.547 179.157 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -71.72 -51.14 24.38 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 121.029 0.442 . . . . 0.0 110.352 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.6 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -56.94 -45.28 83.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.624 179.415 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.526 ' HG3' ' HA ' ' A' ' 94' ' ' ARG . 1.0 OUTLIER -57.14 -48.97 77.36 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.584 178.877 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.454 ' O ' ' HE2' ' A' ' 102' ' ' MET . 12.1 t70 -52.87 -32.94 47.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.378 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -82.52 -57.07 3.51 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.09 179.504 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.546 HD12 ' CG2' ' A' ' 16' ' ' ILE . 11.3 mm -65.08 -60.45 2.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.958 -179.247 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 5.6 ttmt -50.18 -37.84 36.87 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.493 -178.861 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.454 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 14.4 mtm -80.04 -27.16 39.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.037 -179.663 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.935 HG22 HD13 ' A' ' 18' ' ' ILE . 1.0 OUTLIER -81.75 -31.71 31.83 Favored 'General case' 0 N--CA 1.443 -0.793 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 179.811 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.771 HD22 HD11 ' A' ' 42' ' ' LEU . 45.2 mt -65.1 -57.45 8.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.882 179.068 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.411 ' HA ' HG13 ' A' ' 108' ' ' ILE . 4.8 pt20 -63.43 -34.06 76.92 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.932 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -52.31 -36.78 54.1 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.348 0.594 . . . . 0.0 109.829 179.332 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.015 HG22 ' HE1' ' A' ' 111' ' ' TYR . 12.1 mt -85.84 -51.71 12.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.049 178.911 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.661 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.63 -57.54 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.326 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.259 179.17 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 10.9 m -47.49 -26.29 1.34 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.027 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.451 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 73.5 mtt180 -73.64 -25.04 60.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.265 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 1.015 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -75.49 -34.9 60.9 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.734 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.747 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.47 -43.31 17.38 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 178.923 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -61.45 -31.54 71.5 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.875 -1.511 . . . . 0.0 109.092 178.15 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.451 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.44 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.611 178.714 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.454 ' O ' ' N ' ' A' ' 18' ' ' ILE . 30.6 m170 . . . . . 0 CA--C 1.53 0.193 0 N-CA-C 111.381 0.141 . . . . 0.0 111.381 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.487 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 2.0 p -143.73 158.4 43.7 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.982 0.42 . . . . 0.0 111.011 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.505 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 172.26 141.58 3.46 Favored Glycine 0 C--O 1.225 -0.435 0 N-CA-C 110.909 -0.876 . . . . 0.0 110.909 -179.467 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.547 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -84.87 147.06 26.98 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.639 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.589 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -156.14 171.13 20.69 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.202 -179.14 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.681 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.93 122.98 54.81 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 N-CA-C 111.817 0.302 . . . . 0.0 111.817 -179.556 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.468 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 5.7 t80 -121.86 108.65 13.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.983 0.421 . . . . 0.0 111.111 178.411 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 61.0 mt-10 67.43 48.95 1.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.911 179.016 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.7 mttm 73.28 -5.31 1.99 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 179.164 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.469 ' O ' HG23 ' A' ' 8' ' ' ILE . 18.6 t -101.13 148.67 6.9 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.514 0 CA-C-O 121.114 0.483 . . . . 0.0 110.534 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.435 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -111.76 112.71 24.59 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.067 179.87 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.885 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.57 -132.31 3.35 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.933 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.885 HD13 ' O ' ' A' ' 14' ' ' GLY . 17.8 mm -136.64 136.4 48.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.708 0.289 . . . . 0.0 111.345 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.913 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.86 140.95 18.47 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 N-CA-C 106.246 -1.761 . . . . 0.0 106.246 176.56 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ALA . . . . . 0.487 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.6 118.18 5.72 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.565 -0.854 . . . . 0.0 111.695 -178.454 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.536 HD12 ' HB ' ' A' ' 103' ' ' THR . 48.3 mt -84.06 142.94 12.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 114.623 -1.171 . . . . 0.0 112.155 -178.799 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.765 ' ND2' HG22 ' A' ' 22' ' ' VAL . 30.4 t30 -118.84 92.52 3.83 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.653 178.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -82.85 0.67 42.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.601 -179.226 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -82.53 1.57 37.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.76 0.314 . . . . 0.0 111.066 179.655 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.765 HG22 ' ND2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -106.05 -163.03 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.825 -179.779 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.413 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.4 t -175.31 102.9 0.26 Allowed Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.32 179.669 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.45 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 9.4 Cg_exo -70.5 161.71 87.76 Favored 'Cis proline' 0 C--N 1.347 0.46 0 C-N-CA 123.614 -1.411 . . . . 0.0 112.678 0.348 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.443 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -57.4 179.4 0.05 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.403 179.684 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.517 ' CG ' HG21 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -163.58 135.89 5.13 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.174 179.091 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.829 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.92 138.42 44.19 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.958 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.8 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.0 OUTLIER -123.14 112.31 17.57 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -178.263 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.543 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 77.9 t90 -91.97 110.7 22.06 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 178.328 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' A' ' 15' ' ' ILE . 8.4 ptm180 -112.25 132.87 54.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.751 0.31 . . . . 0.0 110.916 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.408 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 8.4 t -50.02 161.71 0.24 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.692 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 54.6 m -75.38 -37.81 60.36 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.322 0.582 . . . . 0.0 109.759 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -83.4 -16.06 47.36 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.125 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.66 34.34 11.74 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.303 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -85.28 -26.37 26.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.717 0.294 . . . . 0.0 111.398 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.36 162.11 5.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.327 0.584 . . . . 0.0 111.449 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.8 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.9 OUTLIER -145.65 140.45 21.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.811 -178.826 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 14.9 m80 -116.2 120.58 39.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.785 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.483 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.45 135.62 38.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.851 -179.913 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.562 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -122.76 140.74 45.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.349 -179.527 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.445 ' O ' HG12 ' A' ' 45' ' ' ILE . 21.4 t -103.98 95.45 3.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 177.777 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.674 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.7 OUTLIER -41.95 -23.76 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.882 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.45 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -76.97 -48.64 17.47 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.344 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.433 HG23 ' HB ' ' A' ' 41' ' ' VAL . 33.5 p -64.61 -26.82 68.56 Favored 'General case' 0 N--CA 1.441 -0.875 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 178.621 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.85 HD12 ' HB3' ' A' ' 62' ' ' LEU . 48.0 mm -56.57 108.66 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.602 178.875 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.426 ' N ' ' O ' ' A' ' 63' ' ' ILE . 3.7 t0 -53.32 -30.97 41.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.808 0.337 . . . . 0.0 111.011 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.423 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 5.1 ptpt -172.55 162.99 5.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.02 0.438 . . . . 0.0 110.878 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.911 HD11 HD13 ' A' ' 104' ' ' LEU . 12.0 tp -109.03 116.47 32.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.619 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.41 ' HB2' ' HB3' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -111.85 146.59 37.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.589 0.233 . . . . 0.0 110.627 -179.972 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.684 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.05 148.57 22.28 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.116 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.601 HG23 ' HB2' ' A' ' 59' ' ' MET . 37.2 p . . . . . 0 C--N 1.332 -0.18 0 CA-C-O 120.676 0.274 . . . . 0.0 111.117 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.433 ' HB3' ' HG2' ' A' ' 97' ' ' MET . 2.4 mpp? . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.782 0.325 . . . . 0.0 111.175 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.601 ' HB2' HG23 ' A' ' 51' ' ' THR . 53.7 mtm -149.91 142.35 24.35 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.999 0.428 . . . . 0.0 111.716 -179.699 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.684 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 20.6 mt -122.07 143.46 49.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.155 178.834 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.426 ' HG3' ' O ' ' A' ' 87' ' ' HIS . 53.3 ttp180 -143.61 152.71 41.72 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 -178.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.85 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.3 mp -127.95 116.24 19.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.637 178.458 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.585 HG23 ' HG2' ' A' ' 86' ' ' ARG . 23.2 mm -76.54 156.68 5.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.701 0.286 . . . . 0.0 111.38 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.444 ' N ' HG22 ' A' ' 63' ' ' ILE . . . . . . . . 0 N--CA 1.452 -0.274 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.301 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.524 HG22 ' N ' ' A' ' 67' ' ' ASP . 13.5 p . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.824 0.345 . . . . 0.0 111.141 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.524 ' N ' HG22 ' A' ' 66' ' ' VAL . 0.4 OUTLIER -105.62 66.53 0.74 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.689 179.718 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -64.13 -16.2 61.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.416 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.2 m -101.03 29.53 4.59 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.767 0.318 . . . . 0.0 110.858 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.9 mmmt -115.21 -63.15 1.5 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.905 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.8 mttm 61.63 95.36 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.53 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.42 124.74 47.58 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.129 -179.685 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.1 mmtt -80.12 170.26 16.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.878 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -122.58 -172.16 2.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.879 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -68.01 -21.27 65.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.163 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -100.88 27.64 5.83 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.002 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.42 26.48 51.61 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.632 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 19.4 m-20 -93.59 115.16 27.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.815 0.341 . . . . 0.0 110.907 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -76.11 115.15 15.54 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.729 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.42 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 13.8 t -115.46 120.08 63.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.748 -179.571 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.703 ' O ' HG13 ' A' ' 81' ' ' VAL . 11.6 p -101.66 96.76 6.8 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.973 179.052 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.42 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 67.8 Cg_exo -36.26 151.34 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.068 2.512 . . . . 0.0 113.257 -178.875 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.0 mttp -104.36 169.63 7.01 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.131 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.485 ' HG3' HG11 ' A' ' 66' ' ' VAL . 2.8 Cg_exo . . . . . 0 N--CA 1.461 -0.408 0 C-N-CA 123.694 2.929 . . . . 0.0 112.259 -178.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.585 ' HG2' HG23 ' A' ' 63' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.637 0.256 . . . . 0.0 110.495 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.473 ' CE1' HG22 ' A' ' 40' ' ' VAL . 3.9 m80 -95.39 111.0 22.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.798 0.332 . . . . 0.0 110.318 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -101.37 141.79 33.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.357 -179.369 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.913 ' CD2' HD11 ' A' ' 16' ' ' ILE . 5.1 m-85 -140.96 116.93 10.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.063 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.443 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -87.01 115.29 24.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.417 179.566 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.445 ' CE1' ' HB2' ' A' ' 7' ' ' ALA . 8.9 m-85 -89.12 134.67 33.92 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.398 -179.583 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 22.4 m-20 -98.75 28.87 4.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.467 179.499 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.429 ' CB ' HG23 ' A' ' 96' ' ' VAL . 7.4 m-20 -175.47 114.32 0.14 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.555 -179.734 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.49 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.1 OUTLIER -56.52 -17.63 9.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.997 179.767 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -72.3 -50.32 27.9 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 120.887 0.375 . . . . 0.0 110.43 179.745 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.429 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -65.88 -41.95 91.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.675 179.241 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.49 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -66.74 -37.82 85.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.927 179.317 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.463 ' N ' ' HG3' ' A' ' 97' ' ' MET . 29.2 t70 -62.61 -29.48 70.63 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.858 178.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.434 ' O ' ' OG1' ' A' ' 103' ' ' THR . 9.0 m-80 -81.9 -65.58 0.99 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.363 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.575 HG22 HD11 ' A' ' 104' ' ' LEU . 15.2 mm -46.53 -56.29 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 CA-C-O 121.148 0.499 . . . . 0.0 110.763 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.576 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 17.5 ttpp -48.07 -42.43 28.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.982 179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.492 ' HG2' ' N ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -75.18 -39.4 60.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.332 179.903 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.536 ' HB ' HD12 ' A' ' 18' ' ' ILE . 0.2 OUTLIER -60.0 -50.73 72.61 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.815 179.785 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.911 HD13 HD11 ' A' ' 48' ' ' LEU . 6.4 mt -53.36 -59.07 5.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.258 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -60.22 -33.66 72.57 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.654 179.524 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -56.4 -36.48 68.95 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 121.338 0.59 . . . . 0.0 109.44 178.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 1.022 HG22 ' HE1' ' A' ' 111' ' ' TYR . 6.9 mt -85.79 -51.65 13.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.002 178.756 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.667 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.38 -57.41 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.138 179.187 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 75.4 m -47.09 -26.03 0.99 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.162 179.783 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.449 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 71.0 mtt-85 -74.26 -25.05 59.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.146 179.744 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 1.022 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -75.85 -35.09 60.05 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.875 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.743 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.18 -43.69 18.96 Favored 'General case' 0 CA--C 1.506 -0.744 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 179.027 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -61.78 -31.33 71.52 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 113.862 -1.517 . . . . 0.0 109.064 178.18 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.449 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.457 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.64 178.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo . . . . . 0 N--CA 1.49 1.276 0 CA-C-O 121.17 0.404 . . . . 0.0 111.973 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.518 ' O ' HG21 ' A' ' 103' ' ' THR . 14.4 m -60.75 -31.36 70.7 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.901 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.518 ' HA ' HG21 ' A' ' 103' ' ' THR . 33.8 m80 -92.6 28.16 2.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.164 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.534 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 11.3 p -161.2 152.24 18.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.281 0.563 . . . . 0.0 111.111 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.432 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 173.95 137.76 2.51 Favored Glycine 0 N--CA 1.448 -0.509 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.566 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -80.86 145.47 31.35 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -178.539 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.579 ' C ' HD13 ' A' ' 8' ' ' ILE . . . -151.98 171.18 18.23 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.358 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.672 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -103.54 122.01 55.63 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.652 -179.668 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.472 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 4.6 t80 -120.75 106.98 12.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.877 0.37 . . . . 0.0 111.201 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.447 ' HG2' ' CD1' ' A' ' 9' ' ' PHE . 41.9 mm-40 67.98 49.09 0.92 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.864 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.4 mttp 72.25 -3.76 2.2 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.459 ' O ' HG23 ' A' ' 8' ' ' ILE . 19.9 t -101.21 150.3 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 CA-C-O 121.074 0.464 . . . . 0.0 110.458 179.563 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.427 ' HA ' HD12 ' A' ' 8' ' ' ILE . 95.8 p -107.12 114.86 29.18 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.877 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.517 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -134.0 -155.98 7.77 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.028 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.566 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 16.6 mm -122.83 131.96 72.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.872 0.367 . . . . 0.0 111.375 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.917 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.4 OUTLIER -100.94 113.67 37.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 177.752 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.534 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -122.18 116.61 24.48 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.553 0.692 . . . . 0.0 110.854 -179.177 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.477 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 17.5 mt -82.63 142.53 13.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 114.721 -1.127 . . . . 0.0 112.338 -178.209 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.594 ' O ' HG23 ' A' ' 22' ' ' VAL . 2.4 m120 -117.4 92.84 3.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.026 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.402 ' HB2' ' CD2' ' A' ' 3' ' ' HIS . 0.1 OUTLIER -82.64 -0.3 46.51 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.353 -179.733 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -83.38 1.3 42.02 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.442 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.594 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -100.87 -162.56 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.908 0.385 . . . . 0.0 110.988 -179.998 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 t -177.98 101.05 0.22 Allowed Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.168 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.403 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 15.7 Cg_exo -66.34 161.62 73.7 Favored 'Cis proline' 0 C--N 1.346 0.408 0 C-N-CA 123.46 -1.475 . . . . 0.0 112.608 0.373 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.727 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -55.29 -172.38 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.872 179.472 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -163.27 142.15 8.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.486 0.66 . . . . 0.0 112.352 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.704 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 3.0 tt -108.37 149.13 29.12 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.829 -1.078 . . . . 0.0 108.744 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.57 HG23 HG23 ' A' ' 39' ' ' THR . 0.6 OUTLIER -146.35 104.11 3.76 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -178.798 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.489 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 83.3 t90 -92.06 110.54 21.91 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.777 178.356 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.474 ' O ' ' N ' ' A' ' 15' ' ' ILE . 42.8 ttt180 -109.66 131.18 55.3 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.777 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.3 t -49.85 155.99 0.79 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.688 0.28 . . . . 0.0 110.597 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.6 m -74.08 -34.63 64.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.317 0.579 . . . . 0.0 109.843 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -87.12 -16.58 35.07 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.054 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.78 33.75 10.86 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.333 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -86.9 -25.02 24.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.673 0.273 . . . . 0.0 111.476 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.17 164.22 2.7 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.285 0.564 . . . . 0.0 111.491 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.489 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.7 OUTLIER -145.64 147.93 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.961 -178.851 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.428 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 58.2 m80 -122.72 120.76 34.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.654 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.57 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.46 145.06 26.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.77 -179.884 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.704 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.1 t -128.49 139.03 52.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.624 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.438 ' O ' HG12 ' A' ' 45' ' ' ILE . 23.0 t -104.0 94.22 3.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 177.483 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.493 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.6 OUTLIER -42.22 -22.85 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.212 -0.449 . . . . 0.0 112.027 -178.783 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.403 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -76.79 -49.75 15.12 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.954 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.415 HG23 ' HB ' ' A' ' 41' ' ' VAL . 30.2 p -64.94 -28.22 69.38 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 178.599 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.895 HD12 ' HB3' ' A' ' 62' ' ' LEU . 31.3 mm -56.4 105.73 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.548 178.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -51.8 -31.72 28.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.188 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.451 ' HG3' HG12 ' A' ' 63' ' ' ILE . 3.2 pttt -172.61 166.94 5.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.574 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 1.069 HD23 HG21 ' B' ' 673' ' ' VAL . 11.9 tp -109.0 121.87 46.06 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.047 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.911 ' HG3' HD11 ' A' ' 63' ' ' ILE . 25.2 mm100 -110.41 138.34 46.93 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.289 179.495 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.716 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -156.85 140.27 15.75 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.61 0.243 . . . . 0.0 111.05 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.545 HG23 ' HB2' ' A' ' 59' ' ' MET . 33.5 p -50.16 140.36 17.05 Favored Pre-proline 0 CA--C 1.53 0.184 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.895 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -65.37 163.21 30.36 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.598 2.198 . . . . 0.0 112.53 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -71.63 -30.59 65.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.194 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.3 p -70.61 -21.86 62.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.913 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 70.0 m -97.03 119.17 35.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.868 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 21.0 mp0 -55.26 -18.99 7.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.499 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -55.17 125.51 20.91 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.894 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.4 ' HE3' ' HB2' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -109.51 93.3 4.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.732 -179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.545 ' HB2' HG23 ' A' ' 51' ' ' THR . 3.5 mpp? -149.64 138.65 21.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.656 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.716 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 39.0 mt -124.8 149.83 46.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.29 178.653 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.441 ' HD2' ' CE2' ' B' ' 670' ' ' PHE . 11.0 mtp180 -151.02 156.0 40.22 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.938 0.399 . . . . 0.0 111.604 -179.533 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.895 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -127.9 118.72 24.15 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.106 178.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.911 HD11 ' HG3' ' A' ' 49' ' ' GLN . 6.6 mm -77.29 153.93 5.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.775 0.321 . . . . 0.0 111.049 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -118.49 138.6 13.87 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.494 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.8 ptpm? -57.09 122.61 12.79 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.875 0.369 . . . . 0.0 110.903 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.489 HG22 ' N ' ' A' ' 67' ' ' ASP . 13.3 p -99.93 159.76 3.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.417 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.489 ' N ' HG22 ' A' ' 66' ' ' VAL . 4.2 m-20 -99.9 47.45 0.94 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.588 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -68.32 -11.39 59.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.478 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.3 m -53.98 -25.1 19.2 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.853 0.358 . . . . 0.0 111.087 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 42.3 mmtt -77.17 -70.18 0.48 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.668 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.9 ptmt 42.63 81.43 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.363 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.403 ' CD ' ' N ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -145.47 -174.16 4.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.052 -179.945 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 78' ' ' ASN . 6.2 mptt -102.8 -171.29 1.93 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.959 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -113.94 -36.51 4.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.017 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 167.89 -30.3 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.149 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -97.02 29.21 3.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.238 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 61.72 16.9 52.82 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.841 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.443 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 15.5 m-20 -67.2 -152.61 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.401 ' HG2' HG12 ' A' ' 81' ' ' VAL . 2.5 tt0 -153.28 118.97 5.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.769 0.319 . . . . 0.0 110.826 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.2 t -94.38 -66.9 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.439 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.455 ' O ' HG13 ' A' ' 81' ' ' VAL . 5.0 p 33.15 80.2 0.26 Allowed Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.639 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -41.66 124.56 2.6 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 123.005 2.47 . . . . 0.0 112.844 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 31.4 mttt -73.21 159.9 83.94 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.908 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.422 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.3 Cg_exo -83.26 149.77 13.41 Favored 'Trans proline' 0 N--CA 1.46 -0.484 0 C-N-CA 123.52 2.814 . . . . 0.0 112.384 -179.045 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -112.83 115.93 29.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.916 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -123.11 137.53 54.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.768 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.465 ' CE1' HG22 ' A' ' 40' ' ' VAL . 4.9 m80 -92.04 111.57 23.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.401 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 12.2 ttt -98.99 134.26 42.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.148 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.917 ' CD2' HD11 ' A' ' 16' ' ' ILE . 2.7 m-85 -136.04 122.36 20.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.792 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.8 114.28 26.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.884 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.546 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 11.1 m-85 -91.35 145.18 24.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.88 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -99.24 34.83 2.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.605 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.674 ' HB3' HG23 ' A' ' 96' ' ' VAL . 1.1 m-20 -178.99 118.06 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.609 -179.684 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.423 ' HA ' ' CG ' ' A' ' 97' ' ' MET . 0.7 OUTLIER -60.06 -15.38 22.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.691 179.477 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.13 -43.07 58.88 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.066 0.46 . . . . 0.0 110.024 179.555 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.674 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -65.93 -51.76 57.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.295 179.061 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.423 ' CG ' ' HA ' ' A' ' 94' ' ' ARG . 0.5 OUTLIER -61.49 -36.32 80.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.285 179.372 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.406 ' HB2' ' O ' ' A' ' 94' ' ' ARG . 8.2 t70 -66.59 -34.23 77.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.112 0.482 . . . . 0.0 110.086 179.36 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.418 ' O ' ' OG1' ' A' ' 103' ' ' THR . 53.4 m-20 -81.82 -26.43 34.34 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.531 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.464 HD12 ' CG2' ' A' ' 16' ' ' ILE . 2.2 mm -86.15 -59.79 2.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.088 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.468 ' CG ' HG11 ' B' ' 673' ' ' VAL . 9.9 ttmt -44.51 -30.32 0.86 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.168 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.424 ' HG3' ' N ' ' A' ' 103' ' ' THR . 19.8 ptp -78.86 -39.29 35.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.326 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.518 HG21 ' O ' ' A' ' 2' ' ' SER . 0.3 OUTLIER -58.4 -60.07 4.36 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.846 179.737 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 1.06 HD13 HD11 ' A' ' 48' ' ' LEU . 2.7 mt -48.0 -57.43 5.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.912 179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.507 HE22 ' HD2' ' B' ' 674' ' ' PRO . 1.4 mt-30 -57.13 -41.43 79.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.969 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -54.67 -35.04 63.14 Favored 'General case' 0 C--O 1.231 0.132 0 CA-C-O 121.165 0.507 . . . . 0.0 110.337 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.04 HG22 ' HE1' ' A' ' 111' ' ' TYR . 11.9 mt -85.74 -51.03 13.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.468 179.445 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.656 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -42.45 -58.13 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.486 179.356 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -47.13 -27.52 1.44 Allowed 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.296 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.463 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 0.0 OUTLIER -73.38 -24.67 60.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.001 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 1.04 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -74.59 -34.96 62.98 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.425 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.765 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.63 -43.32 17.11 Favored 'General case' 0 CA--C 1.504 -0.804 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 179.38 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.404 ' HB2' ' HA ' ' A' ' 110' ' ' ARG . 1.2 m-20 -62.31 -32.06 72.75 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 113.973 -1.467 . . . . 0.0 108.99 178.193 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.463 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.69 -18.16 23.34 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.64 178.588 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 36.1 t0 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.236 -0.888 . . . . 0.0 111.127 179.914 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 36.2 t70 . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.858 0.361 . . . . 0.0 111.17 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -115.09 -38.38 3.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.906 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -177.36 95.67 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.929 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 664' ' ' VAL . . . . . 0.545 ' O ' HG13 ' B' ' 664' ' ' VAL . 11.0 p -142.64 59.89 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.045 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 665' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -132.26 -165.61 1.62 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.88 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 666' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -169.45 92.78 0.26 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.776 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 667' ' ' GLU . . . . . 0.445 ' HA ' ' CD1' ' B' ' 670' ' ' PHE . 0.3 OUTLIER -94.1 19.09 9.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.18 0.514 . . . . 0.0 111.641 -179.947 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -105.83 -19.96 13.59 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.248 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.583 ' O ' HD12 ' B' ' 669' ' ' LEU . 4.5 pp -100.28 19.9 15.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.311 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 670' ' ' PHE . . . . . 0.445 ' CD1' ' HA ' ' B' ' 667' ' ' GLU . 7.7 m-85 -78.75 140.63 38.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.861 0.362 . . . . 0.0 110.903 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -126.68 171.07 11.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.878 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 16.3 p-10 -104.14 131.93 50.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.918 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 673' ' ' VAL . . . . . 1.069 HG21 HD23 ' A' ' 48' ' ' LEU . 12.0 m -75.13 155.61 86.21 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.044 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 674' ' ' PRO . . . . . 0.507 ' HD2' HE22 ' A' ' 105' ' ' GLN . 57.1 Cg_endo -71.1 128.26 14.58 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.521 2.147 . . . . 0.0 112.605 -179.753 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.06 126.25 21.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.566 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 10.7 mttm -48.34 155.97 0.45 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.213 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 49.6 m 61.58 155.25 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.915 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 52.3 mm-40 -148.06 85.84 1.55 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.876 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 679' ' ' ILE . . . . . 0.579 HG22 ' O ' ' B' ' 679' ' ' ILE . 3.9 mt -95.75 43.28 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.051 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 1.8 t . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.926 179.97 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo . . . . . 0 N--CA 1.488 1.193 0 CA-C-O 120.794 0.247 . . . . 0.0 111.638 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.4 p -96.39 -37.55 10.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.88 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.5 m170 -92.97 12.81 22.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.221 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.575 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 49.7 p -156.3 152.85 28.18 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.193 0.52 . . . . 0.0 111.503 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.524 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . -174.91 179.93 45.9 Favored Glycine 0 N--CA 1.448 -0.562 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.521 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -120.6 129.27 53.68 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 117.738 0.769 . . . . 0.0 111.459 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.707 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -141.41 171.15 14.45 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.889 -178.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.652 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -100.61 121.92 51.98 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.018 179.853 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.47 ' HB2' ' CE2' ' A' ' 29' ' ' TRP . 0.7 OUTLIER -120.26 106.02 11.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.03 0.443 . . . . 0.0 111.86 179.531 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 68.16 52.71 0.65 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.562 178.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 71.19 -4.25 1.85 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.913 179.552 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.471 ' O ' HG23 ' A' ' 8' ' ' ILE . 25.2 t -103.52 148.56 8.34 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.566 0 CA-C-O 121.239 0.542 . . . . 0.0 110.527 179.535 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.481 ' HA ' HD12 ' A' ' 8' ' ' ILE . 1.0 OUTLIER -115.32 113.76 24.25 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.086 -179.962 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.855 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -133.63 -122.22 2.27 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.922 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.855 HD13 ' O ' ' A' ' 14' ' ' GLY . 18.7 mm -141.74 136.58 31.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.766 0.317 . . . . 0.0 111.146 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.913 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.82 141.76 16.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 106.301 -1.74 . . . . 0.0 106.301 176.543 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.575 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.32 115.73 5.09 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.393 -0.923 . . . . 0.0 111.55 -178.736 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.894 HD13 HG22 ' A' ' 103' ' ' THR . 5.0 mt -86.68 132.3 32.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.908 -178.52 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.595 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.5 t-20 -110.72 92.82 4.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.265 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -81.39 0.51 37.06 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.517 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -82.55 0.69 41.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.259 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.595 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -101.9 -162.93 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.885 0.374 . . . . 0.0 110.88 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.3 p -174.75 101.51 0.27 Allowed Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.333 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.463 ' HB3' ' HB3' ' A' ' 43' ' ' SER . 11.3 Cg_exo -69.52 166.34 73.67 Favored 'Cis proline' 0 C--N 1.347 0.474 0 C-N-CA 123.604 -1.415 . . . . 0.0 112.562 0.467 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.551 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -61.07 176.67 0.4 Allowed 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.143 179.805 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.476 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.78 135.07 4.65 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.24 179.326 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.791 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.96 129.43 55.11 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.88 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.791 HG22 ' CG2' ' A' ' 37' ' ' VAL . 0.3 OUTLIER -113.36 110.41 20.29 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -178.653 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.57 ' HD1' HG13 ' A' ' 16' ' ' ILE . 72.7 t90 -91.77 113.56 25.86 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.519 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.505 ' O ' ' N ' ' A' ' 15' ' ' ILE . 2.6 ptm180 -114.21 134.61 54.8 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.914 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.461 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 0.2 OUTLIER -49.9 168.5 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.47 179.868 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 54.8 m -76.98 -39.08 51.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.347 0.594 . . . . 0.0 109.903 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -84.85 -14.91 46.49 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.178 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.81 33.89 12.09 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.383 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -83.19 -29.84 28.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.752 0.311 . . . . 0.0 111.332 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.0 157.54 18.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.344 0.592 . . . . 0.0 111.349 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.791 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.9 OUTLIER -145.73 130.34 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.718 -178.823 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.461 ' CB ' ' CE2' ' A' ' 9' ' ' PHE . 2.7 m80 -107.71 122.76 47.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.944 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.659 HG23 HG23 ' A' ' 28' ' ' THR . 0.3 OUTLIER -96.51 129.83 43.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.794 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.559 HG22 ' CE1' ' A' ' 87' ' ' HIS . 1.0 OUTLIER -117.4 139.9 42.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.338 -179.649 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.749 HG12 ' OG ' ' A' ' 43' ' ' SER . 2.8 t -103.88 95.86 4.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 177.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.793 HD11 HD22 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -42.13 -24.8 0.05 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.062 -178.919 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.749 ' OG ' HG12 ' A' ' 41' ' ' VAL . 3.1 p -74.94 -48.75 22.87 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 179.236 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.474 HG23 ' HB ' ' A' ' 41' ' ' VAL . 44.9 p -64.71 -28.01 69.31 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.508 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.87 HD12 ' HB3' ' A' ' 62' ' ' LEU . 33.8 mm -57.15 105.69 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.533 178.584 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.474 ' N ' ' O ' ' A' ' 63' ' ' ILE . 2.6 t0 -47.87 -33.55 7.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.805 0.336 . . . . 0.0 111.071 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.415 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 0.2 OUTLIER -172.47 163.39 5.48 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.805 179.63 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.859 HD11 HD13 ' A' ' 104' ' ' LEU . 14.0 tp -109.11 124.85 51.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.01 -179.61 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.495 ' CD ' HD11 ' A' ' 63' ' ' ILE . 4.7 mt-30 -119.99 144.93 47.23 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.611 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.666 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.06 147.88 21.63 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.7 -0.227 . . . . 0.0 110.793 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.409 HG23 ' HB2' ' A' ' 59' ' ' MET . 71.2 p -75.04 146.19 82.0 Favored Pre-proline 0 C--N 1.333 -0.135 0 CA-C-O 120.741 0.305 . . . . 0.0 111.144 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.3 163.35 32.62 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.681 2.254 . . . . 0.0 112.446 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.518 ' HB1' ' NH1' ' A' ' 94' ' ' ARG . . . -54.47 -23.93 18.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.419 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.7 t -70.69 -16.17 62.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.416 -0.357 . . . . 0.0 111.214 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 11.7 m -73.86 121.44 20.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.902 0.382 . . . . 0.0 110.995 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -63.87 -11.29 26.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.696 179.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.682 ' HE2' HD11 ' B' ' 669' ' ' LEU . 0.0 OUTLIER -138.63 85.44 2.08 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.064 0.459 . . . . 0.0 111.174 179.825 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.423 ' HG2' ' HB2' ' A' ' 91' ' ' PHE . 1.0 OUTLIER -47.52 134.89 11.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.698 -179.812 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.426 ' HG3' ' O ' ' A' ' 57' ' ' LYS . 24.0 mtm -150.09 138.52 20.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.432 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.666 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 20.9 mt -117.8 142.19 47.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.225 178.566 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.443 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 13.8 ttm180 -142.51 150.01 39.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.984 0.421 . . . . 0.0 111.846 -179.399 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.87 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -128.4 117.32 21.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.949 178.527 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.861 HG23 ' HG2' ' A' ' 86' ' ' ARG . 10.3 mm -76.47 146.07 9.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.764 -179.686 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -108.7 148.59 16.86 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.386 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.5 mttt -58.01 114.74 2.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.873 0.368 . . . . 0.0 110.936 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.48 HG22 ' N ' ' A' ' 67' ' ' ASP . 13.2 p -102.41 159.93 4.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.258 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.48 ' N ' HG22 ' A' ' 66' ' ' VAL . 5.2 m-20 -101.13 39.39 1.41 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.772 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.41 -23.03 64.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.113 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.1 t -60.39 -20.41 59.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.105 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt -83.24 -67.32 0.8 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.867 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.437 ' HG3' HG23 ' A' ' 81' ' ' VAL . 28.3 mttt 60.17 92.35 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.764 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.74 -179.02 4.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.065 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.8 mttp -131.82 -167.2 1.83 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.708 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -136.86 -178.67 5.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.893 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -57.32 -22.09 39.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.408 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -108.73 34.8 3.48 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.855 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 55.22 25.22 39.23 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.558 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -67.42 -169.95 0.12 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.797 0.332 . . . . 0.0 110.903 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -136.62 122.01 19.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.637 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.6 t -91.1 -64.91 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.357 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.437 HG23 ' HG3' ' A' ' 71' ' ' LYS . 4.4 p 34.85 78.09 0.35 Allowed Pre-proline 0 CA--C 1.531 0.212 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.958 179.692 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -42.73 125.31 3.79 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 123.125 2.55 . . . . 0.0 112.648 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.402 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -60.59 161.42 14.53 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.076 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 5.0 Cg_exo -83.61 153.38 13.52 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 123.578 2.852 . . . . 0.0 112.363 -179.152 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -111.16 114.03 26.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.902 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.861 ' HG2' HG23 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -119.03 146.44 45.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.734 -179.951 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.559 ' CE1' HG22 ' A' ' 40' ' ' VAL . 19.4 m80 -96.87 112.56 24.26 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.458 ' HE2' ' CZ ' ' B' ' 670' ' ' PHE . 0.0 OUTLIER -94.09 119.17 32.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.97 0.414 . . . . 0.0 111.391 -179.236 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.913 ' CD1' HD11 ' A' ' 16' ' ' ILE . 89.7 m-85 -122.94 116.75 24.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.58 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.416 ' HB3' ' HB ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.52 114.57 28.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.785 0.326 . . . . 0.0 110.628 179.936 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.707 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 30.7 m-85 -93.5 152.63 18.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.371 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -110.39 28.47 8.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.603 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.458 ' CB ' HG23 ' A' ' 96' ' ' VAL . 9.0 m-20 -171.59 112.16 0.33 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.635 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.518 ' NH1' ' HB1' ' A' ' 53' ' ' ALA . 2.5 ttp85 -55.87 -19.48 11.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.911 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.22 -47.35 61.81 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.684 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.466 HG11 ' H ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -66.67 -46.1 86.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.959 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.451 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -63.27 -36.35 83.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.918 179.329 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.451 ' N ' ' HG3' ' A' ' 97' ' ' MET . 11.0 m-20 -62.6 -34.14 76.4 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.148 0.499 . . . . 0.0 110.047 179.19 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -81.84 -35.06 29.8 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.527 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.612 HG23 HD11 ' A' ' 18' ' ' ILE . 9.4 mm -76.45 -59.83 2.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.717 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.536 ' HD3' HG11 ' B' ' 673' ' ' VAL . 5.8 ttmt -51.62 -29.69 18.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.148 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.42 ' HG3' ' N ' ' A' ' 103' ' ' THR . 9.4 ptp -82.49 -37.98 24.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.92 -179.683 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.894 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -70.29 -42.09 72.52 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.018 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.859 HD13 HD11 ' A' ' 48' ' ' LEU . 28.4 mt -55.14 -52.1 64.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.016 0.436 . . . . 0.0 110.017 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.526 ' NE2' ' HB ' ' B' ' 673' ' ' VAL . 0.1 OUTLIER -61.41 -46.22 91.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.26 179.965 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 -47.06 -34.14 5.55 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.12 0.485 . . . . 0.0 110.864 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.047 HG22 ' HE1' ' A' ' 111' ' ' TYR . 12.3 mt -85.62 -52.27 12.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.264 179.304 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.755 HG21 HG21 ' B' ' 675' ' ' THR . 0.9 OUTLIER -42.48 -57.65 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.497 179.323 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -47.55 -26.06 1.32 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.347 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.455 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 0.0 OUTLIER -75.69 -24.8 56.29 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.925 179.865 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 1.047 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -73.69 -34.35 64.83 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 179.233 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.757 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.53 -43.24 17.37 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 179.058 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -62.01 -32.16 72.62 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 113.898 -1.501 . . . . 0.0 109.022 178.144 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.455 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.72 -18.61 22.75 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.611 178.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 38.2 t70 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.198 -0.906 . . . . 0.0 111.106 179.928 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 661' ' ' ASP . . . . . 0.716 ' C ' HD22 ' B' ' 662' ' ' LEU . 4.2 p-10 . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.863 0.363 . . . . 0.0 111.173 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 662' ' ' LEU . . . . . 0.716 HD22 ' C ' ' B' ' 661' ' ' ASP . 3.8 mm? -129.73 37.67 3.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.917 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -176.36 79.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.933 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 10.6 t 66.09 95.72 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.026 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 665' ' ' LEU . . . . . 0.445 HD23 ' N ' ' B' ' 666' ' ' SER . 1.2 tt -61.93 115.58 4.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.191 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 666' ' ' SER . . . . . 0.445 ' N ' HD23 ' B' ' 665' ' ' LEU . 19.2 p 47.16 83.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.485 179.54 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -94.3 18.93 10.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.081 0.467 . . . . 0.0 111.398 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -106.03 -15.68 14.83 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.473 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.682 HD11 ' HE2' ' A' ' 57' ' ' LYS . 2.7 pp -120.28 19.83 12.07 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.637 0.256 . . . . 0.0 111.253 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 670' ' ' PHE . . . . . 0.458 ' CZ ' ' HE2' ' A' ' 88' ' ' MET . 1.1 m-85 -84.32 122.12 28.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.931 0.396 . . . . 0.0 110.967 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -94.02 159.56 15.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.853 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -113.67 101.52 9.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.859 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 673' ' ' VAL . . . . . 0.551 HG21 HD23 ' A' ' 48' ' ' LEU . 27.0 m -57.34 132.37 81.29 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.907 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 674' ' ' PRO . . . . . 0.44 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 37.1 Cg_endo -65.86 153.66 77.21 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.554 2.169 . . . . 0.0 112.681 -179.624 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 675' ' ' THR . . . . . 0.755 HG21 HG21 ' A' ' 108' ' ' ILE . 12.5 p -139.01 116.89 11.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.834 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -179.35 165.98 1.45 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.967 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -94.36 179.91 5.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.903 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -177.96 89.83 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.884 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 679' ' ' ILE . . . . . 0.589 HG22 ' O ' ' B' ' 679' ' ' ILE . 2.7 mt 63.71 36.22 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.031 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.843 -179.948 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo . . . . . 0 N--CA 1.488 1.165 0 CA-C-O 120.843 0.268 . . . . 0.0 111.814 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.687 ' O ' HG21 ' A' ' 103' ' ' THR . 0.3 OUTLIER -102.88 -37.51 7.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.915 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.414 ' O ' ' N ' ' A' ' 18' ' ' ILE . 34.6 m170 -81.49 17.91 1.29 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.529 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.566 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 4.0 p -152.67 153.89 34.2 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.125 0.488 . . . . 0.0 111.333 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.502 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 172.07 138.93 2.67 Favored Glycine 0 C--O 1.225 -0.421 0 N-CA-C 110.731 -0.948 . . . . 0.0 110.731 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.565 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -83.13 145.98 28.91 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -178.5 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.58 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -157.5 171.27 20.67 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.162 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.68 HD12 ' HA ' ' A' ' 13' ' ' SER . 5.2 mm -101.24 127.58 54.37 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.477 ' CZ ' ' CD2' ' A' ' 38' ' ' HIS . 5.9 t80 -124.39 108.23 11.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.996 0.427 . . . . 0.0 111.041 178.046 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 6.8 mm-40 68.67 49.2 0.74 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.829 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp 72.82 -6.25 1.7 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.135 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.529 ' O ' HG23 ' A' ' 8' ' ' ILE . 14.3 t -101.04 144.91 12.21 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.497 0 CA-C-O 121.219 0.533 . . . . 0.0 110.562 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.68 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -99.16 114.18 26.81 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.938 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -136.46 -170.42 11.98 Favored Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.886 -0.673 . . . . 0.0 111.846 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.565 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 14.5 mm -105.76 136.11 41.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 120.788 0.327 . . . . 0.0 111.186 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.826 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.51 140.62 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 176.962 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.566 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.3 117.9 5.74 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.716 -0.794 . . . . 0.0 111.554 -178.671 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.632 HD12 ' HB ' ' A' ' 103' ' ' THR . 22.5 mt -82.02 142.81 13.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 114.461 -1.245 . . . . 0.0 112.184 -178.682 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.67 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.5 OUTLIER -118.2 92.82 3.92 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.972 179.14 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.29 -0.82 42.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.314 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -82.45 0.62 41.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.661 0.267 . . . . 0.0 111.184 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.67 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.46 -162.34 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 120.824 0.345 . . . . 0.0 110.654 179.994 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.1 t -176.29 101.6 0.24 Allowed Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.4 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.45 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 9.7 Cg_exo -70.98 161.37 89.87 Favored 'Cis proline' 0 C--N 1.347 0.492 0 C-N-CA 123.682 -1.382 . . . . 0.0 112.673 0.431 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.456 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -54.64 178.23 0.03 OUTLIER 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.498 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.525 ' HG2' HG21 ' A' ' 22' ' ' VAL . 7.9 pt-20 -163.63 135.18 4.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.135 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.802 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.9 130.44 55.02 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.123 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.471 HG22 ' CG2' ' A' ' 37' ' ' VAL . 10.4 m -113.46 113.06 24.63 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.418 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.496 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 73.2 t90 -91.92 110.38 21.73 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.439 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.8 ttt180 -106.25 131.0 54.0 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.838 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.7 m -49.96 153.89 1.24 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.706 0.289 . . . . 0.0 110.562 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 18.8 m -72.97 -33.69 66.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.281 0.563 . . . . 0.0 109.7 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -87.96 -17.16 31.9 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.002 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.89 33.61 10.88 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.31 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -88.48 -24.39 22.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.645 0.259 . . . . 0.0 111.485 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.04 166.61 2.98 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.383 0.611 . . . . 0.0 111.465 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.496 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.6 OUTLIER -143.66 155.48 16.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.919 -178.865 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.477 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 37.8 m80 -130.15 119.39 22.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.695 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.43 129.05 43.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.763 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.577 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -116.78 139.72 42.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.379 -179.543 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.429 ' HB ' HG23 ' A' ' 44' ' ' THR . 25.3 t -103.97 95.37 3.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 177.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.72 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -42.59 -23.95 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.953 -178.849 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.45 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.8 OUTLIER -76.42 -48.15 20.71 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 179.257 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.429 HG23 ' HB ' ' A' ' 41' ' ' VAL . 34.8 p -64.53 -27.84 69.24 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.444 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.823 HD12 ' HB3' ' A' ' 62' ' ' LEU . 48.0 mm -56.46 110.56 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.548 178.82 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 63' ' ' ILE . 9.0 t0 -54.34 -31.65 54.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.794 0.33 . . . . 0.0 110.935 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.424 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 10.8 pttt -172.66 164.34 5.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.827 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 1.049 HD11 HD13 ' A' ' 104' ' ' LEU . 18.8 tp -109.02 117.35 33.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.409 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -113.2 147.45 37.43 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.551 0.215 . . . . 0.0 110.691 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.652 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.2 152.01 25.68 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.662 -0.244 . . . . 0.0 111.162 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.515 HG23 ' HB2' ' A' ' 59' ' ' MET . 17.7 p -70.89 154.81 94.07 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-O 120.796 0.331 . . . . 0.0 111.168 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.32 163.31 34.88 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.731 2.287 . . . . 0.0 112.514 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.08 -24.86 60.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.431 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.1 t -92.33 18.17 8.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.239 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.9 t -80.06 124.18 28.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.946 0.403 . . . . 0.0 111.177 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -61.66 -14.97 35.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.383 179.004 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.829 ' HE2' HD11 ' B' ' 669' ' ' LEU . 0.0 OUTLIER -145.47 104.98 3.96 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.109 0.48 . . . . 0.0 111.131 179.597 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.405 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 1.8 mpt? -56.19 127.94 33.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.153 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.515 ' HB2' HG23 ' A' ' 51' ' ' THR . 37.9 mtm -149.81 138.3 20.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.033 0.444 . . . . 0.0 111.73 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.652 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 17.2 mt -122.11 141.96 50.87 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.572 178.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 87' ' ' HIS . 42.1 ttp180 -142.48 150.74 40.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.104 0.478 . . . . 0.0 112.284 -178.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.823 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.6 mp -128.15 115.51 18.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.565 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.424 ' HB ' ' HG2' ' A' ' 47' ' ' LYS . 7.8 mm -76.42 156.5 5.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.623 0.249 . . . . 0.0 111.046 -179.518 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -109.38 138.54 14.85 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.498 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.4 mttm -68.52 115.79 8.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.88 0.371 . . . . 0.0 110.94 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.537 HG22 ' N ' ' A' ' 67' ' ' ASP . 13.1 p -87.21 162.44 2.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.994 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.537 ' N ' HG22 ' A' ' 66' ' ' VAL . 11.6 p30 -130.31 51.55 2.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.697 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.793 ' HA ' HG13 ' A' ' 81' ' ' VAL . 6.1 pt-20 -64.63 -16.44 62.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.401 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.1 m -105.81 33.61 3.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.904 0.383 . . . . 0.0 110.793 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.76 -40.78 0.69 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.967 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.3 mttp 63.45 95.44 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.955 0.407 . . . . 0.0 110.771 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.39 133.84 40.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.984 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.415 ' CG ' ' HA2' ' A' ' 77' ' ' GLY . 0.0 OUTLIER -68.28 149.21 49.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.131 -179.856 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.403 ' O ' ' CB ' ' A' ' 75' ' ' ASN . 0.6 OUTLIER -94.37 -36.19 12.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.834 179.793 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASN . . . . . 0.403 ' CB ' ' O ' ' A' ' 74' ' ' ASP . 0.7 OUTLIER 165.41 -28.42 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.115 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -116.55 30.78 7.13 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.385 -179.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.415 ' HA2' ' CG ' ' A' ' 73' ' ' LYS . . . 54.93 29.4 51.03 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.569 -0.824 . . . . 0.0 112.576 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -78.48 -0.86 31.06 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 55.64 108.81 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.821 0.343 . . . . 0.0 111.625 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 7.6 t -115.24 142.38 28.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.386 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.793 HG13 ' HA ' ' A' ' 68' ' ' GLU . 96.3 t -112.41 83.96 5.79 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.467 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -44.36 142.62 4.24 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.714 2.276 . . . . 0.0 112.489 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.5 mttt -89.32 164.96 28.22 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.018 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -79.85 80.31 3.1 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 123.624 2.882 . . . . 0.0 112.019 -179.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -57.49 172.57 0.33 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.376 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.67 134.97 2.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.476 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.533 ' CE1' HG22 ' A' ' 40' ' ' VAL . 4.7 m80 -95.9 111.65 23.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.783 0.325 . . . . 0.0 110.501 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.435 ' CE ' ' CZ ' ' B' ' 670' ' ' PHE . 3.8 ttt -93.95 137.85 32.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.98 -179.546 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.826 ' CD1' HD11 ' A' ' 16' ' ' ILE . 87.9 m-85 -136.26 116.88 13.89 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.938 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.551 ' HB2' HG12 ' A' ' 8' ' ' ILE . 1.1 m -91.0 114.74 27.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.827 0.346 . . . . 0.0 110.64 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.47 ' CE2' HG13 ' A' ' 100' ' ' ILE . 9.3 m-85 -92.62 135.78 33.79 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.569 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -101.75 31.03 4.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.475 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.454 ' CB ' HG23 ' A' ' 96' ' ' VAL . 4.6 m-20 -176.42 120.68 0.15 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.757 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.485 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -59.89 -16.66 31.06 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.67 179.544 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -74.37 -50.75 17.38 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 120.95 0.405 . . . . 0.0 110.402 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.454 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -66.22 -40.13 86.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.687 179.323 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.485 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -68.41 -37.97 80.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.038 179.531 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.427 ' N ' ' HG3' ' A' ' 97' ' ' MET . 17.8 t0 -65.9 -26.67 67.72 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.998 178.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.425 ' O ' ' OG1' ' A' ' 103' ' ' THR . 79.7 m-20 -81.66 -65.71 0.98 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.412 179.454 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.715 HG22 HD11 ' A' ' 104' ' ' LEU . 15.1 mm -48.28 -57.87 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-O 121.115 0.483 . . . . 0.0 110.623 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.63 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 17.2 ttpp -46.77 -39.18 11.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.983 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 30.3 mtm -78.01 -43.75 28.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.497 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.687 HG21 ' O ' ' A' ' 2' ' ' SER . 0.2 OUTLIER -56.96 -53.61 56.03 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.084 -179.991 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 1.049 HD13 HD11 ' A' ' 48' ' ' LEU . 3.4 mt -49.99 -53.27 27.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.993 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -56.87 -46.28 81.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.007 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -49.9 -35.04 22.22 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 121.176 0.512 . . . . 0.0 110.3 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.036 HG22 ' HE1' ' A' ' 111' ' ' TYR . 10.2 mt -85.66 -51.83 12.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.379 179.293 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.686 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.28 -57.2 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.37 179.338 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -46.95 -28.22 1.54 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.253 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.538 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.0 OUTLIER -72.89 -24.89 60.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.28 179.896 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 1.036 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -75.08 -34.79 61.82 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.665 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.76 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.47 -43.68 16.94 Favored 'General case' 0 CA--C 1.505 -0.752 0 N-CA-C 107.918 -1.142 . . . . 0.0 107.918 179.114 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -61.39 -31.36 71.27 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 113.883 -1.508 . . . . 0.0 109.027 178.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.456 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.6 -21.26 20.16 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.56 178.707 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.891 179.866 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.787 0.327 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 1.7 tp -173.99 87.53 0.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.87 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -176.89 95.49 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.963 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 664' ' ' VAL . . . . . 0.532 HG12 ' O ' ' B' ' 664' ' ' VAL . 16.6 t -150.88 40.59 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.071 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 665' ' ' LEU . . . . . 0.421 HD22 ' HA ' ' B' ' 665' ' ' LEU . 0.3 OUTLIER -131.25 175.84 8.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.845 -179.986 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 666' ' ' SER . . . . . . . . . . . . . 1.4 t -177.61 96.6 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.721 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -94.09 19.16 9.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.179 0.514 . . . . 0.0 111.541 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -97.38 -4.81 37.7 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.318 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.829 HD11 ' HE2' ' A' ' 57' ' ' LYS . 0.8 OUTLIER -120.28 20.0 12.04 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.136 179.912 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 670' ' ' PHE . . . . . 0.435 ' CZ ' ' CE ' ' A' ' 88' ' ' MET . 4.0 m-85 -81.45 122.13 27.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.802 0.334 . . . . 0.0 110.914 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -100.95 140.95 34.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.868 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -82.43 113.08 19.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.887 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 673' ' ' VAL . . . . . 0.85 HG22 ' O ' ' A' ' 48' ' ' LEU . 34.2 m -57.53 153.93 26.83 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.086 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.44 128.2 13.36 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.581 2.187 . . . . 0.0 112.316 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 1.5 p -139.09 139.5 37.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.854 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 5.6 mmtt -55.5 166.12 0.69 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.149 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 8.7 t -170.26 -39.36 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.019 0.438 . . . . 0.0 111.021 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 63.38 127.53 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.956 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 679' ' ' ILE . . . . . 0.56 HG22 ' O ' ' B' ' 679' ' ' ILE . 4.3 mt -116.36 45.33 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.982 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 20.9 t . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.902 -179.985 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo . . . . . 0 N--CA 1.489 1.217 0 CA-C-O 120.881 0.284 . . . . 0.0 111.781 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -88.74 -30.23 19.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.944 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.2 m170 -94.62 24.7 4.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.156 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.535 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 8.1 p -161.52 159.76 28.27 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.199 0.523 . . . . 0.0 111.37 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . 168.32 136.84 2.12 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.109 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.567 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -80.83 142.48 33.64 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -178.55 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.656 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -148.08 171.31 16.05 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.402 -179.145 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.678 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -104.1 122.64 57.17 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.439 -179.766 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.469 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 5.1 t80 -122.77 107.64 12.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.942 0.401 . . . . 0.0 111.153 178.795 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 8.0 mt-10 68.34 48.4 0.88 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.92 179.11 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.9 mttm 73.15 -4.73 2.11 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.451 ' O ' HG23 ' A' ' 8' ' ' ILE . 18.9 t -100.91 149.45 6.25 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 CA-C-O 121.094 0.473 . . . . 0.0 110.54 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.402 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -110.42 114.03 27.14 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.8 179.834 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.862 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -130.91 -138.19 4.23 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.206 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.862 HD13 ' O ' ' A' ' 14' ' ' GLY . 15.4 mm -135.64 131.87 51.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.725 0.298 . . . . 0.0 111.551 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.865 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -101.33 115.54 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 177.524 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.535 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -125.36 116.1 21.36 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.589 0.709 . . . . 0.0 110.936 -179.157 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.881 HD13 HG22 ' A' ' 103' ' ' THR . 7.2 mt -82.25 142.74 13.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.824 -178.537 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.596 ' O ' HG23 ' A' ' 22' ' ' VAL . 2.4 m120 -117.66 93.92 4.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.368 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.403 ' CG ' HG12 ' A' ' 107' ' ' ILE . 1.2 tm-20 -81.61 -0.16 41.13 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.397 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -83.64 1.36 42.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.561 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.596 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -100.55 -162.48 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.959 0.409 . . . . 0.0 111.045 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.6 t -176.86 101.04 0.23 Allowed Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.32 179.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.427 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 38.1 Cg_endo -67.98 161.87 79.35 Favored 'Cis proline' 0 C--N 1.347 0.457 0 C-N-CA 123.349 -1.521 . . . . 0.0 112.422 0.552 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.562 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -53.48 -174.71 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.868 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -161.23 144.09 12.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.564 0.697 . . . . 0.0 112.312 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.707 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 3.0 tt -108.25 149.14 29.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.753 -1.112 . . . . 0.0 108.541 178.854 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.1 m -147.42 104.65 3.66 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.168 -0.613 . . . . 0.0 112.557 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.499 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 84.9 t90 -92.02 110.44 21.81 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.727 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.479 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.5 ttm180 -110.69 130.59 55.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.925 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.3 t -49.86 156.81 0.67 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.66 0.267 . . . . 0.0 110.533 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.416 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 28.4 m -74.52 -35.71 63.18 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.438 0.637 . . . . 0.0 109.817 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -85.6 -16.01 40.69 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.119 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.62 34.22 12.03 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.358 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -87.37 -24.37 24.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.706 0.289 . . . . 0.0 111.54 -179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.27 163.01 2.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.293 0.568 . . . . 0.0 111.521 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.7 148.58 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.033 -178.864 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -123.58 120.08 31.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.61 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.49 146.42 24.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.856 0.36 . . . . 0.0 110.934 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.707 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.2 t -131.17 139.13 51.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.494 -179.373 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.416 HG12 ' HB3' ' A' ' 43' ' ' SER . 46.4 t -103.95 95.91 4.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 177.245 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.909 HD11 ' CD2' ' A' ' 104' ' ' LEU . 1.1 mm? -42.46 -22.2 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.568 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.427 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 2.1 t -77.21 -48.26 18.05 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 43.2 p -64.95 -28.11 69.3 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.85 HD12 ' HB3' ' A' ' 62' ' ' LEU . 46.1 mm -56.6 108.63 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.648 178.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.428 ' N ' ' O ' ' A' ' 63' ' ' ILE . 1.6 t0 -54.15 -31.81 53.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.886 0.374 . . . . 0.0 110.971 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.427 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 0.7 OUTLIER -171.67 164.59 6.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.75 179.814 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.862 HD11 HD13 ' A' ' 104' ' ' LEU . 11.4 tp -109.05 118.22 36.22 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.874 -179.602 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.482 ' O ' ' N ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -108.75 139.12 44.01 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.299 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.716 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -156.86 143.92 18.7 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.759 0.314 . . . . 0.0 111.291 -179.551 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.419 ' CG2' ' HB2' ' A' ' 59' ' ' MET . 7.0 p -58.97 144.11 82.7 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.414 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -80.52 163.51 21.61 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.888 2.392 . . . . 0.0 112.433 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -54.98 -23.14 17.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.529 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.9 t -93.15 18.16 9.83 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.395 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.408 ' CB ' ' HB ' ' A' ' 51' ' ' THR . 2.0 t -84.04 125.42 32.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.867 0.365 . . . . 0.0 111.277 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -57.3 -18.73 18.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.077 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.466 ' HE2' HD11 ' B' ' 669' ' ' LEU . 0.0 OUTLIER -142.44 166.08 25.65 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.758 179.3 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.467 ' HG2' ' CA ' ' A' ' 94' ' ' ARG . 2.2 mpt? -100.4 126.74 46.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.898 0.38 . . . . 0.0 111.235 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.624 ' HG3' ' HA ' ' A' ' 90' ' ' SER . 0.0 OUTLIER -149.95 137.88 20.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.572 -179.859 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.716 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 29.6 mt -127.8 148.89 50.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.971 178.346 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.482 ' N ' ' O ' ' A' ' 49' ' ' GLN . 12.6 ttt180 -153.17 152.4 31.2 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -179.154 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.85 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.4 mp -128.21 116.73 20.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.717 178.224 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.625 HG23 ' HG2' ' A' ' 86' ' ' ARG . 19.0 mm -76.59 156.72 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.723 0.297 . . . . 0.0 111.257 -179.365 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.435 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -123.38 127.72 6.71 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.31 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.29 125.77 24.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.91 0.386 . . . . 0.0 111.053 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.492 HG22 ' N ' ' A' ' 67' ' ' ASP . 12.2 p -102.52 161.29 4.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.319 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.492 ' N ' HG22 ' A' ' 66' ' ' VAL . 11.6 p-10 -122.29 53.2 1.25 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.661 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -62.95 -15.14 54.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.464 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.0 t -53.38 -25.04 13.93 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.948 0.404 . . . . 0.0 111.24 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.7 mmtm -74.12 -69.1 0.47 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.693 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.1 ptpt 42.57 81.13 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.419 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.429 ' NH1' HG11 ' A' ' 80' ' ' VAL . 0.0 OUTLIER -148.76 -175.94 5.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.16 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.41 ' HG3' ' O ' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -108.44 -173.14 2.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.898 -179.736 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -105.79 -41.19 5.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.987 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 168.17 -31.32 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.05 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -98.5 39.3 1.26 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.003 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 59.5 18.8 45.55 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.64 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.41 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 12.7 m120 -61.58 -156.45 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 110.46 -0.2 . . . . 0.0 110.46 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -162.22 114.43 1.69 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.803 0.335 . . . . 0.0 110.767 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.799 HG12 ' HD3' ' A' ' 82' ' ' PRO . 42.8 t -96.3 -69.94 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.494 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.5 HG22 ' O ' ' A' ' 81' ' ' VAL . 4.1 p 35.46 70.55 0.97 Allowed Pre-proline 0 CA--C 1.53 0.203 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.584 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.799 ' HD3' HG12 ' A' ' 80' ' ' VAL . 4.7 Cg_exo -40.18 128.79 2.25 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 123.435 2.757 . . . . 0.0 112.76 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.9 pttm -94.98 164.7 18.71 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.946 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.455 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 4.3 Cg_exo -81.07 111.54 2.45 Favored 'Trans proline' 0 N--CA 1.461 -0.389 0 C-N-CA 123.603 2.869 . . . . 0.0 112.255 -179.117 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.8 mt-30 -85.4 114.71 22.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.092 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.625 ' HG2' HG23 ' A' ' 63' ' ' ILE . 0.3 OUTLIER -115.96 130.41 56.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.528 179.733 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.474 ' CE1' HG22 ' A' ' 40' ' ' VAL . 4.2 m80 -93.7 111.21 22.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.343 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.406 ' HE2' ' HE2' ' A' ' 59' ' ' MET . 0.1 OUTLIER -107.07 137.36 45.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.971 0.415 . . . . 0.0 111.149 -179.637 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.865 ' CD2' HD11 ' A' ' 16' ' ' ILE . 1.1 m-85 -137.0 128.84 29.05 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.775 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.624 ' HA ' ' HG3' ' A' ' 59' ' ' MET . 0.9 OUTLIER -97.22 114.42 26.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.727 179.718 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.656 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 33.1 m-85 -91.12 145.58 24.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.109 0.48 . . . . 0.0 111.496 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -108.31 27.65 9.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.487 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -165.67 111.02 0.88 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.851 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.467 ' CA ' ' HG2' ' A' ' 58' ' ' MET . 0.0 OUTLIER -58.71 -23.62 59.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.429 179.696 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -72.95 -44.07 61.57 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.8 179.152 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.41 HG13 ' CA ' ' A' ' 5' ' ' GLY . 37.7 t -65.43 -51.96 57.49 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.445 178.508 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.419 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -60.67 -36.0 77.63 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.853 179.209 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.408 ' N ' ' HG3' ' A' ' 97' ' ' MET . 4.0 m-20 -61.05 -33.75 73.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.089 179.076 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -81.64 -25.23 35.8 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.578 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.581 HG22 HD12 ' A' ' 104' ' ' LEU . 9.1 mm -84.87 -60.14 2.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.002 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.69 ' HD3' HG11 ' B' ' 673' ' ' VAL . 2.7 ttmm -53.31 -27.48 23.32 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.766 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.457 ' HG3' ' N ' ' A' ' 103' ' ' THR . 9.5 ptp -81.57 -39.96 23.79 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.75 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.881 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -74.95 -32.91 61.86 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-O 120.984 0.421 . . . . 0.0 110.023 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.909 ' CD2' HD11 ' A' ' 42' ' ' LEU . 11.2 mt -60.71 -58.6 7.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.458 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.445 ' HA ' HG13 ' A' ' 108' ' ' ILE . 6.1 pt20 -68.34 -33.19 73.85 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.892 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -52.8 -34.72 54.93 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.273 0.559 . . . . 0.0 109.993 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.964 HG22 ' HE1' ' A' ' 111' ' ' TYR . 6.1 mt -84.95 -52.14 12.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.141 179.095 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.604 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.75 -57.81 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.334 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.091 178.961 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.403 ' HA ' ' HG2' ' A' ' 112' ' ' LYS . 0.1 OUTLIER -47.04 -26.29 1.02 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.131 179.757 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 6.0 mtt-85 -73.05 -25.04 60.78 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.35 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.964 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -76.59 -36.15 57.7 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.727 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -79.68 -43.75 22.13 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.903 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -61.73 -31.01 71.15 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 113.913 -1.494 . . . . 0.0 108.99 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.453 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.61 -19.04 22.3 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.698 178.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 37.1 t70 . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.972 179.996 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.826 0.346 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 13.5 mt -153.24 84.41 1.2 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.91 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -176.54 70.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.894 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 664' ' ' VAL . . . . . 0.528 HG12 ' O ' ' B' ' 664' ' ' VAL . 17.5 t 59.16 42.64 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.128 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 665' ' ' LEU . . . . . 0.452 HD12 ' H ' ' B' ' 666' ' ' SER . 0.2 OUTLIER 61.71 -161.48 0.29 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.801 179.969 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 666' ' ' SER . . . . . 0.452 ' H ' HD12 ' B' ' 665' ' ' LEU . 34.3 m -166.94 94.08 0.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.254 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 667' ' ' GLU . . . . . 0.441 ' O ' ' CE1' ' B' ' 670' ' ' PHE . 0.7 OUTLIER -83.78 18.86 1.83 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.072 -179.562 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -106.07 11.51 31.38 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.981 179.454 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.466 HD11 ' HE2' ' A' ' 57' ' ' LYS . 4.4 pp -120.34 -26.25 5.47 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -179.411 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 670' ' ' PHE . . . . . 0.441 ' CE1' ' O ' ' B' ' 667' ' ' GLU . 0.0 OUTLIER -76.51 164.38 26.01 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.985 0.422 . . . . 0.0 111.381 -179.28 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -109.89 171.1 7.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.078 -179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 672' ' ' ASP . . . . . 0.414 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 18.4 t70 -107.24 120.38 41.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.075 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 673' ' ' VAL . . . . . 0.729 ' CG2' HD23 ' A' ' 48' ' ' LEU . 36.0 m -65.37 125.24 89.1 Favored Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.705 179.676 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.73 156.28 64.81 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.491 2.127 . . . . 0.0 112.671 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 52.7 p -136.81 116.63 13.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.763 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.88 130.21 0.09 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.916 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 2.3 m 62.09 148.29 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.06 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 67.0 tp60 -168.6 128.81 1.2 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.911 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 679' ' ' ILE . . . . . 0.66 HG23 ' O ' ' B' ' 679' ' ' ILE . 0.0 OUTLIER -177.21 96.16 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.958 179.956 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 2.5 m . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.905 -179.93 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo . . . . . 0 N--CA 1.487 1.123 0 CA-C-O 120.844 0.268 . . . . 0.0 111.865 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.682 ' O ' HG21 ' A' ' 103' ' ' THR . 0.4 OUTLIER -101.55 -37.57 8.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.88 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.418 ' O ' ' N ' ' A' ' 18' ' ' ILE . 37.1 m80 -82.0 17.9 1.47 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.49 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.57 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 4.9 p -152.26 153.07 33.02 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 121.205 0.526 . . . . 0.0 111.262 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.489 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 173.03 139.07 2.75 Favored Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 110.707 -0.957 . . . . 0.0 110.707 -179.539 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.552 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.84 142.51 31.46 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -178.444 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.569 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -151.81 171.1 18.26 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.179 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.653 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.77 127.05 55.58 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.266 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.554 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.493 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 7.2 t80 -128.08 110.53 12.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.957 0.408 . . . . 0.0 111.093 178.182 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 3.7 mm-40 67.46 50.09 0.96 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.892 179.131 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 69.83 -4.42 1.46 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.187 179.254 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.478 ' O ' HG23 ' A' ' 8' ' ' ILE . 17.9 t -101.38 149.05 6.66 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 CA-C-O 121.122 0.487 . . . . 0.0 110.561 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.454 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -111.85 113.49 25.86 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.033 179.991 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.879 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.98 -133.05 3.4 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.952 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.879 HD13 ' O ' ' A' ' 14' ' ' GLY . 18.7 mm -135.89 136.11 50.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 120.688 0.28 . . . . 0.0 111.255 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.864 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.68 140.52 19.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 106.425 -1.695 . . . . 0.0 106.425 176.7 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.57 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.54 118.01 5.68 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 119.629 -0.829 . . . . 0.0 111.591 -178.631 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.64 HD12 ' HB ' ' A' ' 103' ' ' THR . 20.9 mt -81.52 142.88 13.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 114.501 -1.227 . . . . 0.0 112.164 -178.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.618 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -119.5 92.7 3.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.914 179.034 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.68 -0.2 41.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.319 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -82.49 0.37 42.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.647 -0.251 . . . . 0.0 111.096 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.618 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.31 -163.01 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.823 0.344 . . . . 0.0 110.775 179.92 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.6 p -175.1 101.48 0.26 Allowed Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.369 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.441 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 12.4 Cg_exo -69.48 166.34 73.54 Favored 'Cis proline' 0 C--N 1.346 0.445 0 C-N-CA 123.612 -1.411 . . . . 0.0 112.704 0.348 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.484 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -59.53 178.57 0.15 Allowed 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.342 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.522 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.73 134.52 4.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.209 179.042 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.797 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.93 129.12 55.12 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.904 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.54 HG22 ' CG2' ' A' ' 37' ' ' VAL . 6.8 m -112.33 113.41 25.61 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -178.356 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.533 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 76.3 t90 -91.79 110.36 21.7 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.261 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.492 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.5 ttt180 -109.41 130.33 55.5 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.727 0.298 . . . . 0.0 111.204 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.401 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 31.1 m -49.9 159.83 0.37 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.508 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.422 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 48.3 m -75.98 -37.58 58.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.333 0.587 . . . . 0.0 109.845 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -85.56 -12.91 50.46 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.155 -0.929 . . . . 0.0 111.233 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 83.73 35.4 16.41 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.361 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -87.56 -24.87 23.89 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.709 0.29 . . . . 0.0 111.383 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.75 163.94 2.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.321 0.581 . . . . 0.0 111.427 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.54 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.6 OUTLIER -143.77 155.45 16.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.981 -178.903 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.406 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 17.0 m-70 -130.69 119.56 22.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.795 179.707 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.56 128.54 43.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.739 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.592 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -114.94 141.55 31.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.46 -179.629 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.434 ' HB ' HG23 ' A' ' 44' ' ' THR . 21.5 t -104.07 95.92 4.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 177.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.794 HD11 HD22 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -44.18 -21.94 0.05 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.835 -179.114 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.441 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER -76.92 -47.14 21.89 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.083 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.434 HG23 ' HB ' ' A' ' 41' ' ' VAL . 51.5 p -64.52 -28.08 69.41 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.321 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.869 HD12 ' HB3' ' A' ' 62' ' ' LEU . 49.9 mm -56.68 103.57 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.411 178.48 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.416 ' N ' ' O ' ' A' ' 63' ' ' ILE . 24.2 t70 -58.26 -20.26 40.74 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.807 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.471 ' HG2' HG12 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -172.6 160.18 4.59 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.105 0.478 . . . . 0.0 111.453 -179.877 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.799 HD21 ' HB2' ' A' ' 104' ' ' LEU . 12.2 tp -109.03 120.33 42.23 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.334 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' A' ' 61' ' ' ARG . 0.4 OUTLIER -122.52 145.59 48.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.63 0.252 . . . . 0.0 111.295 -179.641 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.618 ' CB ' HD22 ' A' ' 60' ' ' LEU . . . -157.3 149.86 23.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.667 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.585 HG23 ' HB2' ' A' ' 59' ' ' MET . 43.3 p -56.53 138.66 75.92 Favored Pre-proline 0 CA--C 1.53 0.179 0 C-N-CA 121.045 -0.262 . . . . 0.0 110.87 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -68.34 163.19 37.38 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.598 2.199 . . . . 0.0 112.391 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.27 -32.21 73.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.059 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.4 p -70.74 -20.87 62.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.079 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.431 ' CB ' HD22 ' B' ' 669' ' ' LEU . 79.1 p -91.57 116.51 28.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.894 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -56.51 -18.25 10.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.697 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.5 mmmt -73.16 126.84 30.98 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.851 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.54 97.58 7.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.585 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.585 ' HB2' HG23 ' A' ' 51' ' ' THR . 23.8 mtm -143.97 142.93 30.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.861 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.618 HD22 ' CB ' ' A' ' 50' ' ' ALA . 17.9 mt -118.17 146.25 44.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.044 178.715 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.41 ' N ' ' O ' ' A' ' 49' ' ' GLN . 18.6 ttp180 -143.12 145.59 32.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.972 0.415 . . . . 0.0 112.119 -178.747 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.869 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -128.19 109.07 11.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.889 178.231 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.471 HG12 ' HG2' ' A' ' 47' ' ' LYS . 7.8 mm -76.64 156.41 5.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.994 -0.282 . . . . 0.0 110.891 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -111.18 -170.39 19.12 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.417 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.0 mttm -116.07 136.48 52.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.72 0.295 . . . . 0.0 111.034 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.446 HG22 ' N ' ' A' ' 67' ' ' ASP . 9.3 p -102.14 160.41 4.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.994 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.446 ' N ' HG22 ' A' ' 66' ' ' VAL . 6.5 t70 -136.99 38.36 2.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.197 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 44.67 30.16 0.49 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.312 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 64.6 m -102.1 -22.76 14.17 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.215 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 30.7 mmtm -56.4 -82.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.971 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.7 mttm 55.09 89.81 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.865 0.364 . . . . 0.0 111.129 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.41 ' HG2' ' CG ' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -124.57 134.42 52.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.863 179.95 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.7 mmtt -73.51 148.52 43.02 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.776 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -103.93 -31.74 9.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.037 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 168.57 -31.38 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.101 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -105.11 20.46 18.82 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.327 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 53.84 36.93 56.49 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.532 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -83.6 2.97 34.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.701 0.286 . . . . 0.0 111.646 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 79' ' ' GLU . 9.5 pt-20 42.39 74.38 0.11 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.223 -0.444 . . . . 0.0 112.008 179.539 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.448 HG12 ' N ' ' A' ' 81' ' ' VAL . 40.5 t -76.87 155.41 5.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.32 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.448 ' N ' HG12 ' A' ' 80' ' ' VAL . 52.3 t -110.9 78.96 1.73 Allowed Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.341 179.363 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.41 ' CG ' ' HG2' ' A' ' 72' ' ' ARG . 93.9 Cg_exo -41.24 156.02 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.907 2.405 . . . . 0.0 112.795 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.9 ptpp? -44.69 164.94 0.16 Allowed Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.217 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.438 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.8 Cg_exo -82.4 46.29 2.15 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 123.543 2.828 . . . . 0.0 112.771 -178.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 59.68 149.45 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.009 0.433 . . . . 0.0 111.081 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -166.99 128.39 1.63 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.6 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.564 ' CE1' HG22 ' A' ' 40' ' ' VAL . 7.4 m80 -93.13 111.18 22.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.73 0.3 . . . . 0.0 110.303 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 16.6 ttt -94.18 118.26 31.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.283 -179.432 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.864 ' CD1' HD11 ' A' ' 16' ' ' ILE . 92.8 m-85 -116.98 116.63 27.76 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.654 179.656 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.439 ' HB3' ' HB ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -94.57 114.58 26.58 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.972 0.415 . . . . 0.0 110.545 179.931 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.518 ' CE1' ' HB2' ' A' ' 7' ' ' ALA . 5.8 m-85 -89.63 147.32 23.97 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.394 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -109.47 29.14 7.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.0 179.133 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.428 ' CB ' HG23 ' A' ' 96' ' ' VAL . 7.5 m-20 -174.97 117.69 0.18 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.585 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.481 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -59.47 -14.93 14.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.778 179.614 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.02 -50.83 18.02 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.025 0.44 . . . . 0.0 110.267 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.428 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -64.43 -43.71 97.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.658 179.247 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.481 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -64.38 -36.94 85.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.931 179.381 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -62.88 -28.73 70.24 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.817 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.455 ' O ' ' HG2' ' A' ' 102' ' ' MET . 5.4 m120 -81.69 -65.41 1.02 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.276 179.265 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.642 HG22 HD11 ' A' ' 104' ' ' LEU . 22.6 mm -47.32 -57.64 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.212 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.432 ' HA ' HD12 ' A' ' 104' ' ' LEU . 0.1 OUTLIER -50.03 -35.46 24.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.733 -179.416 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.531 ' HG3' ' N ' ' A' ' 103' ' ' THR . 9.0 ptp -83.04 -41.49 18.6 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.647 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.682 HG21 ' O ' ' A' ' 2' ' ' SER . 0.2 OUTLIER -56.85 -50.76 71.47 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 120.822 0.344 . . . . 0.0 110.564 179.505 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.799 ' HB2' HD21 ' A' ' 48' ' ' LEU . 5.5 mt -52.73 -52.5 55.99 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 179.086 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.71 ' HG2' HD23 ' A' ' 48' ' ' LEU . 7.2 mm100 -55.46 -47.76 75.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.017 179.493 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -49.62 -34.8 19.06 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 121.134 0.492 . . . . 0.0 110.607 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.012 HG22 ' HE1' ' A' ' 111' ' ' TYR . 9.2 mt -85.69 -52.07 12.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.49 179.42 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.667 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -42.52 -57.06 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.622 179.484 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.449 ' HA ' ' HG2' ' A' ' 112' ' ' LYS . 10.1 t -47.98 -26.95 1.96 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.942 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.452 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 11.7 mtp-105 -72.36 -25.03 61.37 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.022 179.728 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 1.012 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -75.54 -34.95 60.79 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.599 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.767 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.73 -43.17 17.12 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.987 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -61.3 -32.36 72.21 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 113.815 -1.539 . . . . 0.0 108.99 178.183 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.452 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.59 -18.91 22.48 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.727 178.628 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 33.5 t70 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.092 179.898 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.806 0.336 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 662' ' ' LEU . . . . . 0.706 ' N ' HD13 ' B' ' 662' ' ' LEU . 0.0 OUTLIER -117.74 -21.12 8.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.35 179.985 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 663' ' ' GLU . . . . . 0.625 ' N ' HD22 ' B' ' 662' ' ' LEU . 0.2 OUTLIER 56.67 85.88 0.07 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.725 0.298 . . . . 0.0 111.079 179.966 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 664' ' ' VAL . . . . . 0.588 ' O ' HG22 ' B' ' 664' ' ' VAL . 14.2 p 43.1 44.86 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.177 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.677 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 665' ' ' LEU . . . . . 0.796 HD13 ' N ' ' B' ' 666' ' ' SER . 0.7 OUTLIER 63.46 142.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.869 179.937 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 666' ' ' SER . . . . . 0.796 ' N ' HD13 ' B' ' 665' ' ' LEU . 1.8 t -111.06 64.01 0.61 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.836 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 667' ' ' GLU . . . . . 0.674 ' HG2' HD12 ' B' ' 665' ' ' LEU . 0.8 OUTLIER -94.14 19.15 9.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.59 -179.943 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -86.96 5.3 37.87 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.394 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.431 HD22 ' CB ' ' A' ' 55' ' ' SER . 0.4 OUTLIER -120.31 19.89 12.04 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.726 0.298 . . . . 0.0 111.168 179.924 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 670' ' ' PHE . . . . . 0.426 ' CZ ' ' HB2' ' A' ' 59' ' ' MET . 5.4 m-85 -63.37 122.81 17.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.856 0.36 . . . . 0.0 110.927 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -100.2 145.29 28.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.845 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -84.17 115.36 22.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.048 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 673' ' ' VAL . . . . . 0.409 HG13 ' HD2' ' B' ' 674' ' ' PRO . 25.5 t -60.47 136.39 92.08 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.892 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 674' ' ' PRO . . . . . 0.466 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 36.6 Cg_endo -65.45 128.33 20.01 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.429 2.086 . . . . 0.0 112.284 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 675' ' ' THR . . . . . 0.515 ' HA ' HE22 ' A' ' 105' ' ' GLN . 0.7 OUTLIER -122.13 159.58 26.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.873 -179.989 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 33.7 tttt -81.0 162.79 23.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.879 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 1.6 t -176.66 -170.37 0.33 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.942 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -82.17 -172.94 4.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.908 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 679' ' ' ILE . . . . . 0.589 HG22 ' O ' ' B' ' 679' ' ' ILE . 3.5 mp -114.14 31.81 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.111 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 3.2 m . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.875 -179.974 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo . . . . . 0 N--CA 1.488 1.164 0 CA-C-O 120.89 0.287 . . . . 0.0 111.822 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.657 ' O ' HG21 ' A' ' 103' ' ' THR . 1.4 m -106.39 -37.55 6.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.849 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.415 ' CD2' ' HG2' ' A' ' 20' ' ' GLU . 16.4 m80 -87.45 20.43 2.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.249 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.546 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 6.5 p -156.54 136.96 13.03 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 121.196 0.522 . . . . 0.0 111.145 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.517 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -171.73 138.54 4.89 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 110.751 -0.939 . . . . 0.0 110.751 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.565 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -81.29 142.75 32.81 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.409 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.516 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -155.74 170.98 20.79 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.364 -179.323 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.607 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -100.85 126.17 54.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.239 -179.826 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.537 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 58.4 t80 -117.25 108.6 15.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.047 0.451 . . . . 0.0 111.569 178.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 67.1 mt-10 58.49 55.55 4.82 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.84 178.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.4 mtmm 71.99 -6.66 1.44 Allowed 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.46 ' O ' HG23 ' A' ' 8' ' ' ILE . 34.0 t -101.73 150.16 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.549 0 CA-C-O 121.235 0.54 . . . . 0.0 110.545 179.383 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.438 ' HA ' HD12 ' A' ' 8' ' ' ILE . 90.4 p -106.1 144.76 32.35 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.003 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.908 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -171.67 -141.86 3.51 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.034 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.908 HD13 ' O ' ' A' ' 14' ' ' GLY . 13.8 mm -132.38 136.19 56.66 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.475 0 CA-C-O 120.938 0.399 . . . . 0.0 111.465 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.8 HD11 ' CG ' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.76 141.37 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 N-CA-C 106.332 -1.729 . . . . 0.0 106.332 176.759 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.546 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.61 118.59 5.85 Favored 'General case' 0 C--N 1.313 -1.002 0 C-N-CA 119.663 -0.815 . . . . 0.0 111.478 -178.498 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.626 HD12 ' HB ' ' A' ' 103' ' ' THR . 20.1 mt -82.0 142.99 12.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.255 -178.668 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.643 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -119.8 92.51 3.8 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.872 178.871 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.415 ' HG2' ' CD2' ' A' ' 3' ' ' HIS . 0.7 OUTLIER -82.85 0.92 41.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.376 -179.651 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -82.79 0.81 42.06 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.06 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.643 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.39 -162.07 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.852 0.358 . . . . 0.0 110.709 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.407 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 11.6 p -175.01 101.23 0.26 Allowed Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.541 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.434 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 9.8 Cg_exo -70.98 165.94 78.69 Favored 'Cis proline' 0 C--N 1.348 0.504 0 C-N-CA 123.617 -1.41 . . . . 0.0 112.634 0.395 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.44 ' CB ' HG21 ' A' ' 107' ' ' ILE . . . -59.66 177.92 0.19 Allowed 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.406 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.561 ' HG2' HG21 ' A' ' 22' ' ' VAL . 6.7 pt-20 -163.68 137.15 5.55 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.003 179.077 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.775 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.86 127.67 53.93 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 178.99 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.617 HG22 ' CG2' ' A' ' 37' ' ' VAL . 3.1 m -109.67 111.15 22.44 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 -178.521 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.537 ' CE2' ' HB3' ' A' ' 9' ' ' PHE . 65.6 t90 -91.95 113.68 26.02 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 116.233 -0.439 . . . . 0.0 109.868 178.651 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.433 ' O ' ' N ' ' A' ' 15' ' ' ILE . 2.5 ttt180 -106.91 133.52 51.43 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.658 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 27.3 m -49.72 166.49 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.251 -0.277 . . . . 0.0 110.251 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.0 m -76.8 -43.23 37.51 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.479 0.657 . . . . 0.0 109.894 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -83.96 -13.78 52.51 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.185 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.22 34.22 10.93 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.276 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.79 -23.08 29.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.684 0.278 . . . . 0.0 111.574 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.9 163.59 2.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.32 0.581 . . . . 0.0 111.422 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.617 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.6 146.03 19.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.985 -178.747 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.448 ' ND1' ' CZ ' ' A' ' 9' ' ' PHE . 1.4 m-70 -122.04 123.53 41.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.828 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.51 126.32 41.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.814 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.568 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -112.47 140.16 33.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.265 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.43 ' HB ' HG23 ' A' ' 44' ' ' THR . 23.3 t -104.01 96.49 4.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 177.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.73 HD11 HD22 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -43.05 -24.28 0.07 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.774 -179.019 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.434 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.8 OUTLIER -74.95 -47.95 26.89 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.281 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.43 HG23 ' HB ' ' A' ' 41' ' ' VAL . 48.7 p -64.64 -28.11 69.39 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 178.438 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.875 HD12 ' HB3' ' A' ' 62' ' ' LEU . 41.8 mm -57.59 99.83 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.526 178.563 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.453 ' N ' ' O ' ' A' ' 63' ' ' ILE . 16.5 t70 -47.48 -28.72 2.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.7 0.286 . . . . 0.0 111.31 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.45 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 1.4 pttt -172.72 156.97 3.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.894 0.378 . . . . 0.0 110.741 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.959 HD11 HD13 ' A' ' 104' ' ' LEU . 3.6 tp -109.1 122.47 47.36 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.714 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.616 ' OE1' HD11 ' A' ' 63' ' ' ILE . 17.9 mt-30 -118.75 151.99 37.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.793 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.661 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.16 150.47 23.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.78 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.594 HG23 ' HB2' ' A' ' 59' ' ' MET . 25.9 p -57.12 142.2 75.21 Favored Pre-proline 0 C--N 1.332 -0.156 0 CA-C-O 120.63 0.252 . . . . 0.0 110.84 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.73 163.27 39.64 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.522 2.148 . . . . 0.0 112.553 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.41 -30.6 68.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.223 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.65 -21.79 62.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.935 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 57.8 m -94.03 117.08 29.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.834 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -54.78 -19.85 7.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.53 179.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -70.25 121.71 18.13 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.758 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.442 ' HA ' ' HG1' ' A' ' 51' ' ' THR . 1.6 mpp? -106.1 104.06 13.68 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.833 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.594 ' HB2' HG23 ' A' ' 51' ' ' THR . 14.2 mtm -149.69 143.6 25.57 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.648 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.661 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 24.0 mt -120.27 140.15 51.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.084 178.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.401 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 0.6 OUTLIER -135.42 148.84 49.45 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 120.917 0.389 . . . . 0.0 111.842 -179.169 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.875 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.4 mp -127.87 113.14 15.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.876 178.577 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.832 HG23 ' HG2' ' A' ' 86' ' ' ARG . 8.8 mm -76.66 145.53 10.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.649 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -104.72 144.87 15.86 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.558 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -56.92 118.24 4.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.816 0.341 . . . . 0.0 110.901 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.467 HG22 ' N ' ' A' ' 67' ' ' ASP . 11.5 p -101.21 159.75 3.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.318 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.467 ' N ' HG22 ' A' ' 66' ' ' VAL . 4.8 m-20 -123.01 43.49 2.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.762 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.1 -20.87 57.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.17 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.32 -21.98 51.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.073 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.1 mmtm -67.11 -65.82 0.63 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.881 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.1 ptmt 43.15 80.78 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.453 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.16 164.41 17.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.942 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.3 mttp -116.68 154.93 29.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.921 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -86.96 170.72 11.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.933 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -59.88 -20.4 56.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.244 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -98.15 31.8 2.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.938 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 59.35 24.63 59.34 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.488 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 12.7 m-20 -78.88 -167.62 1.18 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.727 0.298 . . . . 0.0 110.779 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -147.0 126.82 13.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.867 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 59.6 t -95.07 -65.54 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.373 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.435 ' O ' HG13 ' A' ' 81' ' ' VAL . 4.5 p 34.11 78.26 0.33 Allowed Pre-proline 0 CA--C 1.53 0.188 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.855 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -44.02 124.14 4.58 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.891 2.394 . . . . 0.0 112.676 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.404 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 3.6 mtpt -84.59 159.57 58.08 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.965 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 4.1 Cg_exo -83.84 127.86 4.32 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 123.533 2.822 . . . . 0.0 112.402 -179.101 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -97.95 154.87 17.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.822 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.832 ' HG2' HG23 ' A' ' 63' ' ' ILE . 37.4 mtt180 -153.12 142.0 21.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.541 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.554 ' CE1' HG22 ' A' ' 40' ' ' VAL . 13.7 m80 -97.32 111.32 23.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.69 0.281 . . . . 0.0 110.349 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.465 ' HE1' ' HB3' ' B' ' 667' ' ' GLU . 7.5 ttt -94.08 112.97 24.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.997 0.427 . . . . 0.0 111.175 -179.487 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.8 ' CG ' HD11 ' A' ' 16' ' ' ILE . 90.8 m-85 -116.04 116.63 28.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.628 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -99.2 114.5 27.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.973 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.516 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 5.4 m-85 -95.04 133.66 38.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.149 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 37.5 m-20 -93.64 43.67 1.12 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.685 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.521 ' CB ' HG23 ' A' ' 96' ' ' VAL . 4.5 m-20 176.8 109.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.409 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.459 ' O ' ' HG3' ' A' ' 97' ' ' MET . 0.0 OUTLIER -52.96 -21.06 3.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.959 -179.995 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.34 -44.97 70.55 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 120.831 0.348 . . . . 0.0 110.633 179.767 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.521 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -66.17 -49.84 73.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.882 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.459 ' HG3' ' O ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -62.73 -36.57 83.43 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.351 179.5 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.453 ' O ' ' HG2' ' A' ' 102' ' ' MET . 8.6 t70 -67.6 -35.1 78.33 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.047 0.451 . . . . 0.0 110.053 179.445 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 68.6 m-20 -82.23 -29.58 31.25 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.712 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.517 HD11 ' N ' ' A' ' 5' ' ' GLY . 1.2 mm -83.19 -59.91 2.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.471 -179.512 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 6.6 ttmt -44.41 -28.69 0.58 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.328 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.453 ' HG2' ' O ' ' A' ' 98' ' ' ASP . 6.3 ptm -79.85 -40.29 28.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.424 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.657 HG21 ' O ' ' A' ' 2' ' ' SER . 0.2 OUTLIER -57.79 -58.89 6.38 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.715 179.563 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.959 HD13 HD11 ' A' ' 48' ' ' LEU . 4.7 mt -47.16 -50.48 20.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.76 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.489 HE22 ' HA ' ' B' ' 675' ' ' THR . 6.6 mm100 -56.65 -50.59 71.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.316 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.432 ' HG2' HG13 ' A' ' 107' ' ' ILE . 1.2 pt20 -50.88 -31.3 17.02 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 121.022 0.439 . . . . 0.0 110.921 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.038 HG22 ' HE1' ' A' ' 111' ' ' TYR . 8.4 mt -85.61 -52.94 11.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.652 179.508 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.732 HG21 HG21 ' B' ' 675' ' ' THR . 0.9 OUTLIER -42.51 -56.78 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.808 179.614 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.427 ' HA ' ' HG2' ' A' ' 112' ' ' LYS . 41.2 t -47.83 -26.57 1.7 Allowed 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.264 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 0.0 OUTLIER -74.75 -24.84 58.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.715 179.816 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 1.038 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -74.08 -34.2 63.91 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 179.154 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.765 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.76 -43.22 17.01 Favored 'General case' 0 CA--C 1.505 -0.753 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 179.059 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -61.67 -32.2 72.37 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.901 -1.5 . . . . 0.0 108.992 178.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.453 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.68 -18.73 22.63 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.556 178.702 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 27.2 t0 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.209 -0.9 . . . . 0.0 111.131 179.97 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.836 0.351 . . . . 0.0 111.161 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -92.01 -31.48 15.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.906 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -176.95 95.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.862 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 21.6 t 62.93 83.01 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.072 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 665' ' ' LEU . . . . . 0.404 HD13 ' H ' ' B' ' 666' ' ' SER . 0.1 OUTLIER -143.82 147.09 33.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.858 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 666' ' ' SER . . . . . 0.41 ' HB3' HD11 ' B' ' 669' ' ' LEU . 1.0 OUTLIER -167.42 91.46 0.37 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.854 -179.987 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 667' ' ' GLU . . . . . 0.465 ' HB3' ' HE1' ' A' ' 88' ' ' MET . 3.9 pm0 -94.18 19.14 9.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.134 0.492 . . . . 0.0 111.568 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -102.7 -20.88 14.21 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.103 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.41 HD11 ' HB3' ' B' ' 666' ' ' SER . 0.5 OUTLIER -108.93 19.86 19.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.129 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 670' ' ' PHE . . . . . 0.435 ' CD1' ' HA ' ' B' ' 667' ' ' GLU . 2.2 m-85 -68.46 126.39 29.48 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.877 0.37 . . . . 0.0 110.83 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -100.97 171.08 7.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.876 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -110.94 118.57 36.45 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.946 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 673' ' ' VAL . . . . . . . . . . . . . 4.1 t -66.24 135.23 94.89 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.843 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 674' ' ' PRO . . . . . 0.474 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 56.9 Cg_endo -70.71 128.36 15.06 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.443 2.095 . . . . 0.0 112.406 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 675' ' ' THR . . . . . 0.732 HG21 HG21 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -125.04 153.7 42.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.724 179.848 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.73 146.16 37.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.967 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 3.9 m -173.81 103.09 0.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.896 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -99.7 172.28 7.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.892 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 679' ' ' ILE . . . . . 0.646 ' N ' HD13 ' B' ' 679' ' ' ILE . 0.2 OUTLIER -151.02 30.98 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.15 -179.963 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 1.7 m . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.228 -0.892 . . . . 0.0 110.884 -179.986 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo . . . . . 0 N--CA 1.487 1.109 0 CA-C-O 121.01 0.337 . . . . 0.0 111.894 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -79.32 -34.56 42.2 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.912 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.411 ' NE2' ' HB2' ' A' ' 20' ' ' GLU . 26.1 m170 -97.32 26.26 4.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.055 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.553 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 50.7 p -160.99 155.18 22.9 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.081 0.467 . . . . 0.0 111.087 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.439 ' O ' ' HB ' ' A' ' 16' ' ' ILE . . . 172.67 136.36 2.14 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.284 -179.63 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.576 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -79.79 138.08 37.16 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.102 0.477 . . . . 0.0 112.086 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.67 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -147.11 171.6 15.06 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.535 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.651 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.15 129.95 51.35 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.254 -179.884 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.538 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 62.2 t80 -124.34 109.81 13.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.979 0.418 . . . . 0.0 111.418 178.644 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 61.59 45.35 8.23 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.643 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.7 mtpp 78.19 -4.48 2.2 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 179.208 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.467 ' O ' HG23 ' A' ' 8' ' ' ILE . 28.2 t -99.94 150.82 5.19 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.466 0 CA-C-O 121.119 0.485 . . . . 0.0 110.369 179.345 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.403 ' HA ' HD12 ' A' ' 8' ' ' ILE . 90.5 p -105.69 116.0 31.19 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.127 -179.65 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.425 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -138.54 -158.55 7.77 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.13 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.576 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 18.7 mm -119.8 131.82 71.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.765 0.317 . . . . 0.0 111.325 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.861 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.4 OUTLIER -101.19 114.02 39.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.949 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -123.1 115.89 22.57 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.582 0.706 . . . . 0.0 110.831 -179.262 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.766 HD13 HG22 ' A' ' 103' ' ' THR . 15.7 mt -85.25 142.9 12.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 114.749 -1.114 . . . . 0.0 111.891 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.602 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.7 m120 -117.77 97.44 5.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.279 179.416 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.411 ' HB2' ' NE2' ' A' ' 3' ' ' HIS . 0.0 OUTLIER -84.1 -1.81 55.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.299 -179.757 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -82.92 1.37 39.94 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.486 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -98.35 -162.41 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.846 0.355 . . . . 0.0 110.943 180.0 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.0 p -173.97 99.98 0.3 Allowed Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.345 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.476 ' CG ' ' HB2' ' A' ' 43' ' ' SER . 56.6 Cg_endo -71.09 164.29 83.34 Favored 'Cis proline' 0 C--N 1.346 0.427 0 C-N-CA 123.605 -1.415 . . . . 0.0 112.867 0.361 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.582 ' CB ' HG21 ' A' ' 107' ' ' ILE . . . -54.99 -175.84 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.978 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -163.53 147.11 10.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.629 0.728 . . . . 0.0 112.482 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.693 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 2.8 tt -108.2 149.01 29.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.646 -1.161 . . . . 0.0 108.466 178.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.755 HG23 HG23 ' A' ' 39' ' ' THR . 0.2 OUTLIER -145.42 102.6 3.73 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -178.676 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.538 ' CE2' ' HB3' ' A' ' 9' ' ' PHE . 78.4 t90 -92.13 114.04 26.48 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.735 178.304 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.457 ' O ' ' N ' ' A' ' 15' ' ' ILE . 12.6 ptp180 -114.83 135.13 54.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.639 0.256 . . . . 0.0 110.534 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.5 m -49.81 158.24 0.5 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.717 0.294 . . . . 0.0 110.499 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 32.4 m -72.49 -36.0 68.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.416 0.627 . . . . 0.0 109.707 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -86.13 -18.26 32.78 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.024 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.76 32.56 9.94 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.439 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -85.79 -21.58 28.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.592 0.234 . . . . 0.0 111.52 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.1 158.71 2.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.356 0.598 . . . . 0.0 111.422 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.488 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.68 140.39 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.945 -178.72 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.496 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 0.6 OUTLIER -115.86 125.51 52.75 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.587 179.539 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.755 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -98.07 146.19 25.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.054 -179.677 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.693 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.2 t -129.91 136.7 58.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.144 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.422 ' O ' HG12 ' A' ' 45' ' ' ILE . 47.8 t -104.04 95.86 4.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.427 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.678 HD11 HD22 ' A' ' 104' ' ' LEU . 0.9 OUTLIER -41.93 -24.97 0.05 Allowed 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.642 -178.81 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.476 ' HB2' ' CG ' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -72.99 -51.27 18.91 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 178.621 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 30.8 p -64.93 -28.41 69.51 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 178.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.849 HD12 ' HB3' ' A' ' 62' ' ' LEU . 42.1 mm -56.39 103.31 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.22 178.682 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 63' ' ' ILE . 16.9 t70 -54.53 -31.93 57.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.154 -0.476 . . . . 0.0 112.048 -179.19 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.427 ' O ' ' CG2' ' A' ' 45' ' ' ILE . 53.2 mtmt -157.6 162.97 38.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.539 0.685 . . . . 0.0 112.285 -179.463 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.675 HD13 HD11 ' A' ' 108' ' ' ILE . 9.0 tp -111.52 121.68 45.82 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.118 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.615 ' NE2' HD11 ' A' ' 63' ' ' ILE . 12.0 mt-30 -125.01 136.44 53.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.62 0.247 . . . . 0.0 111.181 -179.511 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.671 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.07 141.23 16.37 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.041 179.61 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.851 HG22 ' HB3' ' B' ' 670' ' ' PHE . 37.4 p -60.34 149.42 76.65 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.241 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -78.27 163.31 27.72 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.707 2.271 . . . . 0.0 112.361 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.11 -28.82 70.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.287 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.84 -17.07 62.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.194 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.511 ' CB ' HD21 ' B' ' 669' ' ' LEU . 47.3 t -71.14 122.05 19.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.033 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.02 -17.45 10.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.369 179.009 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.926 ' HE3' ' HE2' ' A' ' 59' ' ' MET . 0.0 OUTLIER -118.97 167.62 11.57 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.235 179.523 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.429 ' HB2' ' HG2' ' A' ' 97' ' ' MET . 0.9 OUTLIER -127.33 129.36 47.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.177 0.513 . . . . 0.0 111.351 -179.8 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.926 ' HE2' ' HE3' ' A' ' 57' ' ' LYS . 7.8 ttp -149.95 138.03 20.34 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.845 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.671 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 26.7 mt -119.51 150.18 40.68 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.117 178.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.561 ' N ' ' O ' ' A' ' 49' ' ' GLN . 2.3 ttt180 -150.91 148.18 28.11 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -178.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.849 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.3 mp -128.6 118.78 23.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.896 178.293 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.615 HD11 ' NE2' ' A' ' 49' ' ' GLN . 25.0 mm -76.53 156.45 5.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.649 0.262 . . . . 0.0 111.033 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.445 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -117.36 146.09 18.7 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.524 -179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 32.2 mttt -65.0 119.96 11.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.802 0.334 . . . . 0.0 110.829 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.48 HG22 ' N ' ' A' ' 67' ' ' ASP . 12.9 p -98.2 160.5 3.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.081 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.48 ' N ' HG22 ' A' ' 66' ' ' VAL . 16.6 m-20 -115.66 40.24 2.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.009 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.506 ' HA ' HG13 ' A' ' 81' ' ' VAL . 20.8 pt-20 -64.6 -21.06 66.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.058 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 41.5 t -88.69 -22.81 23.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.106 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.6 mmmt -83.97 -41.01 17.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.865 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.609 ' HG2' HG22 ' A' ' 81' ' ' VAL . 16.1 mtmt 61.98 93.23 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.028 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.408 ' N ' ' O ' ' A' ' 80' ' ' VAL . 0.0 OUTLIER -61.83 -176.46 0.09 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.708 179.862 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -141.75 -170.54 3.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.795 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -125.21 -68.08 0.86 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.12 0.486 . . . . 0.0 111.043 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 179.24 -33.36 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.105 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -95.95 38.47 1.18 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.931 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 72.13 8.24 69.17 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.768 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -60.02 -173.74 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.809 0.338 . . . . 0.0 110.924 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -154.11 137.12 15.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.864 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.408 ' O ' ' N ' ' A' ' 72' ' ' ARG . 2.1 t -128.35 145.13 35.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.35 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.609 HG22 ' HG2' ' A' ' 71' ' ' LYS . 81.5 t -123.46 69.96 43.89 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.129 179.231 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_exo -43.1 124.7 3.87 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.789 2.326 . . . . 0.0 112.724 -179.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.3 mmtt -59.56 164.32 5.56 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.094 0.473 . . . . 0.0 110.978 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.439 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 4.6 Cg_exo -81.21 105.63 1.65 Allowed 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 123.601 2.867 . . . . 0.0 112.284 -179.141 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.06 152.52 40.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.119 -179.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.477 ' NE ' HD12 ' A' ' 63' ' ' ILE . 30.2 mtt180 -155.45 137.23 14.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.286 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.585 ' CE1' HG22 ' A' ' 40' ' ' VAL . 10.6 m80 -97.82 111.52 23.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.637 0.256 . . . . 0.0 110.558 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.494 ' HE1' ' HB3' ' B' ' 667' ' ' GLU . 0.0 OUTLIER -99.85 122.45 42.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.941 0.401 . . . . 0.0 110.899 -179.925 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.861 ' CD1' HD11 ' A' ' 16' ' ' ILE . 79.5 m-85 -125.58 116.87 22.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.775 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.437 ' HA ' ' HG3' ' A' ' 59' ' ' MET . 0.8 OUTLIER -95.83 114.55 26.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.145 -179.788 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.67 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 23.6 m-85 -91.42 158.63 16.4 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.169 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 -115.61 29.94 7.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.552 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.5 ' CB ' HG23 ' A' ' 96' ' ' VAL . 4.2 m-20 -173.43 115.84 0.25 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.532 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.449 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 10.4 ttp85 -58.95 -15.92 15.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.017 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.45 -43.7 54.99 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 121.03 0.443 . . . . 0.0 110.174 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.5 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -67.75 -48.48 75.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.437 179.102 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.449 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -62.05 -36.08 80.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.998 179.153 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.424 ' N ' ' HG3' ' A' ' 97' ' ' MET . 2.0 m-20 -62.57 -33.87 75.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.255 179.335 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 16.6 m-20 -81.87 -30.44 32.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.613 179.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.529 HG23 HD11 ' A' ' 18' ' ' ILE . 3.7 mm -79.53 -60.28 2.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.982 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.411 ' HG3' ' CB ' ' A' ' 50' ' ' ALA . 12.0 ttmt -51.85 -28.19 15.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.537 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 12.4 mtm -81.88 -29.39 32.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.941 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.766 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -82.42 -41.44 19.88 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.123 179.894 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.678 HD22 HD11 ' A' ' 42' ' ' LEU . 32.6 mt -56.81 -52.5 64.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.017 0.437 . . . . 0.0 109.855 179.131 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.662 ' HG2' HD23 ' A' ' 48' ' ' LEU . 5.3 mm-40 -61.98 -48.05 82.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.012 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -47.24 -33.06 5.07 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.985 0.422 . . . . 0.0 111.014 -179.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.043 HG22 ' HE1' ' A' ' 111' ' ' TYR . 3.5 mt -85.77 -52.14 12.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.68 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.716 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.14 -59.34 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.63 179.758 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -47.08 -24.89 0.73 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.228 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.447 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 49.8 mtp85 -74.69 -25.31 59.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.385 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 1.043 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -76.18 -34.19 59.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.184 0.516 . . . . 0.0 109.611 179.656 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.739 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.21 -43.61 19.0 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 178.98 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -62.29 -31.67 72.3 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 113.737 -1.574 . . . . 0.0 109.07 178.263 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.447 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.68 -18.4 23.05 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.676 178.722 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 24.1 t70 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.257 -0.878 . . . . 0.0 111.073 179.896 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.887 0.375 . . . . 0.0 111.17 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -104.42 -39.8 6.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.883 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 60.84 92.46 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.941 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 664' ' ' VAL . . . . . 0.57 HG23 ' O ' ' B' ' 664' ' ' VAL . 19.6 m -144.48 80.03 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.083 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 665' ' ' LEU . . . . . 0.829 HD11 ' SD ' ' A' ' 59' ' ' MET . 0.2 OUTLIER 61.77 152.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.886 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 666' ' ' SER . . . . . 0.731 ' H ' HD13 ' B' ' 665' ' ' LEU . 1.2 t -153.42 87.17 1.23 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.434 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 667' ' ' GLU . . . . . 0.494 ' HB3' ' HE1' ' A' ' 88' ' ' MET . 0.6 OUTLIER -88.32 18.82 4.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.901 -179.542 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -105.96 8.3 32.42 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.913 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.912 HD13 ' N ' ' B' ' 670' ' ' PHE . 0.0 OUTLIER -120.4 -17.81 8.08 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.557 -179.618 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 670' ' ' PHE . . . . . 0.912 ' N ' HD13 ' B' ' 669' ' ' LEU . 0.0 OUTLIER -82.46 153.47 25.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.873 0.368 . . . . 0.0 111.207 -179.634 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -126.22 171.25 11.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.172 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -71.48 148.72 46.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.173 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 673' ' ' VAL . . . . . 0.56 HG22 ' HB3' ' A' ' 50' ' ' ALA . 10.8 t -80.61 143.77 55.42 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.961 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 674' ' ' PRO . . . . . 0.425 ' HD2' HG12 ' B' ' 673' ' ' VAL . 14.3 Cg_exo -69.24 128.22 16.18 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.615 2.21 . . . . 0.0 112.949 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 675' ' ' THR . . . . . 0.581 HG23 HE22 ' A' ' 105' ' ' GLN . 0.0 OUTLIER -122.93 -159.39 0.84 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.666 179.149 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 676' ' ' LYS . . . . . 0.465 ' HB3' ' HG3' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -45.91 155.48 0.18 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.802 0.335 . . . . 0.0 111.29 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 6.7 t -162.52 140.76 8.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.844 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -146.78 121.92 10.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.903 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 26.3 mt 63.25 84.71 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.059 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 30.3 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.165 -0.922 . . . . 0.0 110.909 179.942 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_endo . . . . . 0 N--CA 1.488 1.168 0 CA-C-O 120.816 0.257 . . . . 0.0 111.81 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.75 -37.48 10.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.822 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.407 ' NE2' ' HB2' ' A' ' 20' ' ' GLU . 29.8 m170 -89.95 16.12 8.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.359 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.57 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 3.5 p -152.65 155.28 37.0 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.046 0.451 . . . . 0.0 111.051 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.499 ' O ' ' HB ' ' A' ' 16' ' ' ILE . . . 174.29 139.97 3.13 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 111.101 -0.799 . . . . 0.0 111.101 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.555 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -84.04 143.99 29.38 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.206 0.527 . . . . 0.0 112.333 -178.694 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.55 ' C ' HD13 ' A' ' 8' ' ' ILE . . . -153.48 171.26 18.96 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.19 -179.27 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.668 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.99 123.49 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.563 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.468 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.6 t80 -123.85 109.55 13.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.978 0.418 . . . . 0.0 111.082 178.317 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 30.6 mt-10 67.84 51.27 0.79 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.735 179.087 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.8 mmtp 69.07 -2.74 1.69 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.264 -0.425 . . . . 0.0 112.12 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.476 ' O ' HG23 ' A' ' 8' ' ' ILE . 20.1 t -102.81 148.79 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.47 0 CA-C-O 121.096 0.474 . . . . 0.0 110.625 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.459 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -111.22 112.47 24.27 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.941 179.835 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.89 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.42 -134.62 3.63 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.829 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.89 HD13 ' O ' ' A' ' 14' ' ' GLY . 18.0 mm -135.85 135.62 50.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.721 0.296 . . . . 0.0 111.332 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.94 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.57 141.23 17.77 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.66 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 176.476 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.57 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -150.93 117.44 5.73 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 119.574 -0.851 . . . . 0.0 111.489 -178.741 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.958 HD13 HG22 ' A' ' 103' ' ' THR . 6.2 mt -87.12 142.28 13.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 114.565 -1.198 . . . . 0.0 111.703 -178.785 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.633 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.5 t-20 -120.13 92.99 3.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.467 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.407 ' HB2' ' NE2' ' A' ' 3' ' ' HIS . 0.1 OUTLIER -80.69 -0.05 36.54 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.411 -179.862 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -82.93 0.53 43.97 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.289 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.633 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -101.59 -162.5 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.844 0.354 . . . . 0.0 110.853 179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.5 t -174.06 101.33 0.3 Allowed Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.504 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.439 ' HB3' ' OG ' ' A' ' 43' ' ' SER . 61.1 Cg_endo -73.15 160.3 95.95 Favored 'Cis proline' 0 C--N 1.347 0.486 0 C-N-CA 123.455 -1.477 . . . . 0.0 112.758 0.367 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.412 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -52.15 175.39 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.52 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.466 ' CG ' HG21 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -163.65 136.31 5.24 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.14 179.343 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.815 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.99 149.15 28.74 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.787 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.709 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.5 m -135.15 112.97 10.92 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -178.368 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.556 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 79.4 t90 -92.04 110.64 22.02 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 178.318 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 15' ' ' ILE . 4.2 ttt180 -110.4 131.23 55.24 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.972 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.7 t -49.83 158.86 0.44 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.475 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.416 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 46.1 m -74.74 -37.18 62.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.459 0.647 . . . . 0.0 109.773 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -84.37 -15.96 44.53 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.124 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.59 34.55 11.55 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.322 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -85.37 -26.8 26.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.742 0.306 . . . . 0.0 111.309 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.31 164.24 3.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.319 0.58 . . . . 0.0 111.441 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.709 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.64 147.0 18.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.041 -178.769 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 36.9 m-70 -121.01 119.86 33.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.587 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.43 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.43 142.85 28.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.803 -179.905 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.522 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.1 t -131.54 140.22 48.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.49 -179.437 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.416 ' O ' HG12 ' A' ' 45' ' ' ILE . 49.9 t -103.79 96.43 4.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 177.663 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.782 HD11 HD22 ' A' ' 104' ' ' LEU . 0.8 OUTLIER -41.94 -24.77 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.931 -178.819 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.439 ' OG ' ' HB3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -74.54 -49.09 23.3 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.535 -0.542 . . . . 0.0 109.535 179.218 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 46.6 p -64.64 -27.82 69.19 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.878 HD12 ' HB3' ' A' ' 62' ' ' LEU . 43.2 mm -56.66 106.92 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.623 178.85 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.424 ' N ' ' O ' ' A' ' 63' ' ' ILE . 19.5 t70 -52.56 -30.88 33.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.119 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.436 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 11.0 pttt -172.49 163.8 5.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.97 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.993 HD11 HD13 ' A' ' 104' ' ' LEU . 21.2 tp -108.95 116.68 32.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.56 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -110.92 144.14 40.46 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.61 0.243 . . . . 0.0 110.439 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.642 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.09 148.9 22.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.619 0.247 . . . . 0.0 111.277 -179.588 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.623 HG23 ' HB2' ' A' ' 59' ' ' MET . 19.6 p -58.82 134.15 86.73 Favored Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.888 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.68 163.27 38.96 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.568 2.178 . . . . 0.0 112.288 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.58 -31.82 64.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.133 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.5 m -70.84 -15.92 62.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.2 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.788 ' OG ' HD13 ' B' ' 669' ' ' LEU . 8.6 t -75.31 119.91 20.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.955 0.407 . . . . 0.0 110.954 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -60.68 -14.1 18.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.683 179.294 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.404 ' HE3' HD11 ' B' ' 665' ' ' LEU . 0.0 OUTLIER -112.81 174.13 6.05 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.937 179.884 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.402 ' HG2' ' CA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -131.55 114.35 14.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.875 -179.933 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.623 ' HB2' HG23 ' A' ' 51' ' ' THR . 1.8 mpp? -144.58 138.49 27.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.286 -179.805 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.642 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 15.2 mt -118.71 140.37 50.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.313 178.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.403 ' HD3' ' CB ' ' A' ' 88' ' ' MET . 25.5 ttp180 -141.33 150.42 42.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.076 0.465 . . . . 0.0 112.017 -179.106 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.878 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -128.41 114.13 16.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.836 178.407 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.488 ' HA ' ' HB3' ' A' ' 86' ' ' ARG . 6.7 mm -76.77 156.52 5.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.659 0.266 . . . . 0.0 111.043 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -118.71 159.56 14.35 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.509 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.3 mtpt -59.05 115.1 2.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.809 0.337 . . . . 0.0 110.837 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.482 HG22 ' N ' ' A' ' 67' ' ' ASP . 13.3 p -100.98 159.79 3.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.312 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.482 ' N ' HG22 ' A' ' 66' ' ' VAL . 19.7 p-10 -100.39 43.94 1.04 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.798 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.95 -12.07 61.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.308 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -55.0 -24.36 23.88 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.937 0.399 . . . . 0.0 111.115 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.6 mmmt -74.98 -69.36 0.47 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.687 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 42.97 82.31 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.241 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.402 ' HD3' ' C ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -129.33 168.01 16.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.277 -179.925 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 18.0 mmtp -80.45 -166.91 1.17 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.699 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -109.42 -48.65 3.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.057 0.456 . . . . 0.0 110.931 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 168.87 -31.46 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.089 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -100.13 -16.57 17.78 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.324 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 135.54 -7.05 4.25 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.95 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -57.61 -166.11 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.734 0.302 . . . . 0.0 110.904 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -146.39 131.11 17.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.743 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.4 t -95.08 -66.51 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.5 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.444 ' O ' HG13 ' A' ' 81' ' ' VAL . 4.4 p 34.53 81.24 0.24 Allowed Pre-proline 0 CA--C 1.53 0.199 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.684 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_exo -42.11 128.25 4.16 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.954 2.436 . . . . 0.0 112.823 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.0 159.07 85.68 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.949 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -84.78 151.39 11.36 Favored 'Trans proline' 0 N--CA 1.461 -0.44 0 C-N-CA 123.492 2.795 . . . . 0.0 112.488 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -104.71 114.26 28.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.776 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.488 ' HB3' ' HA ' ' A' ' 63' ' ' ILE . 23.2 ptt-85 -123.5 146.22 48.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.798 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.418 ' CE1' HG22 ' A' ' 40' ' ' VAL . 2.7 m80 -99.74 111.01 23.37 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.403 ' CB ' ' HD3' ' A' ' 61' ' ' ARG . 15.4 ttt -94.19 136.31 34.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.071 0.462 . . . . 0.0 111.818 -179.04 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.94 ' CD2' HD11 ' A' ' 16' ' ' ILE . 19.3 m-85 -133.51 116.69 16.27 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.365 179.397 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.422 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.8 OUTLIER -87.1 115.94 24.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.968 0.413 . . . . 0.0 110.793 -179.959 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.47 ' CE2' HG13 ' A' ' 100' ' ' ILE . 8.6 m-85 -91.1 137.54 32.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.592 -179.653 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -101.62 29.4 4.9 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.532 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.463 ' CB ' HG23 ' A' ' 96' ' ' VAL . 4.9 m-20 -175.97 119.95 0.16 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.432 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.474 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 10.7 ttp85 -60.98 -15.06 27.26 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.718 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -75.67 -47.57 25.71 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.954 0.407 . . . . 0.0 110.387 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.463 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -66.91 -42.86 89.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.722 179.286 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.474 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -65.76 -36.95 85.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.953 179.415 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.412 ' N ' ' HG3' ' A' ' 97' ' ' MET . 6.4 m-20 -65.25 -27.24 68.51 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.269 179.047 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.452 ' O ' ' HG2' ' A' ' 102' ' ' MET . 66.9 m-20 -81.74 -52.49 7.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.599 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.835 HG22 HD11 ' A' ' 104' ' ' LEU . 12.6 mm -63.16 -59.3 4.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.094 0.473 . . . . 0.0 110.488 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.52 ' HA ' HD12 ' A' ' 104' ' ' LEU . 6.4 ttmt -47.33 -36.31 9.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.415 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.452 ' HG2' ' O ' ' A' ' 99' ' ' ASN . 7.7 ptp -83.47 -37.78 22.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.726 -179.23 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.958 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -70.9 -27.68 63.97 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.181 -178.954 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.993 HD13 HD11 ' A' ' 48' ' ' LEU . 5.4 mt -71.22 -43.34 67.53 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.41 ' HA ' HG13 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -62.97 -50.39 70.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.243 -0.889 . . . . 0.0 112.449 -179.448 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.49 ' HG3' ' O ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -49.29 -30.29 7.17 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.072 0.463 . . . . 0.0 110.656 -179.295 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.02 HG22 ' HE1' ' A' ' 111' ' ' TYR . 9.0 mt -85.03 -52.72 12.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.412 179.314 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.674 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.39 -56.75 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.298 179.396 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -46.88 -28.15 1.49 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.295 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.542 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.0 OUTLIER -73.46 -25.01 60.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.177 179.73 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 1.02 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -74.04 -35.22 64.32 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 179.576 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.751 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.28 -42.89 18.23 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 179.019 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -61.54 -32.03 72.08 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.014 -1.448 . . . . 0.0 108.957 178.076 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.444 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.58 -18.95 22.44 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.752 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.8 t0 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.235 -0.888 . . . . 0.0 111.045 179.998 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 17.4 p-10 . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.859 0.361 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 662' ' ' LEU . . . . . 0.645 HD23 ' HB2' ' B' ' 663' ' ' GLU . 8.7 tt -60.43 -48.25 82.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.852 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 663' ' ' GLU . . . . . 0.645 ' HB2' HD23 ' B' ' 662' ' ' LEU . 13.0 tt0 -176.86 80.02 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.989 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 21.5 t 64.35 94.41 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.1 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 665' ' ' LEU . . . . . 0.735 ' CD1' HD21 ' B' ' 669' ' ' LEU . 1.9 pt? -95.07 167.18 11.54 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.905 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 666' ' ' SER . . . . . 0.481 ' O ' ' CD1' ' B' ' 670' ' ' PHE . 0.1 OUTLIER -179.53 -73.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.036 0.446 . . . . 0.0 111.13 179.9 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -94.02 19.44 9.11 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.614 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -92.64 -46.26 7.68 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.537 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.788 HD13 ' OG ' ' A' ' 55' ' ' SER . 4.6 pp -120.53 20.01 11.88 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.472 -179.679 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 670' ' ' PHE . . . . . 0.481 ' CD1' ' O ' ' B' ' 666' ' ' SER . 1.5 m-85 -88.5 141.68 28.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.904 0.383 . . . . 0.0 111.275 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -128.66 126.91 41.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.622 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -67.78 108.85 3.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.121 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 673' ' ' VAL . . . . . 0.771 HG21 HD23 ' A' ' 48' ' ' LEU . 33.8 m -58.22 138.37 84.47 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.727 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -54.6 127.98 28.33 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.276 1.984 . . . . 0.0 112.427 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -139.47 116.94 11.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.684 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 11.4 pttt -179.52 161.71 1.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.944 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 94.5 p -111.14 -22.64 11.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.223 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 59.5 95.28 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.888 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 679' ' ' ILE . . . . . 0.679 HD13 ' H ' ' B' ' 679' ' ' ILE . 0.2 OUTLIER -139.34 31.28 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.164 179.956 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.934 179.991 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo . . . . . 0 N--CA 1.489 1.248 0 CA-C-O 120.838 0.266 . . . . 0.0 111.827 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.4 ' HA ' ' HB3' ' A' ' 99' ' ' ASN . 0.1 OUTLIER -104.34 -37.54 7.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.824 -179.975 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.662 ' HA ' HG21 ' A' ' 103' ' ' THR . 1.6 t-160 -61.39 -13.07 17.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.826 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.462 ' C ' HD11 ' A' ' 100' ' ' ILE . 0.5 OUTLIER -137.99 161.7 36.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.023 0.44 . . . . 0.0 110.875 179.881 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.531 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 171.54 138.76 2.61 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 111.168 -0.773 . . . . 0.0 111.168 -179.612 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.556 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -84.13 140.95 31.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.075 0.464 . . . . 0.0 112.228 -178.732 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.563 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -149.65 171.25 16.97 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.254 -179.309 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.661 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.93 125.12 56.12 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.707 -179.667 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.476 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.5 t80 -125.28 109.49 12.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.912 0.387 . . . . 0.0 111.12 178.452 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 47.1 mt-10 67.51 49.15 1.03 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.9 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 mmmt 71.76 -4.88 1.8 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.225 -0.443 . . . . 0.0 112.17 179.249 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.462 ' O ' HG23 ' A' ' 8' ' ' ILE . 17.1 t -100.91 148.72 6.75 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.458 0 CA-C-O 121.087 0.47 . . . . 0.0 110.526 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.459 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -111.6 113.09 25.27 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.898 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.877 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.4 -133.29 3.47 Favored Glycine 0 N--CA 1.445 -0.713 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.03 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.877 HD13 ' O ' ' A' ' 14' ' ' GLY . 19.4 mm -136.31 135.9 49.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 120.648 0.261 . . . . 0.0 111.297 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.879 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.81 140.8 18.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 106.452 -1.684 . . . . 0.0 106.452 176.637 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.447 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.32 117.17 5.49 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 121.687 0.756 . . . . 0.0 111.244 -178.803 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.825 HD13 ' HB ' ' A' ' 103' ' ' THR . 7.5 mt -81.73 143.22 12.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 114.481 -1.236 . . . . 0.0 112.578 -178.275 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -126.17 111.71 14.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.245 179.23 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.451 ' HG2' ' NE2' ' A' ' 3' ' ' HIS . 0.0 OUTLIER -100.41 -2.58 33.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.261 -179.541 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.87 -4.87 40.48 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.985 0.421 . . . . 0.0 110.241 178.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.437 HG21 ' CG ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -92.29 -159.7 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.176 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.427 179.784 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.428 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 33.4 p -179.27 99.29 0.2 Allowed Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.545 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.451 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 10.6 Cg_exo -71.04 164.97 81.54 Favored 'Cis proline' 0 C--N 1.347 0.471 0 C-N-CA 123.697 -1.376 . . . . 0.0 112.625 0.322 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.439 ' CB ' HG21 ' A' ' 107' ' ' ILE . . . -56.14 176.15 0.08 Allowed 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.562 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.518 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.84 139.6 6.41 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.017 178.97 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.777 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.4 OUTLIER -107.71 146.37 32.19 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 178.722 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.69 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.0 OUTLIER -128.49 112.93 14.87 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -178.201 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.535 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 78.5 t90 -92.13 110.63 22.01 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.04 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.488 ' O ' ' N ' ' A' ' 15' ' ' ILE . 18.9 ttm180 -110.6 131.55 54.95 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.67 0.271 . . . . 0.0 110.934 -179.802 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.3 m -49.97 159.33 0.42 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.489 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.415 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 42.5 m -74.91 -37.1 62.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.358 0.599 . . . . 0.0 109.737 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -84.91 -15.96 42.76 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.184 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.94 34.28 11.23 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.311 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -85.26 -26.22 26.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.722 0.296 . . . . 0.0 111.386 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.43 164.79 3.18 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.24 0.543 . . . . 0.0 111.546 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.69 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.35 146.89 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.051 -178.822 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 30.9 m-70 -121.04 120.33 35.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.614 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.62 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.42 138.8 33.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.691 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.572 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -125.32 140.43 48.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.458 -179.623 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.538 ' CG1' HG23 ' A' ' 44' ' ' THR . 44.1 t -104.08 94.42 3.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 177.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.665 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.6 OUTLIER -42.1 -24.8 0.05 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.088 -0.506 . . . . 0.0 112.031 -178.864 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.451 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 1.2 t -76.02 -48.62 20.28 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.361 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.538 HG23 ' CG1' ' A' ' 41' ' ' VAL . 30.0 p -64.58 -27.88 69.25 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 178.485 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.86 HD12 ' HB3' ' A' ' 62' ' ' LEU . 44.8 mm -56.54 109.12 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.536 178.693 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 63' ' ' ILE . 24.3 t0 -53.22 -31.84 45.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.829 0.347 . . . . 0.0 110.933 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.414 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 11.2 pttt -172.66 164.65 5.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.836 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 1.054 HD11 HD13 ' A' ' 104' ' ' LEU . 8.2 tp -108.88 116.36 31.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.611 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -110.04 144.86 38.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.638 0.256 . . . . 0.0 110.542 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.656 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -156.98 145.74 19.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.634 0.254 . . . . 0.0 111.082 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.57 HG21 ' O ' ' A' ' 57' ' ' LYS . 54.5 p -60.11 143.14 88.83 Favored Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.724 0.297 . . . . 0.0 110.978 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.85 163.25 33.77 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.652 2.234 . . . . 0.0 112.436 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.98 -29.36 70.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.121 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.9 m -70.85 -18.12 62.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.131 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.3 t -97.28 115.51 27.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.945 0.402 . . . . 0.0 110.791 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -57.99 -17.59 18.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.753 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.687 ' HG3' HD22 ' B' ' 669' ' ' LEU . 10.3 mmmt -82.21 98.92 8.98 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.735 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.2 mpp? -83.11 111.07 18.56 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.771 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.533 ' HB2' HG23 ' A' ' 51' ' ' THR . 29.8 mtm -149.5 142.31 24.67 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.637 -179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.656 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 18.7 mt -119.47 143.37 47.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.065 178.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.421 ' HG3' ' O ' ' A' ' 87' ' ' HIS . 24.3 ttp180 -143.59 150.58 39.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.968 0.413 . . . . 0.0 111.699 -179.049 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.86 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.7 mp -128.02 115.18 18.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.776 178.631 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.458 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 6.4 mm -76.53 156.44 5.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.661 0.267 . . . . 0.0 110.89 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -120.4 144.36 17.07 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.484 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -58.85 122.3 13.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.801 0.334 . . . . 0.0 110.852 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.509 HG22 ' N ' ' A' ' 67' ' ' ASP . 14.6 p -95.38 159.53 2.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.313 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.509 ' N ' HG22 ' A' ' 66' ' ' VAL . 21.0 p-10 -108.01 55.62 0.64 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.877 -0.602 . . . . 0.0 109.857 179.173 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.95 41.45 1.0 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.371 -179.451 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 32.8 t -110.52 -19.68 12.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.082 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.9 mmtp -81.54 -55.43 4.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.857 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.477 ' HA ' HG23 ' A' ' 81' ' ' VAL . 0.6 OUTLIER 61.34 93.07 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.899 179.974 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -95.37 -173.71 2.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.918 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.432 ' CA ' HG23 ' A' ' 80' ' ' VAL . 0.0 OUTLIER -128.0 -176.63 3.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.712 179.779 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -106.09 -39.58 5.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.988 0.423 . . . . 0.0 110.81 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 165.14 -30.14 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.821 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -108.56 40.11 1.85 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.032 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 69.35 11.4 64.53 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.47 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.408 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 0.6 OUTLIER -56.6 -165.69 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.108 0 CA-C-O 120.692 0.282 . . . . 0.0 110.84 179.893 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -135.54 120.88 19.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.858 0.361 . . . . 0.0 111.016 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.432 HG23 ' CA ' ' A' ' 73' ' ' LYS . 63.0 t -91.99 -63.52 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.494 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.661 ' O ' HG12 ' A' ' 81' ' ' VAL . 0.9 OUTLIER 40.7 94.21 0.05 OUTLIER Pre-proline 0 CA--C 1.535 0.38 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.093 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -50.66 134.11 39.8 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.515 2.144 . . . . 0.0 112.478 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.73 161.53 73.93 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.915 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -82.44 145.58 13.37 Favored 'Trans proline' 0 N--CA 1.461 -0.426 0 C-N-CA 123.563 2.842 . . . . 0.0 112.278 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -94.87 157.97 15.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.0 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.87 138.54 3.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.761 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.487 ' CE1' HG22 ' A' ' 40' ' ' VAL . 2.5 m80 -100.73 111.34 23.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.834 0.349 . . . . 0.0 110.262 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.3 142.14 27.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.149 0.5 . . . . 0.0 111.406 -179.338 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.879 ' CD2' HD11 ' A' ' 16' ' ' ILE . 61.0 m-85 -139.86 116.83 11.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.574 179.792 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -91.22 115.16 27.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.926 0.393 . . . . 0.0 110.596 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.458 ' CE2' HG13 ' A' ' 100' ' ' ILE . 8.7 m-85 -91.05 136.85 32.8 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.533 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 20.2 m-20 -100.24 29.52 4.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.424 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.46 ' CB ' HG23 ' A' ' 96' ' ' VAL . 5.2 m-20 -175.58 116.74 0.15 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.541 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.481 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -57.2 -16.48 8.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.957 179.803 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.43 -49.75 21.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.852 0.358 . . . . 0.0 110.265 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.46 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -65.82 -41.52 90.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.637 179.26 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.481 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -66.67 -37.94 85.8 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.955 179.472 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.429 ' N ' ' HG3' ' A' ' 97' ' ' MET . 20.1 m-20 -66.67 -24.64 66.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.112 0.482 . . . . 0.0 109.921 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.4 ' HB3' ' HA ' ' A' ' 2' ' ' SER . 2.9 m-80 -81.71 -63.24 1.43 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.358 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.761 HG22 HD11 ' A' ' 104' ' ' LEU . 14.3 mm -53.48 -53.85 22.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.579 179.485 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.454 ' HA ' HD12 ' A' ' 104' ' ' LEU . 0.2 OUTLIER -51.4 -29.55 16.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.924 179.908 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 5.1 mtm -83.08 -48.11 10.94 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.132 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.825 ' HB ' HD13 ' A' ' 18' ' ' ILE . 0.2 OUTLIER -53.38 -58.11 8.27 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.109 179.554 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 1.054 HD13 HD11 ' A' ' 48' ' ' LEU . 3.9 mt -46.34 -53.34 11.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.192 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.441 ' NE2' ' O ' ' B' ' 674' ' ' PRO . 1.1 mt-30 -58.33 -45.58 87.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.167 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.438 ' HG2' HG13 ' A' ' 107' ' ' ILE . 0.5 OUTLIER -51.34 -32.95 27.4 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.048 0.452 . . . . 0.0 110.287 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.029 HG22 ' HE1' ' A' ' 111' ' ' TYR . 10.3 mt -85.82 -52.11 12.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.51 179.217 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.695 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.14 -57.22 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.56 179.623 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.25 -27.05 1.37 Allowed 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.597 -0.728 . . . . 0.0 111.067 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.439 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 27.1 mtt180 -73.25 -25.08 60.57 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.359 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 1.029 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -75.68 -34.15 60.42 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.734 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.762 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.66 -43.35 17.02 Favored 'General case' 0 CA--C 1.507 -0.7 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.945 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -61.44 -32.07 72.03 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 113.858 -1.519 . . . . 0.0 108.987 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.439 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.64 -18.88 22.48 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.666 178.729 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 37.6 t70 . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.301 -0.857 . . . . 0.0 111.092 179.9 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 661' ' ' ASP . . . . . 0.504 ' O ' HD22 ' B' ' 662' ' ' LEU . 1.1 m-20 . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.808 0.337 . . . . 0.0 111.213 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 662' ' ' LEU . . . . . 0.504 HD22 ' O ' ' B' ' 661' ' ' ASP . 4.4 mm? -122.84 -50.37 1.95 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.845 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 60.91 92.63 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.837 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 664' ' ' VAL . . . . . 0.416 HG23 ' OE1' ' B' ' 668' ' ' GLU . 6.2 m -139.23 77.22 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.144 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 665' ' ' LEU . . . . . 0.938 HD21 HD21 ' B' ' 669' ' ' LEU . 0.3 OUTLIER -97.5 109.95 22.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.891 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 666' ' ' SER . . . . . 0.434 ' O ' ' CD1' ' B' ' 670' ' ' PHE . 26.3 p -177.68 -80.37 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.992 0.425 . . . . 0.0 111.04 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -94.17 19.31 9.47 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.585 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 668' ' ' GLU . . . . . 0.416 ' OE1' HG23 ' B' ' 664' ' ' VAL . 0.5 OUTLIER -93.87 -39.31 10.77 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.117 -179.909 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.938 HD21 HD21 ' B' ' 665' ' ' LEU . 0.8 OUTLIER -120.58 19.89 11.87 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.215 179.939 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 670' ' ' PHE . . . . . 0.45 ' CE1' ' HB2' ' A' ' 59' ' ' MET . 1.5 m-85 -98.83 158.25 15.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.881 0.372 . . . . 0.0 111.06 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -149.87 126.99 11.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.829 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -60.62 123.71 18.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.049 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 673' ' ' VAL . . . . . 0.992 HG21 HD23 ' A' ' 48' ' ' LEU . 25.9 m -74.35 146.38 84.02 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.973 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 674' ' ' PRO . . . . . 0.441 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 45.7 Cg_exo -56.32 128.33 29.69 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.476 2.117 . . . . 0.0 112.288 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -139.15 116.96 11.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.802 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -178.75 166.0 1.67 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.92 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 54.0 p -126.03 38.87 4.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.939 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 -176.59 134.59 0.23 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.947 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 679' ' ' ILE . . . . . 0.466 HG23 ' O ' ' B' ' 679' ' ' ILE . 3.3 tt -149.48 53.59 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.998 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.911 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo . . . . . 0 N--CA 1.488 1.164 0 CA-C-O 120.87 0.279 . . . . 0.0 111.845 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.567 ' O ' HG21 ' A' ' 103' ' ' THR . 18.4 m -106.82 -31.56 8.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.888 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -84.76 13.91 5.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.456 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.558 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 2.6 p -154.0 150.41 28.24 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.303 0.573 . . . . 0.0 111.335 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.471 ' O ' ' HB ' ' A' ' 16' ' ' ILE . . . 178.64 138.68 3.25 Favored Glycine 0 N--CA 1.448 -0.511 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 -179.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.58 145.74 29.55 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.4 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.556 ' C ' HD13 ' A' ' 8' ' ' ILE . . . -154.41 171.38 19.43 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.337 -179.11 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.666 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.63 122.58 55.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.82 -179.466 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.454 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.6 t80 -123.1 109.35 13.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.949 0.404 . . . . 0.0 111.237 178.514 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.426 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 24.8 mt-10 68.11 49.07 0.89 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.812 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 13.1 mttm 71.5 -3.82 2.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.237 -0.438 . . . . 0.0 112.137 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.436 ' O ' HG23 ' A' ' 8' ' ' ILE . 18.2 t -101.68 148.5 7.37 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.55 0 CA-C-O 121.123 0.487 . . . . 0.0 110.587 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.456 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -110.7 112.89 25.08 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.806 179.865 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.888 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.5 -135.12 3.69 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.006 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.888 HD13 ' O ' ' A' ' 14' ' ' GLY . 18.2 mm -135.87 134.93 51.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.543 0 CA-C-O 120.608 0.242 . . . . 0.0 111.435 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.897 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.43 141.71 16.85 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.649 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 176.388 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.558 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -150.87 118.62 6.15 Favored 'General case' 0 C--N 1.31 -1.117 0 C-N-CA 119.64 -0.824 . . . . 0.0 111.542 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.764 HD13 ' HB ' ' A' ' 103' ' ' THR . 11.0 mt -86.71 142.02 13.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 114.697 -1.138 . . . . 0.0 111.887 -178.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.626 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.7 OUTLIER -118.97 93.1 3.98 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.316 179.452 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -80.79 0.02 36.64 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.33 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -82.66 0.6 42.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.624 0.249 . . . . 0.0 111.304 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.626 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.04 -162.76 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.807 0.337 . . . . 0.0 110.832 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.4 t -175.97 101.75 0.25 Allowed Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.339 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.446 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 11.0 Cg_exo -69.95 161.46 86.7 Favored 'Cis proline' 0 C--N 1.347 0.483 0 C-N-CA 123.597 -1.418 . . . . 0.0 112.619 0.282 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.647 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -54.76 178.49 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.3 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.457 ' CG ' HG21 ' A' ' 22' ' ' VAL . 2.5 pp20? -163.67 133.92 4.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.331 179.415 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.853 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.92 144.5 35.09 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 178.706 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.722 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.3 m -131.48 113.64 13.93 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.702 0.631 . . . . 0.0 112.702 -178.213 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.553 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 78.8 t90 -92.06 110.43 21.8 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 178.263 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.462 ' O ' ' N ' ' A' ' 15' ' ' ILE . 22.4 ttt-85 -110.2 131.11 55.35 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.674 0.274 . . . . 0.0 110.822 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.1 m -49.91 158.22 0.53 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.626 0.25 . . . . 0.0 110.493 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.416 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 44.7 m -74.1 -37.0 64.29 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.421 0.629 . . . . 0.0 109.751 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.48 -16.25 43.14 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.021 -0.991 . . . . 0.0 111.087 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.66 34.42 11.59 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.302 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -85.88 -25.76 26.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.688 0.28 . . . . 0.0 111.425 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.68 164.18 2.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.314 0.578 . . . . 0.0 111.35 -179.779 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.722 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.65 147.91 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.048 -178.767 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 50.0 m-70 -122.09 119.19 30.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.734 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.428 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.49 141.2 30.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.831 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.552 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -127.5 141.01 47.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.449 -179.511 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.449 ' O ' HG12 ' A' ' 45' ' ' ILE . 21.1 t -103.89 93.54 2.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 178.138 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.713 HD11 HD22 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -41.23 -25.12 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.09 -0.504 . . . . 0.0 112.11 -178.827 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.446 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER -74.66 -49.79 20.11 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 179.175 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.408 HG23 ' HB ' ' A' ' 41' ' ' VAL . 30.0 p -64.66 -27.51 68.98 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.58 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.9 HD12 ' HB3' ' A' ' 62' ' ' LEU . 34.5 mm -56.6 109.24 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.661 179.044 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.414 ' N ' ' O ' ' A' ' 63' ' ' ILE . 12.6 t70 -51.76 -34.01 37.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.137 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.43 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 0.7 OUTLIER -169.64 165.41 10.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.089 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.763 HD11 HD13 ' A' ' 104' ' ' LEU . 45.1 tp -108.77 118.3 36.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.499 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.412 ' HB3' ' HB3' ' A' ' 61' ' ' ARG . 4.4 tt0 -115.76 147.22 41.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.602 0.239 . . . . 0.0 110.512 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.664 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.14 137.2 12.62 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.148 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.517 HG21 ' O ' ' A' ' 57' ' ' LYS . 42.8 p -55.33 121.19 35.85 Favored Pre-proline 0 CA--C 1.53 0.207 0 CA-C-O 120.58 0.229 . . . . 0.0 110.865 -179.833 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -68.23 163.4 36.36 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.45 2.1 . . . . 0.0 112.347 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.52 -31.0 22.36 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.338 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.7 t -70.85 -17.6 62.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.068 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.7 t -82.0 119.8 24.45 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.873 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -64.29 -11.45 32.02 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.866 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.517 ' O ' HG21 ' A' ' 51' ' ' THR . 0.0 OUTLIER -111.7 108.7 18.24 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.941 0.401 . . . . 0.0 111.134 -179.994 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.427 ' HB2' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -76.72 106.69 8.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.632 179.815 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.441 ' HB2' ' CZ ' ' B' ' 670' ' ' PHE . 35.2 mtm -149.65 155.51 40.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.132 0.491 . . . . 0.0 111.983 -179.365 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.664 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 28.6 mt -123.38 149.76 44.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.165 178.419 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.447 ' HB2' ' CE2' ' B' ' 670' ' ' PHE . 28.4 ttp180 -146.18 150.87 36.67 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.916 0.389 . . . . 0.0 112.029 -179.131 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.9 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.3 mp -128.34 116.87 20.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.175 178.545 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.8 HD12 ' HD3' ' A' ' 86' ' ' ARG . 22.6 mm -76.64 156.47 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.683 0.277 . . . . 0.0 111.011 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.425 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -122.41 169.2 14.94 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.352 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.95 118.18 31.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.768 0.318 . . . . 0.0 110.935 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.435 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 10.2 p -72.61 160.34 5.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.613 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.432 ' N ' HG22 ' A' ' 66' ' ' VAL . 10.9 t0 -128.02 35.75 4.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.757 0.313 . . . . 0.0 111.411 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 40.31 31.87 0.11 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.522 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.8 m -95.32 -26.61 15.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.877 0.37 . . . . 0.0 110.986 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.09 -77.74 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.751 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.6 mtpm? 56.15 89.95 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.002 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.99 123.15 48.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.823 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -75.38 159.93 30.85 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.851 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -97.32 -64.04 1.08 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.085 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -178.05 -34.71 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.172 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -92.0 40.8 1.05 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.115 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 59.43 18.01 42.02 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.777 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -90.97 118.21 30.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.746 0.307 . . . . 0.0 110.836 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -87.57 115.8 25.25 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.822 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 17.4 t -111.79 139.25 37.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.638 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.419 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 35.9 t -96.34 90.12 0.68 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.462 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 81' ' ' VAL . 1.4 Cg_endo -45.44 151.0 1.12 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.861 2.374 . . . . 0.0 112.759 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 18.1 mttt -46.47 166.34 0.17 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.543 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.435 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 7.8 Cg_exo -77.17 148.33 27.16 Favored 'Trans proline' 0 N--CA 1.464 -0.22 0 C-N-CA 123.72 2.947 . . . . 0.0 112.294 -179.104 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -50.33 156.56 0.83 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.953 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.8 ' HD3' HD12 ' A' ' 63' ' ' ILE . 0.3 OUTLIER -154.61 138.79 16.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.776 -179.86 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.41 ' CE1' HG22 ' A' ' 40' ' ' VAL . 3.3 m80 -102.84 111.26 23.5 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 179.485 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.43 ' CE ' ' CE1' ' B' ' 670' ' ' PHE . 2.8 ttt -109.34 131.5 55.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.269 -179.388 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.897 ' CD2' HD11 ' A' ' 16' ' ' ILE . 0.3 OUTLIER -131.05 117.18 18.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.376 179.684 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.13 114.32 21.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.231 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.508 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 7.8 m-85 -91.17 136.36 33.14 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.945 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 59.3 m-20 -93.52 43.46 1.12 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.789 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.602 ' HB3' HG23 ' A' ' 96' ' ' VAL . 1.8 m-20 175.2 113.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.229 -179.814 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.438 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -56.16 -17.41 7.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.079 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.95 -45.66 56.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.1 0.476 . . . . 0.0 110.171 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.602 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -65.32 -49.57 77.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.396 179.087 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.448 ' O ' HD11 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -62.62 -37.09 84.92 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.727 179.731 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.408 ' HA ' ' HG2' ' A' ' 101' ' ' LYS . 69.1 m-20 -73.35 -31.08 63.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.029 0.442 . . . . 0.0 110.445 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -80.25 -27.92 38.57 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.291 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.536 HG23 HD11 ' A' ' 18' ' ' ILE . 1.6 mm -85.13 -52.82 11.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.699 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.408 ' HG2' ' HA ' ' A' ' 98' ' ' ASP . 8.6 ptpt -48.59 -28.97 3.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.796 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.415 ' HG2' ' N ' ' A' ' 103' ' ' THR . 0.8 OUTLIER -78.11 -39.81 40.19 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.081 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.764 ' HB ' HD13 ' A' ' 18' ' ' ILE . 0.2 OUTLIER -59.05 -61.03 2.94 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.501 179.551 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.763 HD13 HD11 ' A' ' 48' ' ' LEU . 7.3 mt -46.76 -56.09 6.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.715 179.397 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.405 ' OE1' ' HB ' ' B' ' 673' ' ' VAL . 0.0 OUTLIER -55.67 -45.51 77.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.054 179.378 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -51.92 -35.36 45.42 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-O 121.168 0.508 . . . . 0.0 110.57 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.042 HG22 ' HE1' ' A' ' 111' ' ' TYR . 11.3 mt -85.75 -51.08 13.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.669 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.678 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -42.25 -57.03 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.585 179.654 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.15 -28.47 1.83 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.261 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.521 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 3.1 mtt180 -72.44 -24.89 61.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.28 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 1.042 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -74.57 -36.11 63.05 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 179.77 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.752 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.46 -43.45 17.24 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 107.875 -1.158 . . . . 0.0 107.875 179.039 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -60.96 -30.35 70.19 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 113.93 -1.486 . . . . 0.0 108.922 178.231 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.456 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -91.33 -20.89 21.37 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.594 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.865 179.742 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 120.843 0.354 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 3.4 mp -97.81 -44.02 6.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.927 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 663' ' ' GLU . . . . . 0.447 ' O ' HG12 ' B' ' 664' ' ' VAL . 4.5 mt-10 60.62 49.27 6.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.889 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 664' ' ' VAL . . . . . 0.603 ' O ' HG22 ' B' ' 664' ' ' VAL . 14.6 p 43.74 39.83 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.506 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 665' ' ' LEU . . . . . 0.884 HD21 HD11 ' B' ' 669' ' ' LEU . 1.5 tm? -76.5 108.75 9.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.852 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 666' ' ' SER . . . . . 0.439 ' O ' ' CD1' ' B' ' 670' ' ' PHE . 12.6 p -179.04 -39.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.004 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -94.3 19.33 9.61 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.681 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -101.97 -35.74 8.86 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.557 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.884 HD11 HD21 ' B' ' 665' ' ' LEU . 0.0 OUTLIER -120.61 20.02 11.83 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.534 -179.868 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 670' ' ' PHE . . . . . 0.447 ' CE2' ' HB2' ' A' ' 61' ' ' ARG . 1.6 m-85 -101.41 148.42 25.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.891 0.377 . . . . 0.0 111.073 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -140.64 126.9 19.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.77 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -59.84 108.01 0.69 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.91 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 673' ' ' VAL . . . . . 0.576 HG22 ' O ' ' A' ' 48' ' ' LEU . 2.6 m -56.04 157.25 8.8 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.014 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.21 131.4 40.96 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.707 2.271 . . . . 0.0 112.555 -179.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.11 136.27 35.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.703 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.46 165.67 2.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.939 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 1.5 m -176.62 121.87 0.15 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.898 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -135.37 151.61 50.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.871 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 679' ' ' ILE . . . . . 0.609 ' O ' HD12 ' B' ' 679' ' ' ILE . 2.7 pp -138.09 31.16 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.12 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 2.9 m . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.953 179.964 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo . . . . . 0 N--CA 1.487 1.14 0 CA-C-O 120.865 0.277 . . . . 0.0 111.633 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.83 -32.42 67.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.983 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.427 ' CE1' ' HB2' ' A' ' 20' ' ' GLU . 30.5 m170 -90.38 14.36 13.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.5 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.56 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 2.7 p -151.85 154.69 36.66 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.222 0.534 . . . . 0.0 111.242 179.553 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.515 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 172.37 137.98 2.47 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 -179.522 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.571 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.94 144.34 30.08 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -178.595 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.673 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . . . -155.38 171.38 19.97 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.062 -179.312 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.711 HD12 ' HA ' ' A' ' 13' ' ' SER . 4.8 mm -102.16 128.82 54.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.459 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.8 t80 -127.29 109.38 11.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.0 0.429 . . . . 0.0 110.889 177.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 22.4 mt-10 69.0 50.38 0.59 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.747 179.242 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.6 mttt 69.77 -4.76 1.36 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.134 -0.484 . . . . 0.0 112.084 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.531 ' O ' HG23 ' A' ' 8' ' ' ILE . 13.8 t -101.55 144.24 13.39 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.476 0 CA-C-O 121.201 0.524 . . . . 0.0 110.745 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.711 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -99.25 113.83 26.31 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.898 179.957 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -136.04 -168.1 11.42 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.84 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.571 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 14.0 mm -107.59 136.21 43.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.76 0.314 . . . . 0.0 111.285 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.912 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.73 141.37 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 176.808 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.56 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.52 117.25 5.44 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 119.634 -0.827 . . . . 0.0 111.469 -178.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.878 HD11 HG23 ' A' ' 100' ' ' ILE . 5.3 mt -85.63 142.75 12.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.629 -178.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.64 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.1 t-20 -119.45 96.37 5.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.609 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.558 ' HG3' HD11 ' A' ' 107' ' ' ILE . 1.5 mt-10 -79.86 -0.86 36.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.261 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -81.86 -0.06 41.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.612 0.244 . . . . 0.0 111.387 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.64 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -100.97 -162.45 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.82 0.343 . . . . 0.0 110.74 179.883 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 53.8 p -176.51 100.23 0.24 Allowed Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.37 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.435 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 13.4 Cg_exo -68.91 165.82 73.18 Favored 'Cis proline' 0 C--N 1.346 0.409 0 C-N-CA 123.626 -1.406 . . . . 0.0 112.723 0.36 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.686 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -56.79 178.03 0.07 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.153 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.431 ' HG2' ' HA ' ' A' ' 41' ' ' VAL . 9.1 mt-10 -163.4 133.49 4.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.429 179.458 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.808 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -108.11 140.78 40.8 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.58 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.511 HG22 ' CG2' ' A' ' 37' ' ' VAL . 8.2 m -126.08 112.86 16.34 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -178.314 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.511 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 73.8 t90 -91.98 110.4 21.76 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.522 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 15' ' ' ILE . 15.3 ttt180 -107.35 131.03 54.69 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.668 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 27.1 t -49.88 156.21 0.77 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.718 0.294 . . . . 0.0 110.654 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 21.4 m -73.77 -34.35 64.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.223 0.535 . . . . 0.0 109.832 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -87.36 -16.58 34.58 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.187 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.35 33.72 11.39 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.306 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -87.61 -25.83 23.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.694 0.283 . . . . 0.0 111.451 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.53 165.1 3.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.308 0.575 . . . . 0.0 111.537 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.511 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.5 OUTLIER -142.42 155.43 18.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.934 -178.853 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -130.03 119.33 22.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.709 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.48 138.9 33.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.599 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.553 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -126.16 141.12 46.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.5 -179.5 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.527 ' CG1' HG23 ' A' ' 44' ' ' THR . 41.7 t -103.87 94.39 3.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.057 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.749 HD11 HD22 ' A' ' 104' ' ' LEU . 0.5 OUTLIER -41.94 -25.49 0.06 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.836 -179.085 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.435 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -74.88 -49.2 21.24 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 179.236 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.527 HG23 ' CG1' ' A' ' 41' ' ' VAL . 30.3 p -64.7 -27.54 68.98 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.451 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.861 HD12 ' HB3' ' A' ' 62' ' ' LEU . 39.9 mm -56.32 104.44 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.357 178.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' A' ' 63' ' ' ILE . 31.5 t70 -47.98 -31.73 5.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.841 0.353 . . . . 0.0 111.297 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.426 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 1.1 pttt -172.54 162.13 5.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.792 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.979 HD11 HD13 ' A' ' 104' ' ' LEU . 10.6 tp -108.91 122.42 47.18 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.757 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.476 ' OE1' HD11 ' A' ' 63' ' ' ILE . 11.6 mt-30 -119.65 146.31 45.68 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.567 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.683 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.08 138.86 14.21 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.673 -0.239 . . . . 0.0 111.101 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.463 ' CG2' ' CE1' ' B' ' 670' ' ' PHE . 37.1 p -60.16 142.42 89.72 Favored Pre-proline 0 C--N 1.332 -0.167 0 CA-C-O 120.643 0.259 . . . . 0.0 110.894 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.87 163.28 39.35 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.584 2.19 . . . . 0.0 112.551 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.685 ' HB2' HH21 ' A' ' 94' ' ' ARG . . . -65.38 -25.25 67.48 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.276 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.3 p -70.57 -18.38 62.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.046 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 74.6 m -103.07 113.24 26.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.769 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -57.09 -17.97 12.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.879 179.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.493 ' HE2' HD13 ' B' ' 665' ' ' LEU . 27.0 mmmt -71.96 72.3 0.84 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.892 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.419 ' HG2' ' N ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -58.11 106.71 0.4 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.75 179.926 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.462 ' H ' ' HG1' ' A' ' 51' ' ' THR . 25.1 mtm -149.79 138.38 20.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.073 0.463 . . . . 0.0 112.012 -179.48 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.683 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 22.3 mt -118.06 145.01 45.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.712 178.272 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.44 ' HG3' ' HA ' ' A' ' 88' ' ' MET . 10.5 ttm-85 -143.43 147.38 34.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.005 0.431 . . . . 0.0 112.131 -179.004 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.861 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.6 mp -128.3 115.05 17.7 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.662 178.436 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.476 HD11 ' OE1' ' A' ' 49' ' ' GLN . 6.8 mm -76.76 156.19 5.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 C-N-CA 121.02 -0.272 . . . . 0.0 111.016 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -117.79 149.14 18.58 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.551 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 66.8 mttt -60.1 116.08 3.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.87 0.367 . . . . 0.0 110.768 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.508 HG22 ' N ' ' A' ' 67' ' ' ASP . 15.0 p -98.91 159.6 3.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.431 -179.715 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.508 ' N ' HG22 ' A' ' 66' ' ' VAL . 0.5 OUTLIER -109.19 57.22 0.61 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.82 179.076 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -88.25 33.67 0.74 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.555 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 67.8 p -81.88 -19.1 41.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.793 0.33 . . . . 0.0 111.067 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.3 mmtp -79.82 -78.33 0.16 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.855 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.697 ' HG2' HG23 ' A' ' 81' ' ' VAL . 6.2 mttt 58.89 91.84 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.765 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.21 -178.32 7.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.197 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.6 mmtt -82.43 -178.93 7.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.762 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.447 ' O ' ' ND2' ' A' ' 75' ' ' ASN . 1.0 OUTLIER -113.38 -37.34 4.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.032 0.444 . . . . 0.0 111.039 -179.99 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASN . . . . . 0.447 ' ND2' ' O ' ' A' ' 74' ' ' ASP . 0.9 OUTLIER 168.88 -32.3 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.019 179.841 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -105.68 38.56 1.96 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.926 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.26 16.31 57.84 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.651 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 36.2 m-20 -72.9 -166.19 0.28 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.705 0.288 . . . . 0.0 110.742 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -139.19 108.03 5.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.876 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.401 ' O ' ' C ' ' A' ' 81' ' ' VAL . 59.2 t -77.88 -66.05 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.283 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.697 HG23 ' HG2' ' A' ' 71' ' ' LYS . 4.7 p 33.22 83.58 0.2 Allowed Pre-proline 0 CA--C 1.531 0.24 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.674 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -41.32 124.79 2.4 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.947 2.431 . . . . 0.0 112.869 -179.465 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 10.3 mtmt -78.05 162.33 67.58 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.051 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -83.64 171.03 11.16 Favored 'Trans proline' 0 N--CA 1.46 -0.476 0 C-N-CA 123.629 2.886 . . . . 0.0 112.388 -179.065 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -127.05 114.57 17.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.893 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.47 ' HB3' ' HA ' ' A' ' 63' ' ' ILE . 0.0 OUTLIER -121.44 145.12 48.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.747 -179.886 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.522 ' CE1' HG22 ' A' ' 40' ' ' VAL . 7.4 m80 -96.72 111.66 23.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.335 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.44 ' HA ' ' HG3' ' A' ' 61' ' ' ARG . 6.6 ttt -94.13 124.63 38.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.095 0.474 . . . . 0.0 111.282 -179.54 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.912 ' CD1' HD11 ' A' ' 16' ' ' ILE . 89.8 m-85 -122.93 116.85 24.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.551 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.523 ' HB3' HG12 ' A' ' 8' ' ' ILE . 0.3 OUTLIER -92.2 114.66 27.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.837 0.351 . . . . 0.0 110.849 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.673 ' CE1' ' HB2' ' A' ' 7' ' ' ALA . 31.1 m-85 -97.34 143.54 27.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.111 0.481 . . . . 0.0 111.399 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 20.1 m-20 -106.57 38.29 2.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.777 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.521 ' CB ' HG23 ' A' ' 96' ' ' VAL . 5.3 m-20 -179.87 122.92 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.991 -179.689 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.685 HH21 ' HB2' ' A' ' 53' ' ' ALA . 20.0 tpt85 -65.83 -14.41 61.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.474 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.91 -43.07 56.28 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 121.211 0.529 . . . . 0.0 110.023 179.452 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.521 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -62.6 -51.74 68.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.145 179.059 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.459 ' HG3' ' HA ' ' A' ' 94' ' ' ARG . 0.9 OUTLIER -51.87 -44.87 63.87 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.392 178.656 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.446 ' O ' ' HB2' ' A' ' 102' ' ' MET . 1.2 m-20 -53.41 -29.44 35.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.975 179.03 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.5 m-20 -82.48 -53.83 5.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.125 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.878 HG23 HD11 ' A' ' 18' ' ' ILE . 11.0 mm -70.88 -60.46 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.963 -179.318 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.484 ' CG ' HG11 ' B' ' 673' ' ' VAL . 10.6 ttmt -48.6 -35.38 13.45 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.516 -179.152 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.446 ' HB2' ' O ' ' A' ' 98' ' ' ASP . 33.3 mtm -83.45 -29.62 27.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.715 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.865 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -76.36 -45.35 32.41 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.485 -179.648 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.979 HD13 HD11 ' A' ' 48' ' ' LEU . 5.4 mt -53.53 -53.86 45.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.038 0.447 . . . . 0.0 109.923 179.32 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.507 HE22 ' HB ' ' B' ' 673' ' ' VAL . 0.6 OUTLIER -56.7 -47.43 79.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.146 179.901 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -47.28 -36.01 8.59 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 121.26 0.552 . . . . 0.0 110.37 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.039 HG22 ' HE1' ' A' ' 111' ' ' TYR . 12.3 mt -85.75 -51.81 12.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.143 179.094 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.683 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.4 -59.19 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.34 179.129 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -46.76 -27.38 1.18 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.228 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.459 ' HB3' ' O ' ' A' ' 107' ' ' ILE . 0.0 OUTLIER -73.97 -24.79 59.67 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.88 179.964 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 1.039 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -73.98 -37.08 64.57 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.265 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.726 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -80.23 -43.62 21.12 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 179.14 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -61.4 -30.78 70.77 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.886 -1.507 . . . . 0.0 109.051 178.054 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.452 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.73 -19.65 21.58 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.631 178.745 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.2 t70 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.236 -0.887 . . . . 0.0 110.969 179.914 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 8.8 t70 . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.839 0.352 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -176.89 87.96 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.897 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 60.09 81.63 0.17 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.884 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 664' ' ' VAL . . . . . 0.965 HG12 HD23 ' B' ' 665' ' ' LEU . 13.0 t -151.37 83.65 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.012 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 665' ' ' LEU . . . . . 0.965 HD23 HG12 ' B' ' 664' ' ' VAL . 0.7 OUTLIER 46.51 38.61 5.66 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.283 -179.943 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 666' ' ' SER . . . . . 0.445 ' O ' ' CG ' ' B' ' 670' ' ' PHE . 0.3 OUTLIER -82.71 -80.13 0.17 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.166 -179.749 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -93.99 19.38 9.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.76 -179.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -89.94 -47.77 7.65 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.342 -179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.63 HD21 ' HB2' ' B' ' 665' ' ' LEU . 2.2 pp -120.52 20.01 11.89 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.666 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 670' ' ' PHE . . . . . 0.463 ' CE1' ' CG2' ' A' ' 51' ' ' THR . 2.3 m-85 -91.68 127.83 37.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.828 0.347 . . . . 0.0 111.08 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.22 133.88 54.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.744 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 672' ' ' ASP . . . . . 0.42 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 4.9 p-10 -77.53 111.86 13.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.15 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 673' ' ' VAL . . . . . 0.613 ' CG2' HD23 ' A' ' 48' ' ' LEU . 19.5 m -58.69 128.09 83.32 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.769 179.834 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -51.08 134.48 43.28 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.502 2.135 . . . . 0.0 112.78 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 675' ' ' THR . . . . . 0.431 HG21 HG21 ' A' ' 108' ' ' ILE . 0.8 OUTLIER -115.28 116.76 28.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.582 179.686 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.15 124.32 20.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.02 -179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 16.0 t -142.84 -80.59 0.21 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.965 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -90.92 167.78 12.17 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.92 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 679' ' ' ILE . . . . . 0.526 ' O ' HD12 ' B' ' 679' ' ' ILE . 2.6 pp -138.46 30.93 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.14 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 5.6 p . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.86 -179.99 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo . . . . . 0 N--CA 1.488 1.188 0 CA-C-O 120.94 0.308 . . . . 0.0 111.715 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.4 m -107.0 -31.36 8.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.919 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 25.6 m170 -95.27 23.32 5.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.11 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.533 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 0.5 OUTLIER -160.09 160.57 33.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.206 0.526 . . . . 0.0 111.282 179.747 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.535 ' HA3' HG12 ' A' ' 96' ' ' VAL . . . 166.73 135.73 1.91 Allowed Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -179.502 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.577 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -80.32 148.46 30.68 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.568 ' C ' HD13 ' A' ' 8' ' ' ILE . . . -154.52 171.23 19.75 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.462 -179.045 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.673 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -103.0 120.67 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.582 -179.644 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.477 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 4.5 t80 -119.6 106.67 12.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.899 0.38 . . . . 0.0 111.361 178.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 16.6 mt-10 67.71 49.42 0.96 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.928 179.123 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.3 mtmt 72.64 -3.56 2.33 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 179.169 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.451 ' O ' HG23 ' A' ' 8' ' ' ILE . 22.5 t -102.08 151.17 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 CA-C-O 121.066 0.46 . . . . 0.0 110.483 179.61 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.425 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.8 OUTLIER -107.16 114.08 27.92 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.843 179.982 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.458 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -133.55 -158.55 8.72 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.061 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.577 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 17.0 mm -120.21 132.23 70.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.77 0.319 . . . . 0.0 111.38 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.88 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -101.19 114.87 41.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 177.843 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.533 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -124.03 115.79 21.76 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.539 0.685 . . . . 0.0 110.784 -179.248 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.919 HD13 HG22 ' A' ' 103' ' ' THR . 7.8 mt -82.47 142.75 13.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 114.709 -1.132 . . . . 0.0 112.031 -178.384 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.578 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.5 t-20 -118.45 93.12 4.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.201 179.294 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.07 0.5 44.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.414 -179.689 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -83.36 1.46 41.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.35 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.578 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -100.86 -162.46 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.864 0.364 . . . . 0.0 110.972 -179.828 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 94.1 p -176.15 100.36 0.25 Allowed Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.324 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.411 ' HG2' ' CB ' ' A' ' 43' ' ' SER . 14.6 Cg_exo -66.81 165.06 67.43 Favored 'Cis proline' 0 C--N 1.347 0.475 0 C-N-CA 123.644 -1.398 . . . . 0.0 112.474 0.473 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.54 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -57.34 -171.83 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.663 179.482 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -163.36 141.75 7.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.443 0.64 . . . . 0.0 112.249 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.707 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 3.1 tt -108.17 149.05 29.04 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.984 -1.007 . . . . 0.0 108.574 178.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.47 HG23 HG23 ' A' ' 39' ' ' THR . 1.3 m -146.9 104.19 3.69 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -178.788 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.495 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 82.2 t90 -92.13 110.59 21.97 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.683 178.341 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.469 ' O ' ' N ' ' A' ' 15' ' ' ILE . 2.3 ttt180 -108.75 130.33 55.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.852 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.8 m -49.96 154.44 1.11 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.696 0.284 . . . . 0.0 110.607 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 21.6 m -72.94 -34.42 66.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.354 0.597 . . . . 0.0 109.703 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -87.03 -16.9 34.27 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.123 179.612 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.01 34.08 11.34 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.338 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 57.7 m-20 -89.54 -22.63 22.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.644 0.259 . . . . 0.0 111.542 -179.626 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.96 162.66 2.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.38 0.61 . . . . 0.0 111.434 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.495 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.61 144.95 20.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.025 -178.871 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.427 ' CG ' ' CZ ' ' A' ' 9' ' ' PHE . 20.6 m-70 -118.92 120.2 36.58 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.613 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.47 HG23 HG23 ' A' ' 28' ' ' THR . 0.3 OUTLIER -96.51 144.43 26.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.724 -179.934 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.707 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.2 t -128.75 138.76 53.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.559 -179.401 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.428 ' HB ' HG23 ' A' ' 44' ' ' THR . 21.7 t -103.86 94.3 3.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 177.568 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.852 HD11 HD23 ' A' ' 104' ' ' LEU . 0.9 OUTLIER -42.29 -22.88 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.226 -0.443 . . . . 0.0 112.171 -178.744 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.411 ' CB ' ' HG2' ' A' ' 24' ' ' PRO . 0.4 OUTLIER -76.03 -49.93 16.2 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.858 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.428 HG23 ' HB ' ' A' ' 41' ' ' VAL . 29.6 p -65.15 -28.01 69.12 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.369 178.576 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.847 HD12 ' HB3' ' A' ' 62' ' ' LEU . 44.5 mm -56.46 109.92 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.591 179.082 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.413 ' HB2' ' N ' ' A' ' 65' ' ' LYS . 35.2 t70 -53.76 -37.33 63.29 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.847 0.356 . . . . 0.0 110.835 179.793 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.417 ' HG3' HG12 ' A' ' 63' ' ' ILE . 1.3 pttt -167.37 168.57 13.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.834 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.96 HD23 HG21 ' B' ' 673' ' ' VAL . 11.6 tp -109.01 115.62 30.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.706 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.481 ' O ' ' N ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -106.7 141.93 37.16 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 179.728 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.678 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.01 139.2 14.61 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.664 0.269 . . . . 0.0 111.308 -179.712 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.564 HG21 ' O ' ' A' ' 57' ' ' LYS . 71.6 p -56.92 141.29 75.69 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.102 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.12 163.29 33.09 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.595 2.197 . . . . 0.0 112.407 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.95 -30.09 71.3 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.104 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.0 t -70.81 -18.31 62.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.186 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 59.7 p -94.45 115.64 27.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.897 0.379 . . . . 0.0 110.845 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.02 -18.14 12.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.688 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.564 ' O ' HG21 ' A' ' 51' ' ' THR . 0.1 OUTLIER -84.9 94.78 8.84 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.818 179.841 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.422 ' HE2' ' CB ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -80.23 107.95 13.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.85 -179.846 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.461 ' HB2' HG23 ' A' ' 51' ' ' THR . 35.2 mtm -149.78 151.66 33.94 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.005 0.431 . . . . 0.0 111.868 -179.446 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.678 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 33.6 mt -123.95 152.46 42.46 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.3 178.544 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.481 ' N ' ' O ' ' A' ' 49' ' ' GLN . 24.0 ttm180 -151.9 151.56 31.42 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -179.357 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.861 HD21 HD22 ' A' ' 104' ' ' LEU . 1.4 mp -126.65 117.84 23.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.856 178.313 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.871 HD12 ' HD3' ' A' ' 86' ' ' ARG . 10.6 mm -76.62 156.52 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.765 0.317 . . . . 0.0 111.055 -179.571 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -121.28 126.39 6.53 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.434 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.413 ' N ' ' HB2' ' A' ' 46' ' ' ASP . 0.7 OUTLIER -62.55 128.55 36.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.929 0.395 . . . . 0.0 110.897 -179.825 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.514 HG22 ' N ' ' A' ' 67' ' ' ASP . 13.9 p -97.43 161.4 2.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.097 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.514 ' N ' HG22 ' A' ' 66' ' ' VAL . 9.6 m-20 -114.14 63.44 0.66 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.799 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -63.22 -17.73 62.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.294 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.9 t -58.4 -21.9 52.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.198 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.7 mmmp? -75.46 -68.44 0.56 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.907 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.4 mttt 55.89 89.59 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.966 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.01 -179.93 4.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.908 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 10.7 mttt -133.76 -168.44 2.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.779 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -135.04 -175.39 3.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.858 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -57.58 -22.09 42.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.316 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 -110.0 33.72 4.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.953 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.14 24.52 44.12 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.474 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -62.46 -169.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.848 0.356 . . . . 0.0 110.899 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -135.65 114.99 12.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.638 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 96.3 t -86.89 -60.6 2.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.39 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.446 ' O ' HG13 ' A' ' 81' ' ' VAL . 4.2 p 34.98 88.29 0.1 OUTLIER Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.854 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.42 ' O ' HG21 ' A' ' 66' ' ' VAL . 92.6 Cg_exo -42.12 140.35 2.3 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.94 2.427 . . . . 0.0 112.775 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 46.4 mmtt -93.56 163.87 22.99 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.036 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.449 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.7 Cg_exo -82.11 112.84 2.34 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 123.602 2.868 . . . . 0.0 112.311 -179.05 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -77.28 158.91 29.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.871 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.871 ' HD3' HD12 ' A' ' 63' ' ' ILE . 55.9 mtt180 -151.45 129.88 12.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.721 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.406 ' CE1' HG22 ' A' ' 40' ' ' VAL . 4.2 m80 -95.39 111.53 23.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.568 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.524 ' HE3' ' CE1' ' B' ' 670' ' ' PHE . 4.5 ttt -109.19 134.56 51.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.066 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.88 ' CD2' HD11 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -135.08 116.81 15.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.77 179.821 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.69 114.42 23.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.871 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.499 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 7.9 m-85 -91.17 140.92 29.35 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.12 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -97.2 38.54 1.24 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.775 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.655 ' HB3' HG23 ' A' ' 96' ' ' VAL . 1.3 m-20 178.41 116.08 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.553 -179.719 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.427 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -57.49 -18.14 17.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.674 179.584 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.17 -42.22 66.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.177 0.513 . . . . 0.0 110.122 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.655 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -66.26 -53.01 40.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.287 179.012 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.427 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -61.2 -36.8 80.88 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.335 179.309 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.452 ' O ' ' HE2' ' A' ' 102' ' ' MET . 26.8 t70 -67.81 -32.56 73.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.097 0.475 . . . . 0.0 110.181 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 68.1 m-20 -81.63 -33.25 31.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.237 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.69 HG22 HD12 ' A' ' 104' ' ' LEU . 3.2 mm -79.39 -60.09 2.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.616 179.568 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.457 ' HD3' HG11 ' B' ' 673' ' ' VAL . 5.9 ttmt -49.0 -29.58 5.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.508 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.452 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 31.5 mtm -79.13 -32.02 44.32 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.701 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.919 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -86.51 -22.98 26.08 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 120.983 0.42 . . . . 0.0 110.235 179.623 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.861 HD22 HD21 ' A' ' 62' ' ' LEU . 9.5 mt -73.26 -44.73 58.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.803 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.533 ' HA ' HG13 ' A' ' 108' ' ' ILE . 7.1 pt20 -80.63 -33.1 35.99 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -179.431 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.542 ' HG2' ' HA ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -55.71 -36.34 67.09 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 121.309 0.576 . . . . 0.0 110.122 179.832 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.953 HG22 ' HE1' ' A' ' 111' ' ' TYR . 17.7 mt -75.96 -52.05 18.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.441 179.164 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.549 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -43.86 -55.61 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.267 0.556 . . . . 0.0 111.142 179.09 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -46.85 -28.07 1.44 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.237 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.516 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.3 OUTLIER -73.19 -24.76 60.58 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.146 179.751 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.953 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -74.47 -36.53 63.32 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 179.68 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.743 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -80.6 -43.62 20.25 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 179.211 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -61.45 -31.25 71.19 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 113.887 -1.506 . . . . 0.0 108.955 178.126 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.452 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.67 -19.44 21.84 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.638 178.734 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 9.7 t70 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.251 -0.881 . . . . 0.0 111.034 179.893 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 . . . . . 0 N--CA 1.488 1.429 0 CA-C-O 120.773 0.32 . . . . 0.0 111.126 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -155.5 33.56 0.37 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.887 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 60.86 92.6 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.918 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 664' ' ' VAL . . . . . 0.596 HG11 ' HG2' ' B' ' 667' ' ' GLU . 21.4 t 65.3 94.84 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.134 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 665' ' ' LEU . . . . . . . . . . . . . 1.1 tt -70.59 65.91 0.32 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.997 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 666' ' ' SER . . . . . 0.407 ' OG ' HD23 ' B' ' 669' ' ' LEU . 0.9 OUTLIER 58.72 85.07 0.1 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.029 179.963 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 667' ' ' GLU . . . . . 0.596 ' HG2' HG11 ' B' ' 664' ' ' VAL . 0.0 OUTLIER -94.2 19.17 9.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.079 0.466 . . . . 0.0 111.519 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -105.79 -17.26 14.43 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.238 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.698 ' O ' HD12 ' B' ' 669' ' ' LEU . 4.1 pp -100.07 19.94 15.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.144 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 670' ' ' PHE . . . . . 0.524 ' CE1' ' HE3' ' A' ' 88' ' ' MET . 2.1 m-85 -80.56 140.34 35.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.974 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -111.16 126.95 55.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.905 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -76.22 106.7 7.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.968 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 673' ' ' VAL . . . . . 0.96 HG21 HD23 ' A' ' 48' ' ' LEU . 33.5 m -59.58 143.88 85.61 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.995 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.69 139.53 25.27 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.503 2.135 . . . . 0.0 112.438 -179.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.8 116.65 13.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.891 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 179.72 109.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.801 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 8.7 t 54.28 -89.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.226 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 42.97 87.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.582 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 46.4 pt 42.42 33.16 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.744 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.944 179.986 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo . . . . . 0 N--CA 1.488 1.17 0 CA-C-O 120.811 0.255 . . . . 0.0 111.816 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.642 ' O ' HG21 ' A' ' 103' ' ' THR . 16.6 p -81.81 -37.37 27.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.901 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.404 ' O ' ' N ' ' A' ' 18' ' ' ILE . 18.8 m80 -85.59 25.05 1.11 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.45 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.586 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 7.5 p -156.48 151.06 25.7 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.222 0.534 . . . . 0.0 111.209 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.495 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 175.2 140.04 3.24 Favored Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 -179.591 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.547 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -83.03 136.09 34.62 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -178.431 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.736 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -144.79 171.24 14.69 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.011 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.656 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.84 127.81 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-O 120.696 0.284 . . . . 0.0 111.664 -179.672 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.477 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.8 t80 -127.81 110.08 12.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.986 0.422 . . . . 0.0 111.288 178.382 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 59.7 mt-10 67.75 47.77 1.12 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.988 179.104 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp 72.29 -5.41 1.78 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.152 179.333 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.478 ' O ' HG23 ' A' ' 8' ' ' ILE . 14.3 t -99.75 148.14 6.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 CA-C-O 121.028 0.442 . . . . 0.0 110.424 179.699 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.442 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -110.47 113.1 25.47 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.023 179.975 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.876 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.67 -134.29 3.57 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.613 -0.722 . . . . 0.0 111.905 179.722 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.876 HD13 ' O ' ' A' ' 14' ' ' GLY . 17.3 mm -135.82 135.86 50.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.584 0.23 . . . . 0.0 111.405 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.937 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.41 140.52 19.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 106.295 -1.742 . . . . 0.0 106.295 176.61 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.586 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.33 119.07 6.12 Favored 'General case' 0 C--N 1.313 -0.997 0 C-N-CA 119.591 -0.844 . . . . 0.0 111.915 -178.341 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.715 HD12 ' HB ' ' A' ' 103' ' ' THR . 7.1 mt -82.59 142.82 13.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 114.57 -1.196 . . . . 0.0 112.142 -178.785 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.616 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -117.32 92.78 3.94 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.822 178.883 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.31 -0.85 42.89 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.348 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -82.7 0.56 42.81 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.132 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.616 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.87 -163.6 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.908 0.385 . . . . 0.0 110.694 179.939 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.426 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 1.8 t -175.08 102.29 0.26 Allowed Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.274 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.426 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 8.5 Cg_exo -70.48 162.41 86.21 Favored 'Cis proline' 0 C--N 1.345 0.38 0 C-N-CA 123.49 -1.462 . . . . 0.0 112.674 0.45 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.549 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -54.3 178.47 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.376 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.559 ' OE1' HG22 ' A' ' 41' ' ' VAL . 20.4 mt-10 -163.12 135.41 5.3 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.011 179.195 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.824 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.79 139.54 42.23 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 178.813 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.706 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.4 m -124.82 113.12 17.5 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -178.254 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.538 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 78.5 t90 -91.97 110.5 21.86 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 178.317 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.471 ' O ' ' N ' ' A' ' 15' ' ' ILE . 49.0 ttt180 -110.5 130.93 55.45 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.955 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.0 m -49.84 158.5 0.48 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.492 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.426 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 45.3 m -74.25 -37.05 63.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.371 0.605 . . . . 0.0 109.71 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -84.64 -16.03 43.36 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.992 -1.004 . . . . 0.0 111.114 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.51 34.5 11.79 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.315 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -85.51 -25.92 26.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.753 0.311 . . . . 0.0 111.408 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.5 164.22 3.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.352 0.596 . . . . 0.0 111.441 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.706 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.65 147.94 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.125 -178.793 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -123.16 121.19 35.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.825 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.51 139.98 31.81 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.838 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.576 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -127.07 140.43 49.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.467 -179.627 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.559 HG22 ' OE1' ' A' ' 26' ' ' GLU . 21.9 t -103.83 95.76 4.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 177.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.755 HD11 HD22 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -42.7 -23.78 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.85 -178.994 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.415 ' CB ' ' HG2' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -76.03 -48.81 19.49 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 179.242 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.416 HG23 ' HB ' ' A' ' 41' ' ' VAL . 40.6 p -64.47 -27.19 68.81 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.548 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.81 HD12 ' HB3' ' A' ' 62' ' ' LEU . 47.9 mm -56.36 107.38 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.472 178.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.434 ' N ' ' O ' ' A' ' 63' ' ' ILE . 15.6 t70 -53.25 -28.48 27.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.543 -179.782 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.476 ' HD2' ' NE2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -172.83 163.46 5.01 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.02 0.438 . . . . 0.0 110.963 179.852 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.792 HD11 HD13 ' A' ' 104' ' ' LEU . 15.0 tp -109.17 122.19 46.76 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.722 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.476 ' NE2' ' HD2' ' A' ' 47' ' ' LYS . 1.9 mt-30 -124.22 146.56 48.64 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-O 120.776 0.322 . . . . 0.0 111.177 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.655 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.16 145.1 19.16 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.61 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.436 ' O ' ' HE1' ' A' ' 97' ' ' MET . 72.4 p -68.94 150.79 97.52 Favored Pre-proline 0 C--N 1.333 -0.124 0 CA-C-O 120.804 0.335 . . . . 0.0 111.182 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -75.64 163.38 34.03 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.753 2.302 . . . . 0.0 112.506 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.667 ' HB1' ' CZ ' ' A' ' 94' ' ' ARG . . . -64.24 -23.89 67.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.389 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.6 m -70.66 -19.86 62.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.872 0.368 . . . . 0.0 111.125 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.9 m -71.87 123.15 22.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.041 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -56.16 -18.04 8.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.276 179.048 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.618 ' NZ ' HD21 ' B' ' 669' ' ' LEU . 0.0 OUTLIER -129.01 118.68 22.96 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.73 179.357 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.409 ' HB3' ' HG2' ' A' ' 97' ' ' MET . 3.0 mpp? -85.38 134.62 34.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.457 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.409 ' HB2' HG23 ' A' ' 51' ' ' THR . 3.0 mpp? -149.79 142.36 24.47 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.589 -179.758 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.655 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 21.8 mt -116.63 145.64 43.26 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.032 178.525 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.441 ' HB3' ' HB2' ' A' ' 49' ' ' GLN . 10.2 ttm180 -143.6 148.82 36.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.092 0.472 . . . . 0.0 112.237 -179.098 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.81 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -128.29 115.94 19.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.625 178.276 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.625 HG23 ' HG2' ' A' ' 86' ' ' ARG . 24.8 mm -76.41 156.5 5.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.807 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.421 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -117.52 171.99 14.13 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.734 -0.745 . . . . 0.0 112.631 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.1 mttt -98.07 127.78 44.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.812 0.339 . . . . 0.0 110.909 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.513 HG22 ' N ' ' A' ' 67' ' ' ASP . 14.8 p -97.34 161.04 2.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.191 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.513 ' N ' HG22 ' A' ' 66' ' ' VAL . 2.3 m-20 -112.28 75.87 0.94 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.767 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -62.79 -17.57 61.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.31 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.4 m -57.27 -22.77 43.85 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.144 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.9 mmtm -63.01 -65.38 0.69 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.79 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.7 mttp 58.23 92.25 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.851 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -110.32 166.98 10.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.873 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.2 mttp -133.95 -168.02 2.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.812 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -136.54 -176.69 4.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.879 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 -59.11 -20.86 57.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.326 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -105.86 29.07 6.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.016 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.31 26.08 35.5 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.551 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 26.8 m-20 -65.9 -163.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.699 0.285 . . . . 0.0 110.917 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -137.22 116.81 12.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.662 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.406 ' O ' ' O ' ' A' ' 81' ' ' VAL . 99.3 t -86.63 -60.67 2.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.613 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.63 ' O ' HG12 ' A' ' 81' ' ' VAL . 0.9 OUTLIER 43.6 98.84 0.03 OUTLIER Pre-proline 0 CA--C 1.537 0.452 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.109 179.868 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.478 ' O ' HG21 ' A' ' 66' ' ' VAL . 81.8 Cg_exo -45.01 149.64 1.17 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.591 2.194 . . . . 0.0 112.707 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.1 mtpt -105.14 162.17 20.54 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.953 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.411 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.9 Cg_exo -82.07 111.77 2.21 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 123.598 2.865 . . . . 0.0 112.269 -179.116 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -71.91 143.18 49.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.917 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.625 ' HG2' HG23 ' A' ' 63' ' ' ILE . 14.3 mtt180 -131.49 144.82 51.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.585 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.54 ' CE1' HG22 ' A' ' 40' ' ' VAL . 17.3 m80 -97.04 111.37 23.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.802 0.334 . . . . 0.0 110.216 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 3.1 mtp -94.3 126.36 39.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.339 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.937 ' CD1' HD11 ' A' ' 16' ' ' ILE . 88.8 m-85 -130.55 116.57 18.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.508 179.553 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.437 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -98.18 114.49 26.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.842 0.353 . . . . 0.0 110.661 179.863 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.736 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 43.0 m-85 -94.37 139.64 30.84 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.559 -179.632 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 -99.19 31.98 2.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.712 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.488 ' HB3' HG23 ' A' ' 96' ' ' VAL . 2.1 m-20 -175.41 113.68 0.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.722 -179.803 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.667 ' CZ ' ' HB1' ' A' ' 53' ' ' ALA . 10.1 ttp85 -56.62 -19.28 15.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.784 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.62 -47.77 58.42 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-O 120.851 0.358 . . . . 0.0 110.752 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.488 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -67.0 -45.4 87.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 178.927 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.465 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -63.91 -37.24 86.67 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.755 179.202 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.456 ' N ' ' HG3' ' A' ' 97' ' ' MET . 9.3 m-20 -60.14 -30.18 69.13 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 121.179 0.514 . . . . 0.0 109.948 178.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -81.69 -63.26 1.43 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.169 179.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.663 HG22 HD11 ' A' ' 104' ' ' LEU . 9.0 mm -48.56 -59.89 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.948 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.438 ' HA ' HD12 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -48.54 -30.69 5.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.648 -179.997 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.401 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 17.1 mtm -83.45 -45.68 13.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.405 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.715 ' HB ' HD12 ' A' ' 18' ' ' ILE . 0.3 OUTLIER -57.23 -53.05 62.53 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.756 179.747 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.792 HD13 HD11 ' A' ' 48' ' ' LEU . 6.4 mt -49.87 -53.61 24.67 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.176 0.512 . . . . 0.0 109.924 179.296 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.697 ' HG2' HD23 ' A' ' 48' ' ' LEU . 59.9 mm-40 -56.45 -47.56 78.87 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.963 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -49.82 -34.51 19.92 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-O 121.112 0.482 . . . . 0.0 110.494 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.027 HG22 ' HE1' ' A' ' 111' ' ' TYR . 3.4 mt -85.71 -51.73 13.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.374 179.337 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.705 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.48 -57.02 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.43 179.266 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.416 ' HA ' ' HG2' ' A' ' 112' ' ' LYS . 35.0 t -47.33 -28.54 2.06 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.209 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.525 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.7 OUTLIER -71.9 -24.99 61.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.12 179.879 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 1.027 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -74.85 -35.04 62.36 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.526 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.764 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.77 -43.02 17.24 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 178.985 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -61.42 -32.02 71.97 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 113.898 -1.501 . . . . 0.0 108.957 178.137 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.456 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.7 -18.91 22.38 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.616 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.7 t70 . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.252 -0.88 . . . . 0.0 111.082 179.902 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.779 0.324 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 662' ' ' LEU . . . . . 0.426 ' O ' HD23 ' B' ' 662' ' ' LEU . 5.3 tt -104.45 -30.94 9.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.908 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -176.23 89.92 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.896 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 21.6 t -144.55 80.15 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.045 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 665' ' ' LEU . . . . . 0.863 HD13 ' N ' ' B' ' 666' ' ' SER . 1.2 tm? -129.41 145.86 51.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.882 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 666' ' ' SER . . . . . 0.863 ' N ' HD13 ' B' ' 665' ' ' LEU . 2.7 t -138.32 77.67 1.64 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.771 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 667' ' ' GLU . . . . . 0.452 ' CB ' ' CE1' ' B' ' 670' ' ' PHE . 8.0 pt-20 -94.13 19.2 9.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.083 0.468 . . . . 0.0 111.618 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -77.72 -17.65 57.38 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.212 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.618 HD21 ' NZ ' ' A' ' 57' ' ' LYS . 0.5 OUTLIER -105.15 20.01 19.6 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.296 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 670' ' ' PHE . . . . . 0.452 ' CE1' ' CB ' ' B' ' 667' ' ' GLU . 2.4 m-85 -59.69 122.07 13.22 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.796 0.332 . . . . 0.0 110.969 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -92.03 143.95 25.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.803 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -92.81 109.23 20.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.001 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 673' ' ' VAL . . . . . 0.441 ' CG1' ' NE2' ' A' ' 105' ' ' GLN . 12.0 t -58.1 135.33 84.25 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.844 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -72.98 128.34 13.04 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.372 2.048 . . . . 0.0 112.461 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 675' ' ' THR . . . . . 0.642 HG21 HG21 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -117.24 153.32 33.1 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.777 179.845 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 7.4 tttm -59.41 159.22 8.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.922 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 11.9 p 59.04 -169.47 0.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.915 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 60.88 80.18 0.22 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.903 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 679' ' ' ILE . . . . . 0.581 HG22 ' O ' ' B' ' 679' ' ' ILE . 20.6 mt -109.95 31.4 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.149 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.85 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo . . . . . 0 N--CA 1.489 1.238 0 CA-C-O 121.171 0.404 . . . . 0.0 111.998 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.0 p -68.83 -31.53 70.57 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.937 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.9 m170 -93.08 25.41 3.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.153 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.532 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 12.5 p -156.66 159.49 38.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.2 0.524 . . . . 0.0 111.107 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.581 ' HA3' HG12 ' A' ' 96' ' ' VAL . . . 168.24 136.49 2.06 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.58 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.5 148.16 28.27 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -178.541 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.505 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -157.23 171.45 20.4 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.225 -179.076 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.648 HD12 ' HA ' ' A' ' 13' ' ' SER . 4.3 mm -101.7 122.77 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.982 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.492 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 3.7 t80 -118.44 105.27 11.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.951 0.405 . . . . 0.0 111.051 178.681 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 4.3 mm-40 67.45 54.75 0.67 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.756 179.283 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.425 ' HA ' HD21 ' B' ' 662' ' ' LEU . 1.1 mttm 70.19 -4.66 1.49 Allowed 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 179.311 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.515 ' O ' HG23 ' A' ' 8' ' ' ILE . 21.7 t -104.04 146.7 11.17 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.501 0 CA-C-O 121.134 0.492 . . . . 0.0 110.806 179.631 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.648 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -98.48 114.81 27.33 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.459 179.705 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -133.97 -177.37 14.89 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.365 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.58 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 15.5 mm -105.38 130.5 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-O 120.815 0.341 . . . . 0.0 111.237 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.876 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.4 OUTLIER -101.14 113.63 37.83 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.967 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.532 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -122.47 114.7 21.05 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 121.452 0.644 . . . . 0.0 110.623 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.77 HD13 HG22 ' A' ' 103' ' ' THR . 10.7 mt -82.41 142.82 13.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.906 -178.391 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.595 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.7 t-20 -116.94 94.78 4.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.292 179.471 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.31 0.69 40.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.384 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -82.78 0.61 42.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.385 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.595 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -100.93 -161.94 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.884 0.373 . . . . 0.0 110.911 -179.957 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.0 t -178.84 100.57 0.2 Allowed Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.307 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.433 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 16.8 Cg_exo -65.68 160.99 72.8 Favored 'Cis proline' 0 C--N 1.346 0.412 0 C-N-CA 123.526 -1.447 . . . . 0.0 112.585 0.301 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.766 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -55.77 -171.36 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.805 179.428 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -163.3 142.06 8.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.465 0.65 . . . . 0.0 112.193 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.707 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 2.7 tt -108.22 147.61 31.12 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.92 -1.036 . . . . 0.0 108.578 178.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.5 m -143.42 104.29 4.22 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.492 ' CH2' ' HB3' ' A' ' 9' ' ' PHE . 82.3 t90 -92.07 110.59 21.97 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.903 178.678 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -109.39 129.27 55.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.644 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.1 t -49.77 156.68 0.67 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.613 0.244 . . . . 0.0 110.514 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.0 m -72.28 -36.2 68.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.352 0.596 . . . . 0.0 109.75 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -82.27 -18.51 42.16 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.063 179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.58 34.81 15.18 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.435 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -93.03 -21.25 19.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.629 0.252 . . . . 0.0 111.62 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.24 161.24 6.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.341 0.591 . . . . 0.0 111.492 -179.774 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.478 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.64 148.95 16.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.107 -178.873 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.478 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 16.3 m80 -123.3 120.47 33.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.606 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.51 143.14 27.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.948 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.707 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.2 t -127.11 138.81 53.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.479 -179.479 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.445 ' O ' HG12 ' A' ' 45' ' ' ILE . 21.8 t -104.02 94.15 3.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 177.545 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.607 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.6 OUTLIER -41.31 -23.47 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.221 -178.698 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.433 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 1.2 t -77.34 -49.07 15.73 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.053 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.427 HG23 ' HB ' ' A' ' 41' ' ' VAL . 30.6 p -64.9 -27.73 69.06 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.488 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.886 HD12 ' HB3' ' A' ' 62' ' ' LEU . 40.6 mm -55.99 110.19 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.582 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -57.28 -29.56 63.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.519 -179.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.438 ' CG ' HG13 ' A' ' 63' ' ' ILE . 1.2 pttt -172.47 168.97 5.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.033 0.444 . . . . 0.0 111.09 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.915 HD22 ' NE2' ' A' ' 105' ' ' GLN . 1.1 tp -109.21 117.09 33.21 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.239 -179.621 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.527 ' O ' ' N ' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -111.17 138.85 47.1 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 179.033 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.674 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -156.84 141.44 16.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.71 0.29 . . . . 0.0 111.129 -179.594 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.515 HG23 ' HB2' ' A' ' 59' ' ' MET . 43.9 p -50.16 137.8 20.66 Favored Pre-proline 0 CA--C 1.531 0.215 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.95 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -72.18 163.25 39.3 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.52 2.147 . . . . 0.0 112.58 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.82 -31.59 72.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.128 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 68.5 m -70.71 -21.84 62.51 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.902 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 27.6 m -91.06 117.15 29.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.732 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -55.4 -18.93 7.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.589 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.3 mmtm -74.85 130.77 40.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.867 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.493 ' HE2' ' HB2' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -112.59 102.52 10.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.621 179.897 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.515 ' HB2' HG23 ' A' ' 51' ' ' THR . 32.8 mtm -149.59 146.6 27.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.484 -179.401 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.674 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 32.1 mt -121.53 152.73 38.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.793 178.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.527 ' N ' ' O ' ' A' ' 49' ' ' GLN . 6.9 ttm180 -151.78 145.3 24.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.802 -179.479 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.886 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.2 mp -120.46 118.16 29.55 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 178.281 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.611 HD12 ' HG2' ' A' ' 86' ' ' ARG . 26.8 mm -76.48 156.48 5.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.596 0.236 . . . . 0.0 111.058 -179.581 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.445 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -113.14 141.72 17.05 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.548 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.4 mttm -71.41 115.7 10.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.93 0.395 . . . . 0.0 110.915 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.543 HG11 ' HG3' ' A' ' 84' ' ' PRO . 12.0 p -96.84 162.5 2.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.074 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.539 ' N ' HG22 ' A' ' 66' ' ' VAL . 3.5 m-20 -132.9 64.39 1.61 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.536 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -65.39 -14.79 61.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.561 -179.6 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.8 m -108.75 34.95 3.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.709 0.29 . . . . 0.0 110.987 -179.777 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.9 mmmm -122.97 -65.85 1.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.167 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 32.9 mttt 66.1 96.86 0.05 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.394 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.76 132.56 55.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.181 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.8 mmtp -82.32 159.94 22.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.853 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 51.6 p30 -112.45 -173.48 2.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.893 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -60.05 -20.36 57.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.329 -179.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -101.05 24.13 9.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.126 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.21 21.89 34.4 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.731 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -89.79 117.07 28.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.697 0.284 . . . . 0.0 110.771 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -70.26 108.1 4.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.811 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.412 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 21.3 t -111.03 119.49 59.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.751 -179.674 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.657 ' O ' HG13 ' A' ' 81' ' ' VAL . 14.6 p -99.72 100.71 11.6 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.86 178.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.412 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 74.7 Cg_exo -38.58 143.66 0.23 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.829 2.353 . . . . 0.0 113.121 -178.893 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.458 ' CA ' HG23 ' A' ' 66' ' ' VAL . 8.7 pttt -112.06 166.36 11.08 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.997 -179.86 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.543 ' HG3' HG11 ' A' ' 66' ' ' VAL . 2.6 Cg_exo -80.16 92.21 1.11 Allowed 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 123.621 2.881 . . . . 0.0 112.232 -179.034 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -83.29 114.93 21.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.103 -179.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.611 ' HG2' HD12 ' A' ' 63' ' ' ILE . 0.1 OUTLIER -108.84 134.38 51.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.835 179.879 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.433 ' CE1' HG22 ' A' ' 40' ' ' VAL . 2.2 m80 -100.82 111.41 23.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.378 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.446 ' CE ' ' CZ ' ' B' ' 670' ' ' PHE . 1.0 OUTLIER -104.88 139.03 40.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.179 -179.622 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.876 ' CD2' HD11 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -140.04 120.33 13.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.977 179.888 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.524 ' HB2' HG12 ' A' ' 8' ' ' ILE . 1.2 m -88.66 114.72 25.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.275 -179.773 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.505 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 6.8 m-85 -95.2 133.61 38.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.9 0.381 . . . . 0.0 111.094 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 24.3 m-20 -92.55 43.76 1.14 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.706 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.704 ' HB3' HG23 ' A' ' 96' ' ' VAL . 1.1 m-20 174.77 114.49 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.293 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.493 ' HB2' ' HE2' ' A' ' 58' ' ' MET . 0.2 OUTLIER -57.32 -16.95 10.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.933 179.7 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.62 -42.48 64.42 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.18 0.514 . . . . 0.0 109.906 179.468 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.704 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -65.82 -54.25 29.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.266 178.905 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.43 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -59.35 -35.96 74.84 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.438 179.388 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.569 ' O ' ' HE2' ' A' ' 102' ' ' MET . 29.1 t70 -67.08 -31.72 72.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.066 0.46 . . . . 0.0 110.428 179.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 90.3 m-20 -81.74 -30.03 32.63 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.335 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.666 HG23 HD11 ' A' ' 18' ' ' ILE . 4.5 mm -83.23 -59.97 2.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.817 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.61 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 17.8 ttpp -47.55 -38.3 13.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.644 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.569 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 41.6 mtm -79.94 -25.62 40.4 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.242 -179.592 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.77 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -80.76 -40.74 24.66 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.126 179.962 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.607 ' CD2' HD11 ' A' ' 42' ' ' LEU . 13.2 mt -57.73 -53.01 63.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.267 -0.424 . . . . 0.0 109.993 179.271 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.915 ' NE2' HD22 ' A' ' 48' ' ' LEU . 4.6 mm-40 -60.59 -43.66 97.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.433 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -47.18 -36.44 8.7 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 121.22 0.533 . . . . 0.0 110.512 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.037 HG22 ' HE1' ' A' ' 111' ' ' TYR . 14.4 mt -85.88 -51.59 13.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.512 179.193 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.673 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.21 -60.49 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.681 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.425 ' HA ' ' HG2' ' A' ' 112' ' ' LYS . 6.6 t -46.96 -25.87 0.88 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.25 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.459 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 15.7 mtt180 -72.26 -25.07 61.47 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.942 179.5 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 1.037 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -75.38 -36.7 60.87 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 179.698 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.737 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.59 -42.87 19.46 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.988 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -61.39 -30.24 70.42 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.007 -1.451 . . . . 0.0 108.967 177.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.459 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -91.66 -20.65 21.38 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.54 178.771 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 38.6 t70 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.288 -0.863 . . . . 0.0 110.839 179.825 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 . . . . . 0 N--CA 1.488 1.432 0 CA-C-O 120.771 0.319 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 662' ' ' LEU . . . . . 0.719 ' HB3' HD23 ' B' ' 665' ' ' LEU . 3.6 mm? -109.59 -41.62 4.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.916 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 62.23 93.53 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.92 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 21.3 t 65.66 95.1 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.162 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 665' ' ' LEU . . . . . 0.719 HD23 ' HB3' ' B' ' 662' ' ' LEU . 0.2 OUTLIER -113.59 149.79 34.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.845 179.947 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 666' ' ' SER . . . . . 0.689 ' H ' HD13 ' B' ' 665' ' ' LEU . 2.7 t -145.07 80.93 1.63 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.791 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 667' ' ' GLU . . . . . 0.442 ' HA ' ' CD1' ' B' ' 670' ' ' PHE . 0.1 OUTLIER -94.08 19.16 9.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.188 0.518 . . . . 0.0 111.588 -179.934 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -102.71 -19.21 14.85 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.149 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.85 19.92 19.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.156 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 670' ' ' PHE . . . . . 0.446 ' CZ ' ' CE ' ' A' ' 88' ' ' MET . 2.0 m-85 -63.73 134.48 55.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.842 0.353 . . . . 0.0 110.915 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -102.32 165.07 11.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.838 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -107.18 122.35 46.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.97 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 673' ' ' VAL . . . . . 0.402 HG11 ' HG3' ' A' ' 105' ' ' GLN . 11.1 t -71.08 136.09 84.84 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.871 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -63.96 128.03 20.89 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.291 1.994 . . . . 0.0 112.101 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 675' ' ' THR . . . . . 0.677 HG23 ' OE1' ' A' ' 105' ' ' GLN . 1.8 p -133.07 127.78 34.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.653 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -52.62 162.17 0.61 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.145 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -178.38 -175.74 0.47 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.978 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -143.64 109.04 5.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.857 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 679' ' ' ILE . . . . . 0.538 HG22 ' O ' ' B' ' 679' ' ' ILE . 19.8 mm -97.75 35.95 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.085 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 40.7 t . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.177 -0.916 . . . . 0.0 110.857 179.954 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo . . . . . 0 N--CA 1.489 1.216 0 CA-C-O 120.919 0.3 . . . . 0.0 111.755 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.72 ' O ' HG21 ' A' ' 103' ' ' THR . 0.5 OUTLIER -105.75 -37.62 6.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.76 -179.952 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.419 ' CE1' ' HB2' ' A' ' 20' ' ' GLU . 25.2 m170 -89.76 24.06 2.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.119 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.56 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 8.9 p -156.33 142.31 18.05 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.139 0.495 . . . . 0.0 111.228 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.47 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -175.45 140.27 5.13 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 110.746 -0.942 . . . . 0.0 110.746 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.549 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -81.94 139.73 34.44 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.415 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.602 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -148.92 171.23 16.66 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.043 -179.586 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.647 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.96 128.72 55.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-O 120.827 0.346 . . . . 0.0 111.791 -179.55 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.491 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 7.1 t80 -129.19 110.62 12.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.111 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.431 ' HG2' ' CE1' ' A' ' 9' ' ' PHE . 5.6 mm-40 67.41 47.69 1.23 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.947 179.014 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.2 mmtm 72.25 -5.95 1.66 Allowed 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.466 ' O ' HG23 ' A' ' 8' ' ' ILE . 14.4 t -99.23 148.52 6.2 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 CA-C-O 121.034 0.445 . . . . 0.0 110.474 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.455 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -111.34 113.86 26.62 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.084 -179.924 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.874 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -132.31 -133.91 3.48 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.877 -0.678 . . . . 0.0 112.112 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.874 HD13 ' O ' ' A' ' 14' ' ' GLY . 17.5 mm -136.13 135.27 50.18 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.491 0 CA-C-O 120.81 0.338 . . . . 0.0 111.322 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.91 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.32 139.99 20.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 176.669 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.56 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -150.1 118.56 6.47 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 119.489 -0.884 . . . . 0.0 111.68 -178.305 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.586 HD12 ' HB ' ' A' ' 103' ' ' THR . 11.3 mt -81.57 142.92 13.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 114.469 -1.242 . . . . 0.0 112.053 -178.654 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.624 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -119.98 92.59 3.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.045 179.052 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.419 ' HB2' ' CE1' ' A' ' 3' ' ' HIS . 1.2 tt0 -82.46 -0.39 46.12 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.33 -179.645 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -83.08 1.31 40.83 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.336 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.624 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -102.58 -162.72 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.842 0.354 . . . . 0.0 110.819 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 8.3 p -174.28 101.08 0.29 Allowed Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.366 179.64 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.45 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 58.4 Cg_endo -71.84 165.56 81.51 Favored 'Cis proline' 0 C--N 1.346 0.41 0 C-N-CA 123.518 -1.451 . . . . 0.0 112.765 0.466 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.32 175.72 0.21 Allowed 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.549 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.497 ' HG2' HG21 ' A' ' 22' ' ' VAL . 6.6 pt-20 -163.71 138.71 6.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.112 179.179 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.81 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.72 143.92 35.55 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.861 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.724 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.2 m -127.52 113.55 16.28 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -178.404 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.534 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 77.9 t90 -92.0 110.33 21.69 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.422 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.73 130.97 55.43 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.68 0.276 . . . . 0.0 110.905 -179.812 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.3 t -49.84 158.52 0.48 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.561 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.415 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 48.1 m -73.76 -37.34 65.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.483 0.658 . . . . 0.0 109.69 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -84.2 -16.32 43.81 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.001 -1.0 . . . . 0.0 111.18 179.596 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.49 34.54 11.74 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.308 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -85.54 -25.61 26.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.677 0.275 . . . . 0.0 111.379 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.73 163.94 2.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.213 0.53 . . . . 0.0 111.423 -179.784 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.724 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.68 146.16 19.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.196 -178.729 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.402 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 26.8 m-70 -119.84 120.75 37.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.664 179.748 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.496 HG23 HG23 ' A' ' 28' ' ' THR . 0.3 OUTLIER -96.53 137.42 35.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.063 -179.76 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.562 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.1 t -126.53 139.31 52.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.221 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.467 ' CG1' HG23 ' A' ' 44' ' ' THR . 47.0 t -103.96 95.98 4.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 177.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.731 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.9 OUTLIER -41.16 -25.52 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.12 -178.919 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.45 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 2.0 t -76.14 -48.51 20.33 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.465 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.467 HG23 ' CG1' ' A' ' 41' ' ' VAL . 30.9 p -64.69 -27.86 69.2 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 178.449 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.849 HD12 ' HB3' ' A' ' 62' ' ' LEU . 42.0 mm -56.48 107.14 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.512 178.619 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.407 ' N ' ' O ' ' A' ' 63' ' ' ILE . 8.2 t70 -47.89 -33.98 8.3 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.926 0.393 . . . . 0.0 111.011 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.431 ' HG3' HG12 ' A' ' 63' ' ' ILE . 1.8 pttt -172.44 164.02 5.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.72 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 1.034 HD11 HD13 ' A' ' 104' ' ' LEU . 15.1 tp -108.65 123.29 48.74 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.61 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -119.53 148.56 43.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.537 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.674 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.1 148.37 22.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.573 0.225 . . . . 0.0 111.043 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.568 HG21 ' O ' ' A' ' 57' ' ' LYS . 35.7 p -57.95 138.86 83.23 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-O 120.626 0.25 . . . . 0.0 110.985 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -76.63 163.22 32.06 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.562 2.174 . . . . 0.0 112.446 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.94 -28.06 68.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.144 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.0 t -70.74 -17.78 62.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.172 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.0 m -101.04 114.31 28.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.781 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -58.75 -16.93 19.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.889 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.568 ' O ' HG21 ' A' ' 51' ' ' THR . 15.7 mmmt -80.72 104.08 10.99 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.841 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.401 ' HG2' ' CA ' ' A' ' 94' ' ' ARG . 2.1 mpp? -82.58 108.6 16.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.855 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.579 ' HE3' ' HE1' ' B' ' 670' ' ' PHE . 31.9 mtm -149.7 143.19 25.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.632 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.674 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 25.4 mt -120.48 145.55 47.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.096 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.467 ' HB2' ' CE2' ' B' ' 670' ' ' PHE . 14.7 ttm-85 -141.9 151.3 42.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.949 0.404 . . . . 0.0 111.857 -179.058 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.849 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -128.19 117.42 21.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.817 178.564 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.611 HD12 ' HG2' ' A' ' 86' ' ' ARG . 17.3 mm -76.6 156.52 5.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.792 0.329 . . . . 0.0 111.279 -179.354 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.416 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -114.95 166.96 12.21 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.447 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.6 mmtp -74.66 114.37 13.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.932 0.396 . . . . 0.0 110.858 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.458 HG22 ' N ' ' A' ' 67' ' ' ASP . 7.6 p -107.12 160.58 6.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.313 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.458 ' N ' HG22 ' A' ' 66' ' ' VAL . 2.4 t0 -113.04 39.57 2.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.807 179.823 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.59 -21.91 65.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.187 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.2 m -80.02 -21.07 43.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.208 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.4 mmtp -79.63 -68.37 0.67 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.9 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.3 mtpt 60.04 89.25 0.07 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.818 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.28 -176.51 3.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.923 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 11.1 mttt -134.38 -167.74 2.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.674 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -135.91 -179.21 5.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.91 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -56.93 -22.32 36.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.347 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.73 33.49 4.04 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.989 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 55.5 26.17 44.35 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.51 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -66.8 -169.51 0.08 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.816 0.341 . . . . 0.0 111.001 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -135.58 119.39 17.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.568 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.2 t -89.28 -63.92 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.424 -179.704 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.446 ' O ' HG13 ' A' ' 81' ' ' VAL . 4.8 p 34.21 80.41 0.26 Allowed Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.849 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -45.51 124.69 6.85 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.848 2.365 . . . . 0.0 112.592 -179.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.425 ' O ' HG23 ' A' ' 66' ' ' VAL . 0.2 OUTLIER -72.09 161.62 77.9 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.018 179.976 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.409 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.5 Cg_exo -83.13 128.46 4.97 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 123.645 2.897 . . . . 0.0 112.42 -179.036 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -102.46 115.32 30.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.936 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.611 ' HG2' HD12 ' A' ' 63' ' ' ILE . 0.5 OUTLIER -121.46 143.47 49.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.568 -179.948 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.541 ' CE1' HG22 ' A' ' 40' ' ' VAL . 11.6 m80 -99.02 111.37 23.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.732 0.301 . . . . 0.0 110.372 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.404 ' HE1' ' HA ' ' B' ' 666' ' ' SER . 0.0 OUTLIER -94.81 121.04 35.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.008 0.432 . . . . 0.0 111.199 -179.532 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.91 ' CD1' HD11 ' A' ' 16' ' ' ILE . 92.9 m-85 -122.9 116.73 24.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.467 179.748 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.412 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -97.11 114.55 26.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.846 -179.937 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.602 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 17.0 m-85 -94.66 137.14 34.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.182 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 24.6 m-20 -97.08 39.26 1.19 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.823 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.497 ' CB ' HG23 ' A' ' 96' ' ' VAL . 5.4 m-20 179.59 111.17 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.553 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.428 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.3 OUTLIER -53.41 -21.67 6.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.781 179.795 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.79 -47.3 66.49 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-O 120.891 0.377 . . . . 0.0 110.834 179.79 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.497 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -65.76 -47.22 86.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 178.873 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.45 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -64.52 -37.42 87.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.372 179.539 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.45 ' N ' ' HG3' ' A' ' 97' ' ' MET . 35.7 t0 -68.75 -33.88 74.65 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.095 0.474 . . . . 0.0 109.965 179.278 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.435 ' O ' ' OG1' ' A' ' 103' ' ' THR . 53.2 m-20 -81.88 -26.86 33.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.475 179.294 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.47 HD11 ' N ' ' A' ' 5' ' ' GLY . 1.6 mm -86.4 -59.7 2.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.041 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.568 ' HD3' HG11 ' B' ' 673' ' ' VAL . 7.9 ttmt -44.15 -30.6 0.79 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.374 -179.508 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.77 -37.93 34.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.446 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.72 HG21 ' O ' ' A' ' 2' ' ' SER . 0.3 OUTLIER -59.33 -57.42 13.09 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.714 179.588 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 1.034 HD13 HD11 ' A' ' 48' ' ' LEU . 5.7 mt -47.97 -56.03 8.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.892 179.481 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.556 HE22 ' HB ' ' B' ' 673' ' ' VAL . 0.3 OUTLIER -56.37 -44.99 80.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.883 179.444 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -52.19 -34.44 45.3 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-O 121.168 0.509 . . . . 0.0 110.404 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.989 HG22 ' HE1' ' A' ' 111' ' ' TYR . 5.0 mt -85.64 -51.91 12.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.328 179.291 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.693 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -42.26 -57.58 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.501 179.396 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.7 m -46.92 -26.12 0.92 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.178 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.438 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 14.4 mtp85 -74.06 -25.02 59.61 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.282 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.989 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -76.32 -34.34 59.01 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.748 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.01 -43.51 17.88 Favored 'General case' 0 CA--C 1.505 -0.776 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 178.851 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -61.65 -31.56 71.67 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 113.867 -1.515 . . . . 0.0 109.099 178.112 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.438 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.67 -18.85 22.48 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.697 178.785 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 36.6 t70 . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.071 179.941 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 12.3 t70 . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.793 0.33 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 2.8 tt -168.69 86.15 0.18 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.851 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 61.01 92.76 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.892 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 664' ' ' VAL . . . . . 0.588 HG12 ' O ' ' B' ' 664' ' ' VAL . 21.7 t -96.51 40.59 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.109 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 665' ' ' LEU . . . . . 0.944 HD11 HD21 ' B' ' 669' ' ' LEU . 30.0 tp -111.49 127.96 55.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.873 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 666' ' ' SER . . . . . 0.404 ' HA ' ' HE1' ' A' ' 88' ' ' MET . 0.2 OUTLIER 178.75 -84.85 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.001 179.85 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -94.29 19.21 9.75 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.61 -179.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -86.58 -31.53 21.14 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.26 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.944 HD21 HD11 ' B' ' 665' ' ' LEU . 3.1 pp -120.54 20.04 11.87 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.189 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 670' ' ' PHE . . . . . 0.579 ' HE1' ' HE3' ' A' ' 59' ' ' MET . 1.1 m-85 -93.01 168.23 11.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.991 0.424 . . . . 0.0 111.255 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -148.21 126.9 12.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.652 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -71.1 98.81 1.73 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.096 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 673' ' ' VAL . . . . . 0.568 HG11 ' HD3' ' A' ' 101' ' ' LYS . 21.9 m -59.39 121.18 54.61 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.82 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 674' ' ' PRO . . . . . 0.452 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 80.1 Cg_exo -48.39 141.69 18.66 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.736 2.29 . . . . 0.0 112.842 -179.526 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 675' ' ' THR . . . . . 0.552 HG21 HG21 ' A' ' 108' ' ' ILE . 0.6 OUTLIER -139.0 116.84 11.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.73 179.784 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 2.3 mtmt 179.94 165.98 1.22 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.876 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 96.9 p -126.37 153.69 44.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.936 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 6.0 pm0 45.24 -168.45 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.414 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 4.3 mt 59.63 87.32 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.069 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 2.0 t . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.891 -179.994 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_endo . . . . . 0 N--CA 1.488 1.193 0 CA-C-O 120.819 0.258 . . . . 0.0 111.829 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -92.75 -37.48 12.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.859 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 33.8 m170 -86.62 11.5 12.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.434 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.571 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 3.4 p -151.25 155.39 38.69 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.162 0.506 . . . . 0.0 111.328 179.543 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.502 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 173.62 138.02 2.55 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.866 -0.894 . . . . 0.0 110.866 -179.623 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.558 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.22 133.41 35.25 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -178.53 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.711 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -141.6 171.23 14.35 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.182 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.646 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.66 127.99 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.827 -179.598 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.49 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 7.6 t80 -129.41 110.81 12.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.957 0.408 . . . . 0.0 111.155 178.309 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.411 ' HG3' ' CE1' ' A' ' 9' ' ' PHE . 36.8 mt-10 67.53 49.38 1.01 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.826 179.173 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 69.76 -4.69 1.37 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.214 179.412 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.454 ' O ' HG23 ' A' ' 8' ' ' ILE . 15.7 t -100.07 148.11 6.95 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.479 0 CA-C-O 121.108 0.48 . . . . 0.0 110.41 179.501 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.434 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -112.1 112.83 24.73 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.956 179.885 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.884 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -130.46 -128.97 3.04 Favored Glycine 0 N--CA 1.445 -0.71 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.958 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.884 HD13 ' O ' ' A' ' 14' ' ' GLY . 19.4 mm -138.66 135.48 43.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 120.692 0.282 . . . . 0.0 111.313 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.89 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.8 141.2 17.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 106.279 -1.748 . . . . 0.0 106.279 176.575 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.571 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.41 116.99 5.4 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 119.532 -0.867 . . . . 0.0 111.549 -178.715 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.916 HD13 HG22 ' A' ' 103' ' ' THR . 4.7 mt -85.28 137.81 20.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 114.553 -1.203 . . . . 0.0 111.85 -178.786 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.638 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.5 t-20 -116.6 93.43 4.21 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.316 179.545 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -80.36 0.08 34.62 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.475 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -82.7 0.41 43.51 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.36 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.638 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -101.75 -162.27 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.873 0.368 . . . . 0.0 110.886 179.89 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 t -175.73 101.23 0.25 Allowed Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.427 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.442 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 57.5 Cg_endo -71.31 160.23 92.71 Favored 'Cis proline' 0 C--N 1.346 0.434 0 C-N-CA 123.471 -1.47 . . . . 0.0 112.784 0.409 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.572 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -53.64 176.97 0.03 OUTLIER 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.421 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.504 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.64 135.0 4.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.43 179.309 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.81 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -108.08 130.57 55.09 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 178.736 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.738 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.4 m -114.52 113.44 24.44 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -178.201 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.535 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 78.1 t90 -91.94 110.58 21.94 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.246 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.505 ' O ' ' N ' ' A' ' 15' ' ' ILE . 1.5 ttt180 -110.83 131.27 55.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.199 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.413 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 17.1 m -49.91 160.6 0.31 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.424 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.424 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 45.9 m -75.66 -37.34 59.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.341 0.591 . . . . 0.0 109.751 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -85.42 -14.53 45.93 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.107 179.722 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.65 34.72 12.91 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.323 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.32 -26.1 26.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.812 0.339 . . . . 0.0 111.358 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.28 162.49 2.95 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.275 0.56 . . . . 0.0 111.411 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.738 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.61 145.63 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.035 -178.768 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 31.3 m-70 -120.03 120.99 37.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.779 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.4 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.51 128.52 43.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.708 -179.982 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.58 ' CG2' ' CE1' ' A' ' 87' ' ' HIS . 0.9 OUTLIER -114.72 140.25 36.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.522 -179.547 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.421 HG12 ' HB3' ' A' ' 43' ' ' SER . 28.3 t -104.03 96.29 4.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 177.818 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.81 HD11 HD22 ' A' ' 104' ' ' LEU . 0.5 OUTLIER -42.81 -24.46 0.06 Allowed 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.874 -178.89 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.442 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 1.5 t -74.84 -48.02 27.36 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.255 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.405 HG23 ' HB ' ' A' ' 41' ' ' VAL . 48.4 p -64.66 -27.71 69.11 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 108.976 -0.749 . . . . 0.0 108.976 178.414 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.877 HD12 ' HB3' ' A' ' 62' ' ' LEU . 44.6 mm -56.58 108.06 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.645 178.838 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.444 ' N ' ' O ' ' A' ' 63' ' ' ILE . 14.9 t0 -55.27 -28.13 51.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.395 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.431 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 2.7 ptpt -172.45 161.97 5.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.901 0.381 . . . . 0.0 110.873 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.695 HD11 HD13 ' A' ' 104' ' ' LEU . 46.5 tp -109.09 118.94 38.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.975 -179.607 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.414 ' HB3' ' HB3' ' A' ' 61' ' ' ARG . 4.8 tt0 -117.6 145.68 44.15 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.788 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.66 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.1 145.92 19.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.997 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.526 HG23 ' HB2' ' A' ' 59' ' ' MET . 72.7 p -52.34 138.68 38.21 Favored Pre-proline 0 CA--C 1.53 0.173 0 CA-C-O 120.595 0.236 . . . . 0.0 110.954 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.24 163.21 39.94 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.484 2.122 . . . . 0.0 112.469 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.43 -32.07 73.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.12 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.5 m -70.77 -20.69 62.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.995 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 12.1 m -89.37 117.65 28.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.855 179.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -56.64 -17.91 10.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.622 179.383 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.5 mmmm -80.1 127.23 32.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.825 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.08 104.35 13.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.526 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.526 ' HB2' HG23 ' A' ' 51' ' ' THR . 47.8 mtm -149.6 146.29 27.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.615 -179.424 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.66 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 26.7 mt -119.8 148.75 43.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.596 178.797 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.443 ' HB2' ' CE2' ' B' ' 670' ' ' PHE . 1.7 ttt180 -144.52 147.19 32.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.879 0.371 . . . . 0.0 111.559 -179.621 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.877 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.6 mp -128.37 113.74 15.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.815 178.558 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.604 ' HA ' ' HB3' ' A' ' 86' ' ' ARG . 7.1 mm -76.7 156.48 5.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.747 0.308 . . . . 0.0 111.239 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -116.84 179.26 17.52 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.489 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.2 mmtm -92.57 127.37 38.04 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.809 0.338 . . . . 0.0 111.032 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.519 HG22 ' N ' ' A' ' 67' ' ' ASP . 11.2 p -97.58 161.2 2.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.152 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.519 ' N ' HG22 ' A' ' 66' ' ' VAL . 7.4 m-20 -91.7 74.22 5.82 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.138 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.51 ' CG ' HG11 ' A' ' 81' ' ' VAL . 9.9 mp0 -54.29 -21.01 8.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.603 -179.48 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.7 m -48.53 -27.46 2.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.882 0.372 . . . . 0.0 111.317 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.8 mmmt -67.46 -65.83 0.64 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.757 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.3 mttt 60.93 93.01 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.022 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.57 124.46 34.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.754 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -76.18 167.49 21.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.944 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -104.43 -50.48 3.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.203 0.525 . . . . 0.0 111.168 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.3 t30 174.36 -31.54 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.198 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -93.37 40.78 1.07 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.091 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 58.33 19.16 38.9 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.645 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -80.38 174.23 11.81 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.821 0.343 . . . . 0.0 110.8 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -133.29 111.99 11.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.825 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 24.4 t -103.33 141.58 18.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.432 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.51 HG11 ' CG ' ' A' ' 68' ' ' GLU . 45.4 t -110.65 90.6 10.81 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.633 179.646 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -44.55 145.51 2.6 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.681 2.254 . . . . 0.0 112.57 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.454 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -54.06 154.44 7.72 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.156 -179.889 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.477 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 4.2 Cg_exo -83.7 -176.29 2.64 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 123.513 2.808 . . . . 0.0 112.351 -179.193 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -89.72 113.82 25.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.59 179.705 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.604 ' HB3' ' HA ' ' A' ' 63' ' ' ILE . 0.0 OUTLIER -116.1 143.15 45.86 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.056 -179.652 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.58 ' CE1' ' CG2' ' A' ' 40' ' ' VAL . 9.9 m80 -94.93 116.44 28.71 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.183 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.591 ' HE1' ' HA ' ' B' ' 666' ' ' SER . 0.0 OUTLIER -94.04 110.95 22.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.005 0.431 . . . . 0.0 111.186 -179.413 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.89 ' CD1' HD11 ' A' ' 16' ' ' ILE . 94.2 m-85 -110.93 116.61 31.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.501 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.417 ' HB2' HG12 ' A' ' 8' ' ' ILE . 0.8 OUTLIER -100.79 114.39 28.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.884 0.373 . . . . 0.0 110.711 179.928 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.711 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 42.6 m-85 -93.41 150.69 20.26 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.426 -179.751 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 -107.98 31.54 5.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.404 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.513 ' HB3' HG23 ' A' ' 96' ' ' VAL . 2.1 m-20 -175.93 113.68 0.12 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.468 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.438 ' O ' ' HG3' ' A' ' 97' ' ' MET . 0.0 OUTLIER -56.57 -19.07 14.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 179.77 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.92 -45.07 64.92 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.735 179.764 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.513 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -67.81 -48.27 76.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.966 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.438 ' HG3' ' O ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -62.07 -35.56 79.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.865 179.165 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.4 ' N ' ' HG3' ' A' ' 97' ' ' MET . 7.3 m-20 -61.15 -31.47 71.19 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.217 179.111 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.9 m-80 -81.73 -51.76 7.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.42 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.681 HG23 HD11 ' A' ' 18' ' ' ILE . 10.7 mm -58.46 -59.77 3.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.623 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.481 ' HD3' HG11 ' B' ' 673' ' ' VAL . 5.3 ttmt -51.18 -31.75 21.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.912 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 14.1 mtm -83.34 -31.44 26.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.592 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.916 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -82.32 -27.16 32.41 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.798 -179.568 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.81 HD22 HD11 ' A' ' 42' ' ' LEU . 19.3 mt -67.69 -42.08 82.63 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 179.322 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.543 ' NE2' ' HB ' ' B' ' 673' ' ' VAL . 2.1 mm100 -66.29 -48.72 69.48 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.603 -179.362 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.445 ' HG2' ' HA ' ' A' ' 103' ' ' THR . 11.1 pt20 -46.86 -33.39 4.48 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 121.087 0.47 . . . . 0.0 110.973 -178.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.036 HG22 ' HE1' ' A' ' 111' ' ' TYR . 11.3 mt -82.42 -53.36 11.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.603 179.278 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.686 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.24 -57.15 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.342 179.65 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -46.87 -26.92 1.08 Allowed 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.134 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.446 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 19.7 mtp180 -73.95 -25.05 59.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.29 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 1.036 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -76.1 -35.59 59.25 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.735 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.718 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -80.54 -43.78 20.14 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 178.911 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -61.54 -31.08 71.09 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 113.876 -1.511 . . . . 0.0 109.053 178.188 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.446 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.62 -19.41 21.92 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.691 178.726 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.5 t0 . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.033 179.989 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 4.0 t0 . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.885 0.374 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 1.1 tp -104.92 -33.1 8.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.85 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 663' ' ' GLU . . . . . 0.432 ' O ' HG12 ' B' ' 664' ' ' VAL . 2.6 pt-20 -86.95 53.34 2.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.991 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 664' ' ' VAL . . . . . 0.601 ' O ' HG22 ' B' ' 664' ' ' VAL . 14.5 p 43.75 39.7 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.578 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 665' ' ' LEU . . . . . 0.587 HD21 HD21 ' B' ' 669' ' ' LEU . 2.1 tm? -74.58 112.88 11.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.91 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 666' ' ' SER . . . . . 0.591 ' HA ' ' HE1' ' A' ' 88' ' ' MET . 0.2 OUTLIER -176.67 -86.03 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.986 179.955 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -94.28 19.17 9.78 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.628 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -85.63 -25.1 26.81 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.249 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.587 HD21 HD21 ' B' ' 665' ' ' LEU . 3.5 pp -120.26 19.85 12.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.35 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 670' ' ' PHE . . . . . 0.443 ' CE2' ' HB2' ' A' ' 61' ' ' ARG . 1.3 m-85 -92.84 159.0 15.57 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.862 0.363 . . . . 0.0 110.948 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -151.45 138.51 19.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.92 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -68.48 108.08 3.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.913 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 673' ' ' VAL . . . . . 0.6 HG22 ' O ' ' A' ' 48' ' ' LEU . 30.8 m -60.15 141.97 90.03 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.056 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -54.03 136.24 66.43 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.588 2.192 . . . . 0.0 112.701 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 675' ' ' THR . . . . . 0.56 HG21 HG21 ' A' ' 108' ' ' ILE . 0.4 OUTLIER -126.31 116.76 21.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.536 179.585 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -61.92 110.02 1.43 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.963 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 19.8 p -143.26 -169.77 3.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.865 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 678' ' ' GLN . . . . . 0.61 ' O ' HD13 ' B' ' 679' ' ' ILE . 7.9 pt20 -133.62 121.17 21.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.904 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 679' ' ' ILE . . . . . 0.61 HD13 ' O ' ' B' ' 678' ' ' GLN . 23.6 mm -134.8 75.07 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.147 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.852 -179.883 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo . . . . . 0 N--CA 1.489 1.223 0 CA-C-O 121.149 0.395 . . . . 0.0 111.996 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.43 ' O ' ' CD2' ' A' ' 3' ' ' HIS . 83.1 p -97.98 22.78 8.86 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.116 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.43 ' CD2' ' O ' ' A' ' 2' ' ' SER . 24.3 m170 -152.12 21.23 0.66 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.093 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.581 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 3.9 p -155.79 157.58 36.73 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.122 0.487 . . . . 0.0 111.218 179.736 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.513 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 171.33 139.15 2.7 Favored Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 111.119 -0.792 . . . . 0.0 111.119 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.78 144.2 30.33 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -178.569 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.556 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -153.28 171.19 18.94 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.054 -179.419 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.663 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.79 125.74 55.85 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 CA-C-O 120.745 0.307 . . . . 0.0 111.721 -179.68 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.478 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.2 t80 -125.17 109.16 12.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.938 0.399 . . . . 0.0 111.194 178.498 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.421 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 49.9 mt-10 67.5 48.06 1.16 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.888 179.025 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.6 mttt 73.3 -5.84 1.87 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.2 0.445 . . . . 0.0 112.2 179.2 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.459 ' O ' HG23 ' A' ' 8' ' ' ILE . 16.8 t -100.21 148.68 6.49 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.496 0 CA-C-O 121.174 0.511 . . . . 0.0 110.448 179.639 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.45 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -110.8 113.18 25.56 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.97 179.883 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.886 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.9 -133.86 3.51 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.803 -0.713 . . . . 0.0 111.983 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.886 HD13 ' O ' ' A' ' 14' ' ' GLY . 18.4 mm -135.93 135.68 50.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.682 0.277 . . . . 0.0 111.319 179.78 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.932 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.74 140.37 19.82 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 176.5 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.581 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -149.55 117.51 6.31 Favored 'General case' 0 C--N 1.31 -1.115 0 C-N-CA 119.607 -0.837 . . . . 0.0 111.614 -178.581 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.899 HD13 HG22 ' A' ' 103' ' ' THR . 4.3 mt -85.39 142.77 12.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.738 -178.753 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.613 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.5 t-20 -121.26 92.83 3.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.399 179.634 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.409 ' HB2' ' NE2' ' A' ' 3' ' ' HIS . 0.7 OUTLIER -81.18 0.42 36.57 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.487 -179.867 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -82.67 0.65 42.26 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.295 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.613 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -102.24 -162.56 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.924 0.392 . . . . 0.0 110.858 -179.962 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.414 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 10.1 p -174.43 101.07 0.28 Allowed Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.437 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.45 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 56.4 Cg_endo -70.71 165.64 78.76 Favored 'Cis proline' 0 C--N 1.347 0.461 0 C-N-CA 123.438 -1.484 . . . . 0.0 112.807 0.278 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.462 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -58.25 176.74 0.15 Allowed 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.308 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.478 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.7 135.46 4.87 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.287 179.287 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.804 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.85 147.37 31.01 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.786 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.737 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.2 m -132.73 113.65 13.22 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.431 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.551 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 79.7 t90 -91.96 110.5 21.86 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 178.331 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.468 ' O ' ' N ' ' A' ' 15' ' ' ILE . 8.8 ttt180 -110.51 131.0 55.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.961 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.5 m -49.87 158.92 0.44 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.53 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.411 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 48.4 m -74.42 -37.35 63.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.379 0.609 . . . . 0.0 109.674 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -84.21 -16.02 44.83 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.027 -0.988 . . . . 0.0 111.154 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.47 34.53 11.81 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.235 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.92 -25.53 26.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.638 0.256 . . . . 0.0 111.364 -179.665 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.78 163.75 2.86 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.31 0.576 . . . . 0.0 111.403 -179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.737 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.65 146.83 19.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.07 -178.757 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.43 ' ND1' ' CZ ' ' A' ' 9' ' ' PHE . 12.6 m-70 -120.48 120.18 35.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.698 179.711 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.525 HG23 HG23 ' A' ' 28' ' ' THR . 0.3 OUTLIER -96.43 141.45 29.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.805 -179.772 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.555 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -129.98 139.83 50.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.413 -179.507 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.418 ' O ' HG12 ' A' ' 45' ' ' ILE . 30.7 t -103.87 96.32 4.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 177.715 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.812 HD11 HD22 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -41.75 -24.21 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.127 -178.775 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.45 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 1.8 t -77.38 -48.59 16.9 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 179.388 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.7 p -64.49 -27.5 69.02 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.576 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.867 HD12 ' HB3' ' A' ' 62' ' ' LEU . 36.7 mm -56.48 112.59 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.595 178.836 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.418 ' N ' ' O ' ' A' ' 63' ' ' ILE . 1.4 t70 -52.37 -35.05 50.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.882 0.373 . . . . 0.0 111.034 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.412 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 12.6 pttt -172.34 167.44 5.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.813 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 1.013 HD23 HG21 ' B' ' 673' ' ' VAL . 15.1 tp -109.05 118.85 37.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.986 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.4 ' HB3' ' HB3' ' A' ' 61' ' ' ARG . 10.6 tt0 -114.27 145.92 41.12 Favored 'General case' 0 C--O 1.225 -0.224 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.423 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.629 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -156.97 151.07 24.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.129 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.674 HG23 ' HB2' ' A' ' 59' ' ' MET . 9.5 p -56.44 136.41 76.47 Favored Pre-proline 0 C--N 1.331 -0.196 0 CA-C-O 120.657 0.265 . . . . 0.0 111.295 -179.576 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -71.95 163.44 38.81 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.665 2.243 . . . . 0.0 112.358 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.44 -25.14 49.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.403 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.9 t -92.25 18.27 8.48 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.209 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.408 ' CB ' ' HB ' ' A' ' 51' ' ' THR . 94.0 p -87.13 123.15 31.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.921 0.391 . . . . 0.0 111.296 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -58.52 -18.56 30.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.133 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.35 166.96 21.61 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.671 179.473 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.426 ' HG2' ' CA ' ' A' ' 94' ' ' ARG . 3.0 mpp? -112.01 124.29 52.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.201 -179.501 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.674 ' HB2' HG23 ' A' ' 51' ' ' THR . 31.0 mtm -149.69 138.48 20.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.637 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.629 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 16.0 mt -117.68 143.54 46.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.054 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.513 ' HD3' HD13 ' A' ' 63' ' ' ILE . 0.3 OUTLIER -144.59 149.57 36.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.022 0.439 . . . . 0.0 112.023 -179.043 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.867 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.8 mp -128.08 118.05 22.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.819 178.533 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.711 HD12 ' HG2' ' A' ' 86' ' ' ARG . 10.0 mm -76.5 156.5 5.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.037 -179.631 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -117.7 152.04 17.8 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.53 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.1 mttm -76.73 115.63 16.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.824 0.345 . . . . 0.0 110.911 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.504 HG22 ' N ' ' A' ' 67' ' ' ASP . 14.5 p -88.16 160.87 2.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.174 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.504 ' N ' HG22 ' A' ' 66' ' ' VAL . 14.0 p30 -101.71 73.11 1.41 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.623 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.529 ' HA ' HG13 ' A' ' 81' ' ' VAL . 9.4 mt-10 -54.92 -23.99 21.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.256 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.6 m -63.44 -21.77 66.49 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.0 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -63.33 -62.88 1.39 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.795 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.8 mttm 62.77 94.47 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.819 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.6 128.74 45.02 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.857 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.48 153.96 37.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.913 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.46 -42.16 7.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.984 0.421 . . . . 0.0 111.007 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 167.76 -29.66 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.166 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -101.6 20.79 15.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.356 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.21 36.05 56.29 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.555 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -90.29 0.38 57.26 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 54.77 110.42 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.901 0.381 . . . . 0.0 111.661 179.423 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 7.1 t -113.44 133.54 59.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.619 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.529 HG13 ' HA ' ' A' ' 68' ' ' GLU . 42.5 t -106.17 85.78 1.79 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.605 179.636 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 81' ' ' VAL . 1.5 Cg_endo -43.85 139.9 5.19 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.954 2.436 . . . . 0.0 112.633 -179.598 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -58.82 165.08 3.53 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.122 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.429 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.3 Cg_exo -81.7 158.29 18.86 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 123.683 2.922 . . . . 0.0 112.33 -179.094 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -84.0 117.3 23.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.011 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.711 ' HG2' HD12 ' A' ' 63' ' ' ILE . 0.4 OUTLIER -114.65 141.55 47.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.751 179.864 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.541 ' CE1' HG22 ' A' ' 40' ' ' VAL . 7.0 m80 -99.09 111.33 23.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.756 0.312 . . . . 0.0 110.164 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.456 ' HE3' ' CE1' ' B' ' 670' ' ' PHE . 9.0 ttt -94.74 134.7 37.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.065 0.46 . . . . 0.0 111.586 -179.19 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.932 ' CD1' HD11 ' A' ' 16' ' ' ILE . 51.5 m-85 -135.31 116.62 14.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.667 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.443 ' HB3' ' HB ' ' A' ' 8' ' ' ILE . 0.5 OUTLIER -92.22 114.8 27.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.894 0.378 . . . . 0.0 110.491 179.775 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.476 ' CE1' ' HB2' ' A' ' 7' ' ' ALA . 9.0 m-85 -89.74 136.33 33.1 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.733 -179.368 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -101.08 27.79 5.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.306 179.242 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.441 ' CB ' HG23 ' A' ' 96' ' ' VAL . 9.9 m-20 -175.24 112.76 0.13 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.556 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.458 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -55.79 -19.39 11.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.927 179.72 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.21 -47.95 59.25 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.796 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.441 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -66.83 -45.37 87.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.006 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.458 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -63.9 -37.02 85.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.766 179.31 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.481 ' O ' ' HE2' ' A' ' 102' ' ' MET . 14.1 m-20 -61.14 -31.95 71.66 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.093 0.473 . . . . 0.0 109.941 178.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 -81.97 -54.04 5.64 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.502 179.317 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.538 HD12 ' CG2' ' A' ' 16' ' ' ILE . 15.3 mm -57.5 -60.01 2.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.896 179.724 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.468 ' HD3' HG11 ' B' ' 673' ' ' VAL . 0.4 OUTLIER -51.6 -37.3 49.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.269 -179.584 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.481 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 39.1 mtm -81.35 -27.72 34.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.218 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.899 HG22 HD13 ' A' ' 18' ' ' ILE . 1.0 OUTLIER -81.49 -31.44 32.9 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.852 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.812 HD22 HD11 ' A' ' 42' ' ' LEU . 33.7 mt -64.8 -55.95 16.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.96 179.181 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.401 ' HA ' HG13 ' A' ' 108' ' ' ILE . 6.2 pt20 -62.34 -35.9 80.54 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.926 179.64 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -50.39 -36.97 35.11 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-O 121.289 0.566 . . . . 0.0 109.811 179.287 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.015 HG22 ' HE1' ' A' ' 111' ' ' TYR . 12.4 mt -85.78 -52.08 12.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.02 178.828 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.67 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.53 -58.1 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.342 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.229 179.225 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.4 m -47.29 -25.98 1.11 Allowed 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.133 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.454 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 33.6 mtp180 -74.08 -25.04 59.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.214 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 1.015 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -75.41 -35.28 61.04 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.661 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.74 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.34 -43.46 19.03 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 178.873 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -61.66 -31.59 71.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 113.838 -1.528 . . . . 0.0 108.983 178.19 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.454 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.54 -19.13 22.27 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.681 178.748 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 29.4 t0 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.151 -0.928 . . . . 0.0 110.999 -179.953 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.854 0.359 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 5.1 mp -124.2 69.62 1.08 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.878 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -87.13 53.78 2.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.027 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 16.5 m 42.18 61.36 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.716 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 665' ' ' LEU . . . . . 0.857 HD13 ' N ' ' B' ' 666' ' ' SER . 0.9 OUTLIER -59.07 150.98 23.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.914 179.991 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 666' ' ' SER . . . . . 0.857 ' N ' HD13 ' B' ' 665' ' ' LEU . 7.2 m -121.52 70.35 0.94 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.615 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -91.44 19.17 6.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.785 -179.84 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -105.7 5.58 31.17 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.243 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.28 19.86 12.06 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.715 0.293 . . . . 0.0 111.145 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 670' ' ' PHE . . . . . 0.456 ' CE1' ' HE3' ' A' ' 88' ' ' MET . 4.1 m-85 -68.19 131.37 45.27 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.889 0.376 . . . . 0.0 111.007 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -107.16 127.02 53.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.788 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -71.98 112.57 8.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.934 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 673' ' ' VAL . . . . . 1.013 HG21 HD23 ' A' ' 48' ' ' LEU . 26.9 m -59.19 148.47 71.7 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.022 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.21 135.15 28.67 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.618 2.212 . . . . 0.0 112.485 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 675' ' ' THR . . . . . 0.414 HG21 HG21 ' A' ' 108' ' ' ILE . 0.8 OUTLIER -129.9 116.69 19.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.89 179.781 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 2.6 pttt 179.88 109.98 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.806 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 9.3 p 60.85 152.03 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.081 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -90.43 78.4 6.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.843 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 9.0 tt -108.44 -20.42 6.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.373 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.866 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo . . . . . 0 N--CA 1.489 1.221 0 CA-C-O 120.794 0.247 . . . . 0.0 111.665 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.67 ' O ' HG21 ' A' ' 103' ' ' THR . 25.9 p -106.19 -37.55 6.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.896 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.42 ' O ' ' N ' ' A' ' 18' ' ' ILE . 18.6 m80 -91.39 25.83 2.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.009 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.555 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 19.2 p -158.31 133.63 8.71 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 121.244 0.545 . . . . 0.0 111.212 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.534 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -170.29 138.78 5.17 Favored Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.566 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -80.26 142.28 34.75 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -178.415 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.507 ' C ' HD13 ' A' ' 8' ' ' ILE . . . -154.66 171.19 19.9 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.326 -179.35 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.645 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -99.08 127.59 51.58 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.388 -179.782 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.471 ' CB ' ' CE2' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -127.19 107.18 9.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.994 0.426 . . . . 0.0 111.545 179.122 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 68.04 53.87 0.62 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.221 179.101 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.06 -0.7 1.64 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.91 179.718 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.566 ' O ' HG23 ' A' ' 8' ' ' ILE . 37.1 t -105.15 151.91 7.22 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.481 0 CA-C-O 121.201 0.524 . . . . 0.0 110.576 179.415 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.471 ' HA ' HD12 ' A' ' 8' ' ' ILE . 54.7 p -114.09 115.84 28.19 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.136 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.729 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -138.04 -139.27 3.83 Favored Glycine 0 N--CA 1.444 -0.804 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.94 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.729 HD13 ' O ' ' A' ' 14' ' ' GLY . 15.9 mm -129.32 134.93 62.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.844 0.354 . . . . 0.0 111.219 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.845 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.36 140.62 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 176.703 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.555 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.46 118.1 5.74 Favored 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 119.537 -0.865 . . . . 0.0 111.507 -178.347 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.685 HD12 ' HB ' ' A' ' 103' ' ' THR . 6.9 mt -80.79 142.96 13.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 114.385 -1.28 . . . . 0.0 112.254 -178.651 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.642 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.3 t-20 -119.39 92.65 3.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.96 179.057 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.26 -0.95 47.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.305 -179.76 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -83.0 1.07 41.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.57 -0.287 . . . . 0.0 111.241 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.642 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -102.91 -162.92 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.837 0.351 . . . . 0.0 110.758 179.998 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.412 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 9.9 p -174.42 101.07 0.28 Allowed Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.333 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.456 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 58.5 Cg_endo -71.74 165.4 81.75 Favored 'Cis proline' 0 C--N 1.347 0.464 0 C-N-CA 123.569 -1.43 . . . . 0.0 112.905 0.396 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.55 176.57 0.13 Allowed 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.514 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.518 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 13.7 pt-20 -163.76 136.85 5.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.229 179.104 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.796 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.92 129.06 55.12 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.954 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.507 HG22 ' CG2' ' A' ' 37' ' ' VAL . 6.7 m -111.67 113.18 25.39 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.555 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.489 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 75.4 t90 -91.99 110.63 22.0 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.737 178.668 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -107.98 126.84 53.18 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.912 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.4 t -49.77 156.53 0.69 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.378 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.442 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 54.4 m -71.69 -38.04 70.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.433 0.635 . . . . 0.0 109.415 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -78.75 -9.99 59.62 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 114.897 -1.047 . . . . 0.0 111.184 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 69.77 42.38 70.77 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.276 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -101.98 -23.18 14.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.729 0.299 . . . . 0.0 111.262 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -168.19 153.85 6.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.385 0.612 . . . . 0.0 111.487 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.507 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.5 OUTLIER -140.97 155.47 21.74 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.072 -178.634 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.427 ' HB2' ' CE2' ' A' ' 9' ' ' PHE . 10.7 m-70 -131.2 121.96 25.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.491 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.42 127.23 42.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.0 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.567 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -113.11 138.94 40.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.16 -179.915 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.474 ' CG1' HG23 ' A' ' 44' ' ' THR . 44.5 t -103.86 95.85 4.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.067 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.727 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.7 OUTLIER -41.8 -25.09 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.123 -0.489 . . . . 0.0 112.008 -178.905 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.456 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 2.1 t -76.07 -48.64 20.06 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 179.352 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.474 HG23 ' CG1' ' A' ' 41' ' ' VAL . 31.0 p -64.68 -27.89 69.23 Favored 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.407 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.842 HD12 ' HB3' ' A' ' 62' ' ' LEU . 41.6 mm -56.43 108.15 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.471 178.724 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.423 ' N ' ' O ' ' A' ' 63' ' ' ILE . 50.5 t0 -48.74 -34.03 11.37 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.807 0.337 . . . . 0.0 111.143 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.414 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 2.3 pttt -172.56 165.02 5.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.853 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.811 HD23 HG21 ' B' ' 673' ' ' VAL . 8.3 tp -109.03 119.19 38.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.76 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.411 ' HB2' ' HB3' ' A' ' 61' ' ' ARG . 3.8 mt-30 -115.72 147.13 41.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.413 179.46 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.668 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.03 149.11 22.83 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.79 -0.187 . . . . 0.0 110.969 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.1 p -54.13 138.89 55.97 Favored Pre-proline 0 CA--C 1.53 0.18 0 CA-C-O 120.628 0.251 . . . . 0.0 110.819 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -68.99 163.18 38.64 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.538 2.159 . . . . 0.0 112.524 -179.665 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.03 -31.67 72.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.088 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.71 -20.94 62.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.944 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 38.8 m -94.0 116.14 28.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.714 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -55.86 -18.59 9.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.64 179.515 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 17.7 mmtt -67.76 128.67 37.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.836 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -109.09 99.15 8.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.504 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.44 ' O ' HD23 ' A' ' 60' ' ' LEU . 46.2 mtm -149.6 143.03 25.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.755 -179.253 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.668 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 24.8 mt -121.78 145.19 48.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.205 178.794 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.442 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 14.8 ttm-85 -140.29 150.71 44.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.937 0.399 . . . . 0.0 111.6 -179.373 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.842 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.4 mp -128.07 117.75 22.22 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.958 178.778 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.46 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 21.4 mm -76.54 156.51 5.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.857 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.415 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -118.69 139.17 14.26 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.614 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.5 mttt -59.69 123.49 17.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.86 0.362 . . . . 0.0 110.787 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.48 HG22 ' N ' ' A' ' 67' ' ' ASP . 11.7 p -101.23 160.02 3.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.287 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.48 ' N ' HG22 ' A' ' 66' ' ' VAL . 3.0 m-20 -98.06 48.16 1.0 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.806 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.38 -20.41 54.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.262 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.0 m -59.33 -21.45 59.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.163 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.7 mmmt -72.82 -67.66 0.54 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.856 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.506 ' HA ' HG23 ' A' ' 81' ' ' VAL . 11.5 mttm 62.12 94.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.767 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.58 170.29 8.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.839 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -133.01 -166.7 1.8 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.737 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -138.32 -170.16 2.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.993 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.78 -21.28 55.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.303 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -110.25 29.09 7.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.01 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.63 26.17 38.14 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.639 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -62.44 -164.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.798 0.332 . . . . 0.0 110.934 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -133.45 115.41 14.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.581 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 90.1 t -86.98 -61.16 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.558 -179.667 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.676 ' O ' HG12 ' A' ' 81' ' ' VAL . 0.9 OUTLIER 40.85 95.98 0.04 OUTLIER Pre-proline 0 CA--C 1.536 0.414 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.128 179.904 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.499 ' HD2' ' HA ' ' A' ' 81' ' ' VAL . 9.6 Cg_endo -52.05 139.08 52.66 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.599 2.199 . . . . 0.0 112.398 -179.301 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.4 mmmm -69.09 155.97 92.49 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.946 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.42 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 2.3 Cg_endo -85.25 153.58 10.83 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.528 2.818 . . . . 0.0 112.444 -179.171 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -80.93 156.26 26.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.759 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.42 ' HG3' HG23 ' A' ' 63' ' ' ILE . 0.9 OUTLIER -163.66 119.26 1.65 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.815 -179.739 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.53 ' CE1' HG22 ' A' ' 40' ' ' VAL . 24.0 m80 -94.05 111.42 23.14 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 179.423 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.564 ' HE1' ' HB3' ' B' ' 667' ' ' GLU . 0.0 OUTLIER -94.25 110.97 22.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.993 0.425 . . . . 0.0 111.241 -179.282 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.845 ' CD1' HD11 ' A' ' 16' ' ' ILE . 96.2 m-85 -115.16 116.6 28.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.537 179.755 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.63 114.53 28.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.637 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.467 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 3.7 m-85 -94.35 137.27 33.71 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.077 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -94.0 41.06 1.08 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.707 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.612 ' HB3' HG23 ' A' ' 96' ' ' VAL . 1.6 m-20 177.97 115.41 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.333 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.425 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -58.2 -16.47 13.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.829 179.721 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -73.19 -45.31 57.1 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-O 121.099 0.476 . . . . 0.0 110.12 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.612 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -65.24 -49.93 76.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.42 179.031 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.425 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -62.69 -36.24 82.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.49 179.523 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -70.43 -35.01 73.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.076 0.465 . . . . 0.0 110.191 179.528 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.404 ' O ' ' OG1' ' A' ' 103' ' ' THR . 15.3 m120 -81.75 -27.48 33.79 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.468 179.418 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.534 HD11 ' N ' ' A' ' 5' ' ' GLY . 1.3 mm -86.21 -59.19 2.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.959 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.611 ' HD3' HG11 ' B' ' 673' ' ' VAL . 6.5 ttmt -43.98 -31.05 0.81 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.193 -179.55 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.416 ' HG3' ' N ' ' A' ' 103' ' ' THR . 19.8 ptp -77.83 -39.75 42.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.352 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.685 ' HB ' HD12 ' A' ' 18' ' ' ILE . 0.3 OUTLIER -60.13 -52.42 65.43 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.794 179.654 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.77 HD13 HD11 ' A' ' 48' ' ' LEU . 9.5 mt -51.5 -59.45 4.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.369 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.41 ' HA ' HG13 ' A' ' 108' ' ' ILE . 7.3 pt20 -60.49 -34.26 73.8 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.87 179.601 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -56.09 -36.22 67.89 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.232 0.539 . . . . 0.0 109.856 179.208 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.031 HG22 ' HE1' ' A' ' 111' ' ' TYR . 8.3 mt -85.76 -50.61 14.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.367 179.104 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.679 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.13 -56.4 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.427 179.433 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -46.26 -28.23 1.23 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.047 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.468 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 29.2 mtt180 -72.77 -25.04 61.03 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.346 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 1.031 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -76.34 -35.12 58.91 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 179.884 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.735 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.17 -44.01 18.5 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 178.954 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 54.7 t0 -61.87 -31.24 71.5 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 113.822 -1.535 . . . . 0.0 109.148 178.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.468 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.68 -19.35 21.93 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.85 178.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.274 -0.869 . . . . 0.0 110.982 179.973 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 . . . . . 0 N--CA 1.488 1.437 0 CA-C-O 120.782 0.325 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 3.9 tp 60.21 63.76 1.35 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.891 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -176.46 95.56 0.05 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.86 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 21.4 t 66.38 95.6 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.086 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 665' ' ' LEU . . . . . 0.701 HD13 ' H ' ' B' ' 666' ' ' SER . 0.2 OUTLIER 63.16 147.93 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.809 179.962 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 666' ' ' SER . . . . . 0.701 ' H ' HD13 ' B' ' 665' ' ' LEU . 3.0 t -133.46 74.76 1.57 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.851 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 667' ' ' GLU . . . . . 0.564 ' HB3' ' HE1' ' A' ' 88' ' ' MET . 1.1 pt-20 -94.13 19.12 9.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.553 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -83.23 0.71 44.28 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.395 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -120.2 19.88 12.11 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.587 0.232 . . . . 0.0 111.071 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 670' ' ' PHE . . . . . 0.511 ' CE1' ' HE3' ' A' ' 88' ' ' MET . 1.8 m-85 -63.44 122.11 15.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.834 0.35 . . . . 0.0 110.915 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -101.53 170.98 7.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.933 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -114.48 113.36 24.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.955 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 673' ' ' VAL . . . . . 0.811 HG21 HD23 ' A' ' 48' ' ' LEU . 35.1 m -66.14 149.72 97.49 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.01 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -72.27 155.65 55.88 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.57 2.18 . . . . 0.0 112.514 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 675' ' ' THR . . . . . 0.595 HG21 HG21 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -139.07 116.99 11.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.744 179.881 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 3.6 tttt -56.38 121.67 10.1 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.073 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 32.1 t -149.97 -44.24 0.13 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.105 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -122.44 163.28 20.13 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.864 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 20.9 pt -82.72 -20.41 9.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.405 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 11.8 m . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.239 -0.886 . . . . 0.0 110.868 179.953 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo . . . . . 0 N--CA 1.488 1.177 0 CA-C-O 121.006 0.336 . . . . 0.0 111.727 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.446 ' O ' ' CD2' ' A' ' 3' ' ' HIS . 26.3 p -105.8 22.85 14.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.12 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.446 ' CD2' ' O ' ' A' ' 2' ' ' SER . 22.3 m170 -157.52 24.99 0.29 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.934 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.577 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 2.6 p -158.49 156.15 29.75 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.205 0.526 . . . . 0.0 111.295 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.493 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 172.75 139.44 2.85 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 110.898 -0.881 . . . . 0.0 110.898 -179.58 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.544 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -84.0 143.17 29.96 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.506 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.621 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . . . -152.46 171.15 18.52 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.079 -179.414 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.654 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.67 126.48 56.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-O 120.786 0.327 . . . . 0.0 111.715 -179.613 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.537 ' CE1' ' CE1' ' A' ' 38' ' ' HIS . 6.6 t80 -126.63 109.81 12.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.917 0.389 . . . . 0.0 111.128 178.388 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 3.8 mm-40 67.73 50.43 0.87 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.828 179.214 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.1 mttt 69.23 -3.42 1.55 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 179.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.493 ' O ' HG23 ' A' ' 8' ' ' ILE . 17.0 t -101.38 148.58 7.13 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 CA-C-O 121.097 0.475 . . . . 0.0 110.564 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.451 ' HA ' HD12 ' A' ' 8' ' ' ILE . 73.0 p -111.12 114.62 28.01 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.024 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.893 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -134.18 -133.99 3.38 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.953 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.893 HD13 ' O ' ' A' ' 14' ' ' GLY . 18.8 mm -136.35 136.49 48.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.683 0.278 . . . . 0.0 111.34 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.94 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.84 141.47 17.5 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.63 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 176.436 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.577 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.4 118.39 5.86 Favored 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.534 -178.608 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.935 HD13 HG22 ' A' ' 103' ' ' THR . 4.8 mt -85.33 142.73 12.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 114.537 -1.21 . . . . 0.0 111.796 -178.696 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.619 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -121.65 93.07 3.89 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.419 179.596 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.442 ' HB2' ' NE2' ' A' ' 3' ' ' HIS . 0.1 OUTLIER -81.19 1.09 33.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.532 -179.777 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -81.86 0.47 39.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.122 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.619 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -101.75 -161.99 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.801 0.334 . . . . 0.0 110.838 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.41 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 15.6 p -175.24 100.93 0.26 Allowed Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.455 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.442 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 10.5 Cg_exo -70.11 166.04 76.04 Favored 'Cis proline' 0 C--N 1.347 0.471 0 C-N-CA 123.55 -1.437 . . . . 0.0 112.512 0.296 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.459 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -60.04 176.99 0.27 Allowed 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.248 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.523 ' HG2' HG21 ' A' ' 22' ' ' VAL . 6.9 pt-20 -163.78 138.19 5.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.141 179.177 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.823 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.76 149.05 28.66 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.874 -0.788 . . . . 0.0 108.874 178.86 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.792 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.3 m -133.84 112.58 11.44 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -178.272 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.538 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 76.8 t90 -92.11 110.68 22.06 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.258 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.411 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.1 ptp180 -112.13 133.44 54.27 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.718 0.294 . . . . 0.0 110.761 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 25.4 m -49.82 161.02 0.26 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.593 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.407 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 53.5 m -74.22 -37.78 63.75 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.404 0.621 . . . . 0.0 109.659 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.72 -17.29 41.76 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.041 179.548 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.81 33.74 10.83 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.367 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -83.83 -27.85 28.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.714 0.292 . . . . 0.0 111.258 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.96 161.49 5.72 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.283 0.564 . . . . 0.0 111.348 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.792 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.69 140.82 22.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.036 -178.709 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.537 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 65.4 m80 -114.58 121.25 42.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.683 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.482 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.54 140.94 30.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.842 -179.856 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.567 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -127.79 140.47 49.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.329 -179.673 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.439 ' O ' HG12 ' A' ' 45' ' ' ILE . 41.1 t -103.95 95.94 4.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 177.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.771 HD11 HD22 ' A' ' 104' ' ' LEU . 0.7 OUTLIER -42.27 -23.83 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.972 -178.955 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.442 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -76.42 -48.32 20.13 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.255 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.411 HG23 ' CG1' ' A' ' 41' ' ' VAL . 38.9 p -64.53 -27.89 69.28 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 178.506 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.826 HD12 ' HB3' ' A' ' 62' ' ' LEU . 48.4 mm -56.9 108.49 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.582 178.73 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.414 ' N ' ' O ' ' A' ' 63' ' ' ILE . 8.3 t70 -51.93 -33.77 38.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.871 0.367 . . . . 0.0 110.819 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.422 ' HG3' HG12 ' A' ' 63' ' ' ILE . 13.8 pttt -171.23 165.04 7.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.703 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.89 HD23 HG21 ' B' ' 673' ' ' VAL . 16.6 tp -108.82 122.47 47.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.85 -179.554 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -115.49 141.56 47.89 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.473 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.658 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.06 141.15 16.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.075 -179.739 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.562 HG23 ' HB2' ' A' ' 59' ' ' MET . 44.6 p -52.58 142.97 30.08 Favored Pre-proline 0 CA--C 1.53 0.174 0 CA-C-N 116.607 -0.27 . . . . 0.0 111.09 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -72.69 163.24 39.05 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.566 2.177 . . . . 0.0 112.516 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.45 -31.44 70.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.189 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.5 m -70.79 -21.32 62.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.021 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 46.6 t -96.83 117.22 30.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.929 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -55.19 -19.97 9.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.515 179.322 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 13.8 mmtt -61.26 121.62 13.03 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.624 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.439 ' HE2' ' H ' ' A' ' 94' ' ' ARG . 1.3 mpt? -106.16 99.41 9.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.857 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.562 ' HB2' HG23 ' A' ' 51' ' ' THR . 3.1 mpp? -149.88 138.52 20.81 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.93 0.395 . . . . 0.0 111.996 -179.517 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.661 HD12 ' CZ ' ' A' ' 91' ' ' PHE . 15.5 mt -120.0 140.73 50.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.615 178.246 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.464 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 13.0 ttm180 -143.38 151.67 40.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.032 0.444 . . . . 0.0 112.126 -178.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.826 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -128.52 117.63 21.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.95 178.491 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.479 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 14.2 mm -76.66 156.43 5.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.718 -0.219 . . . . 0.0 110.805 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.425 ' O ' ' HB2' ' A' ' 84' ' ' PRO . . . -117.24 178.05 16.92 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.531 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.5 mttm -102.05 120.31 40.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.785 0.326 . . . . 0.0 111.001 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.444 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 9.8 p -83.29 160.56 3.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.771 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.444 ' N ' HG22 ' A' ' 66' ' ' VAL . 12.4 t70 -132.75 36.92 3.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.741 0.305 . . . . 0.0 111.44 -179.654 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 43.08 29.89 0.23 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.323 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 36.3 m -94.26 -28.15 15.76 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.974 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.6 mmtm -57.06 -79.88 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.708 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.0 mtpt 55.37 89.82 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.2 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.419 ' HG2' ' HG3' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -116.77 121.19 40.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.589 179.644 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -74.39 150.59 39.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.068 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -97.58 -166.19 1.35 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.833 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -65.72 -15.44 62.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.346 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -113.11 14.22 19.47 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.685 -0.234 . . . . 0.0 111.399 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.91 40.46 72.73 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.501 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -84.65 3.09 38.66 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.844 0.312 . . . . 0.0 111.844 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 79' ' ' GLU . 10.3 pt-20 42.24 97.2 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.09 0.472 . . . . 0.0 112.022 179.533 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.465 HG12 ' N ' ' A' ' 81' ' ' VAL . 13.9 t -109.83 157.66 10.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.721 -179.687 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.465 ' N ' HG12 ' A' ' 80' ' ' VAL . 52.8 t -111.92 82.24 4.01 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.326 179.288 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.419 ' HG3' ' HG2' ' A' ' 72' ' ' ARG . 83.1 Cg_exo -42.1 149.49 0.29 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.933 2.422 . . . . 0.0 112.954 -179.56 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -46.1 168.61 0.11 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.521 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.444 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 8.1 Cg_exo -77.18 179.61 6.35 Favored 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 123.705 2.937 . . . . 0.0 112.403 -178.915 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.4 162.98 0.29 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.876 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.438 ' CG ' HD12 ' A' ' 63' ' ' ILE . 0.2 OUTLIER -166.67 116.83 0.92 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.028 -179.67 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.542 ' CE1' HG22 ' A' ' 40' ' ' VAL . 22.3 m80 -96.5 111.18 23.39 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.283 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.404 ' CE ' ' CZ ' ' B' ' 670' ' ' PHE . 0.0 OUTLIER -96.28 128.01 42.81 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.076 0.465 . . . . 0.0 111.637 -178.866 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.94 ' CD2' HD11 ' A' ' 16' ' ' ILE . 58.5 m-85 -132.15 116.57 17.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.481 179.408 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.459 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -91.61 115.04 27.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.953 0.406 . . . . 0.0 110.632 179.867 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.661 ' CZ ' HD12 ' A' ' 60' ' ' LEU . 2.8 m-85 -91.53 137.72 32.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.162 -179.522 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 22.5 m-20 -102.04 34.87 2.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.743 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.6 ' HB3' HG23 ' A' ' 96' ' ' VAL . 10.3 t30 179.14 123.42 0.05 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.943 -179.732 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.526 ' HA ' ' HG3' ' A' ' 97' ' ' MET . 2.8 mmm-85 -61.85 -14.41 33.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.547 179.157 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -71.72 -51.14 24.38 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 121.029 0.442 . . . . 0.0 110.352 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.6 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -56.94 -45.28 83.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.624 179.415 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.526 ' HG3' ' HA ' ' A' ' 94' ' ' ARG . 1.0 OUTLIER -57.14 -48.97 77.36 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.584 178.877 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.454 ' O ' ' HE2' ' A' ' 102' ' ' MET . 12.1 t70 -52.87 -32.94 47.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.378 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -82.52 -57.07 3.51 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.09 179.504 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.546 HD12 ' CG2' ' A' ' 16' ' ' ILE . 11.3 mm -65.08 -60.45 2.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.958 -179.247 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.458 ' HD3' HG11 ' B' ' 673' ' ' VAL . 5.6 ttmt -50.18 -37.84 36.87 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.493 -178.861 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.454 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 14.4 mtm -80.04 -27.16 39.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.037 -179.663 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.935 HG22 HD13 ' A' ' 18' ' ' ILE . 1.0 OUTLIER -81.75 -31.71 31.83 Favored 'General case' 0 N--CA 1.443 -0.793 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 179.811 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.771 HD22 HD11 ' A' ' 42' ' ' LEU . 45.2 mt -65.1 -57.45 8.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.882 179.068 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.411 ' HA ' HG13 ' A' ' 108' ' ' ILE . 4.8 pt20 -63.43 -34.06 76.92 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.932 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -52.31 -36.78 54.1 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.348 0.594 . . . . 0.0 109.829 179.332 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.015 HG22 ' HE1' ' A' ' 111' ' ' TYR . 12.1 mt -85.84 -51.71 12.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.049 178.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.77 HG21 HG21 ' B' ' 675' ' ' THR . 0.9 OUTLIER -42.63 -57.54 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.326 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.259 179.17 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 10.9 m -47.49 -26.29 1.34 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.027 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.451 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 73.5 mtt180 -73.64 -25.04 60.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.265 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 1.015 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -75.49 -34.9 60.9 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.734 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.747 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.47 -43.31 17.38 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 178.923 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -61.45 -31.54 71.5 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.875 -1.511 . . . . 0.0 109.092 178.15 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.451 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.65 -20.83 20.45 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.611 178.714 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.361 -0.828 . . . . 0.0 110.838 179.821 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.825 0.345 . . . . 0.0 111.196 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 662' ' ' LEU . . . . . 0.65 ' O ' HD12 ' B' ' 662' ' ' LEU . 4.2 pp -119.39 30.62 7.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.922 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -86.67 53.04 2.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.028 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 17.7 m -142.56 40.23 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.08 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 665' ' ' LEU . . . . . 0.462 HD13 ' H ' ' B' ' 666' ' ' SER . 0.2 OUTLIER -75.98 162.07 28.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.792 -179.976 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 666' ' ' SER . . . . . 0.613 ' HB3' HD11 ' B' ' 669' ' ' LEU . 3.1 t -176.36 96.06 0.05 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.744 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 667' ' ' GLU . . . . . 0.449 ' HA ' ' CD1' ' B' ' 670' ' ' PHE . 2.4 pt-20 -94.08 19.24 9.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.112 0.482 . . . . 0.0 111.509 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.2 -10.36 35.99 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.338 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.673 ' N ' HD13 ' B' ' 669' ' ' LEU . 0.0 OUTLIER -120.2 19.91 12.11 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.679 0.276 . . . . 0.0 111.275 179.954 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 670' ' ' PHE . . . . . 0.449 ' CD1' ' HA ' ' B' ' 667' ' ' GLU . 2.7 m-85 -75.73 122.07 23.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.773 0.321 . . . . 0.0 110.884 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -111.74 166.93 10.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.801 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 11.4 p30 -108.31 112.13 24.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.991 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 673' ' ' VAL . . . . . 0.89 HG21 HD23 ' A' ' 48' ' ' LEU . 27.0 m -58.92 118.9 33.07 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.828 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_exo -48.02 136.73 23.38 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.614 2.21 . . . . 0.0 112.675 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 675' ' ' THR . . . . . 0.77 HG21 HG21 ' A' ' 108' ' ' ILE . 0.6 OUTLIER -122.56 116.87 24.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.759 179.825 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 179.88 166.0 1.2 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.832 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 9.9 t -167.79 78.12 0.16 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.884 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -71.68 -172.97 0.88 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.874 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 1.8 pp -110.56 -19.71 6.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.41 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 31.6 p . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.217 -0.896 . . . . 0.0 110.901 179.986 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo . . . . . 0 N--CA 1.487 1.143 0 CA-C-O 120.964 0.318 . . . . 0.0 111.839 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.659 ' O ' HG21 ' A' ' 103' ' ' THR . 58.1 p -86.38 -37.49 18.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.904 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.454 ' O ' ' N ' ' A' ' 18' ' ' ILE . 30.6 m170 -71.43 -4.95 29.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.381 179.751 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.487 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 2.0 p -143.73 158.4 43.7 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.982 0.42 . . . . 0.0 111.011 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.505 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 172.26 141.58 3.46 Favored Glycine 0 C--O 1.225 -0.435 0 N-CA-C 110.909 -0.876 . . . . 0.0 110.909 -179.467 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.547 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -84.87 147.06 26.98 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.639 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.589 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -156.14 171.13 20.69 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.202 -179.14 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.681 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.93 122.98 54.81 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 N-CA-C 111.817 0.302 . . . . 0.0 111.817 -179.556 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.468 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 5.7 t80 -121.86 108.65 13.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.983 0.421 . . . . 0.0 111.111 178.411 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 61.0 mt-10 67.43 48.95 1.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.911 179.016 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.7 mttm 73.28 -5.31 1.99 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 179.164 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.469 ' O ' HG23 ' A' ' 8' ' ' ILE . 18.6 t -101.13 148.67 6.9 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.514 0 CA-C-O 121.114 0.483 . . . . 0.0 110.534 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.435 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -111.76 112.71 24.59 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.067 179.87 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.885 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.57 -132.31 3.35 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.933 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.885 HD13 ' O ' ' A' ' 14' ' ' GLY . 17.8 mm -136.64 136.4 48.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.708 0.289 . . . . 0.0 111.345 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.913 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.86 140.95 18.47 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 N-CA-C 106.246 -1.761 . . . . 0.0 106.246 176.56 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.487 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.6 118.18 5.72 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.565 -0.854 . . . . 0.0 111.695 -178.454 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.536 HD12 ' HB ' ' A' ' 103' ' ' THR . 48.3 mt -84.06 142.94 12.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 114.623 -1.171 . . . . 0.0 112.155 -178.799 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.765 ' ND2' HG22 ' A' ' 22' ' ' VAL . 30.4 t30 -118.84 92.52 3.83 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.653 178.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -82.85 0.67 42.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.601 -179.226 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -82.53 1.57 37.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.76 0.314 . . . . 0.0 111.066 179.655 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.765 HG22 ' ND2' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -106.05 -163.03 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.825 -179.779 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.413 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.4 t -175.31 102.9 0.26 Allowed Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.32 179.669 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.45 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 9.4 Cg_exo -70.5 161.71 87.76 Favored 'Cis proline' 0 C--N 1.347 0.46 0 C-N-CA 123.614 -1.411 . . . . 0.0 112.678 0.348 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.443 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -57.4 179.4 0.05 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.403 179.684 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.517 ' CG ' HG21 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -163.58 135.89 5.13 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.174 179.091 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.829 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.92 138.42 44.19 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.958 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.8 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.0 OUTLIER -123.14 112.31 17.57 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -178.263 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.543 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 77.9 t90 -91.97 110.7 22.06 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 178.328 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' A' ' 15' ' ' ILE . 8.4 ptm180 -112.25 132.87 54.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.751 0.31 . . . . 0.0 110.916 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.408 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 8.4 t -50.02 161.71 0.24 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.692 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 54.6 m -75.38 -37.81 60.36 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.322 0.582 . . . . 0.0 109.759 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -83.4 -16.06 47.36 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.125 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.66 34.34 11.74 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.303 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -85.28 -26.37 26.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.717 0.294 . . . . 0.0 111.398 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.36 162.11 5.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.327 0.584 . . . . 0.0 111.449 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.8 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.9 OUTLIER -145.65 140.45 21.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.811 -178.826 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 14.9 m80 -116.2 120.58 39.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.785 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.483 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.45 135.62 38.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.851 -179.913 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.562 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -122.76 140.74 45.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.349 -179.527 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.445 ' O ' HG12 ' A' ' 45' ' ' ILE . 21.4 t -103.98 95.45 3.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 177.777 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.674 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.7 OUTLIER -41.95 -23.76 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.882 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.45 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -76.97 -48.64 17.47 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.344 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.433 HG23 ' HB ' ' A' ' 41' ' ' VAL . 33.5 p -64.61 -26.82 68.56 Favored 'General case' 0 N--CA 1.441 -0.875 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 178.621 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.85 HD12 ' HB3' ' A' ' 62' ' ' LEU . 48.0 mm -56.57 108.66 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.602 178.875 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.426 ' N ' ' O ' ' A' ' 63' ' ' ILE . 3.7 t0 -53.32 -30.97 41.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.808 0.337 . . . . 0.0 111.011 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.423 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 5.1 ptpt -172.55 162.99 5.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.02 0.438 . . . . 0.0 110.878 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.911 HD11 HD13 ' A' ' 104' ' ' LEU . 12.0 tp -109.03 116.47 32.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.619 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.41 ' HB2' ' HB3' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -111.85 146.59 37.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.589 0.233 . . . . 0.0 110.627 -179.972 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.684 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.05 148.57 22.28 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.116 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.601 HG23 ' HB2' ' A' ' 59' ' ' MET . 37.2 p -60.46 135.32 91.67 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-O 120.676 0.274 . . . . 0.0 111.117 -179.81 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.16 163.34 35.18 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.577 2.185 . . . . 0.0 112.317 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.53 -30.36 60.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.284 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.6 t -70.81 -15.89 62.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.262 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 54.0 p -70.94 122.56 20.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.888 0.375 . . . . 0.0 111.094 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -60.57 -14.68 21.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.466 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.774 ' CE ' HD11 ' B' ' 669' ' ' LEU . 0.1 OUTLIER -120.37 -176.66 3.27 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.875 179.791 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.433 ' HB3' ' HG2' ' A' ' 97' ' ' MET . 2.4 mpp? -134.76 120.52 19.52 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.175 -179.689 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.601 ' HB2' HG23 ' A' ' 51' ' ' THR . 53.7 mtm -149.91 142.35 24.35 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.999 0.428 . . . . 0.0 111.716 -179.699 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.684 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 20.6 mt -122.07 143.46 49.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.155 178.834 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.426 ' HG3' ' O ' ' A' ' 87' ' ' HIS . 53.3 ttp180 -143.61 152.71 41.72 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 -178.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.85 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.3 mp -127.95 116.24 19.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.637 178.458 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.585 HG23 ' HG2' ' A' ' 86' ' ' ARG . 23.2 mm -76.54 156.68 5.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.701 0.286 . . . . 0.0 111.38 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.444 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -122.85 129.91 7.65 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.301 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.67 125.55 25.62 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.964 0.411 . . . . 0.0 111.089 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.524 HG22 ' N ' ' A' ' 67' ' ' ASP . 13.5 p -99.18 161.63 3.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.141 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.524 ' N ' HG22 ' A' ' 66' ' ' VAL . 0.4 OUTLIER -105.62 66.53 0.74 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.689 179.718 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -64.13 -16.2 61.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.416 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.2 m -101.03 29.53 4.59 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.767 0.318 . . . . 0.0 110.858 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.9 mmmt -115.21 -63.15 1.5 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.905 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.8 mttm 61.63 95.36 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.53 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.42 124.74 47.58 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.129 -179.685 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.1 mmtt -80.12 170.26 16.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.878 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -122.58 -172.16 2.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.879 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -68.01 -21.27 65.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.163 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -100.88 27.64 5.83 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.002 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.42 26.48 51.61 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.632 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 19.4 m-20 -93.59 115.16 27.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.815 0.341 . . . . 0.0 110.907 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -76.11 115.15 15.54 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.729 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.42 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 13.8 t -115.46 120.08 63.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.748 -179.571 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.703 ' O ' HG13 ' A' ' 81' ' ' VAL . 11.6 p -101.66 96.76 6.8 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.973 179.052 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.42 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 67.8 Cg_exo -36.26 151.34 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.068 2.512 . . . . 0.0 113.257 -178.875 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.0 mttp -104.36 169.63 7.01 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.131 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.485 ' HG3' HG11 ' A' ' 66' ' ' VAL . 2.8 Cg_exo -80.04 115.12 3.22 Favored 'Trans proline' 0 N--CA 1.461 -0.408 0 C-N-CA 123.694 2.929 . . . . 0.0 112.259 -178.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -85.37 114.65 22.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.164 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.585 ' HG2' HG23 ' A' ' 63' ' ' ILE . 0.2 OUTLIER -110.33 131.15 55.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.495 179.787 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.473 ' CE1' HG22 ' A' ' 40' ' ' VAL . 3.9 m80 -95.39 111.0 22.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.798 0.332 . . . . 0.0 110.318 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.475 ' HE3' ' CE1' ' B' ' 670' ' ' PHE . 0.7 OUTLIER -101.37 141.79 33.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.357 -179.369 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.913 ' CD2' HD11 ' A' ' 16' ' ' ILE . 5.1 m-85 -140.96 116.93 10.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.063 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.443 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -87.01 115.29 24.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.417 179.566 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.445 ' CE1' ' HB2' ' A' ' 7' ' ' ALA . 8.9 m-85 -89.12 134.67 33.92 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.398 -179.583 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 22.4 m-20 -98.75 28.87 4.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.467 179.499 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.429 ' CB ' HG23 ' A' ' 96' ' ' VAL . 7.4 m-20 -175.47 114.32 0.14 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.555 -179.734 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.49 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.1 OUTLIER -56.52 -17.63 9.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.997 179.767 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -72.3 -50.32 27.9 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 120.887 0.375 . . . . 0.0 110.43 179.745 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.429 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -65.88 -41.95 91.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.675 179.241 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.49 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -66.74 -37.82 85.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.927 179.317 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.463 ' N ' ' HG3' ' A' ' 97' ' ' MET . 29.2 t70 -62.61 -29.48 70.63 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.858 178.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.434 ' O ' ' OG1' ' A' ' 103' ' ' THR . 9.0 m-80 -81.9 -65.58 0.99 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.363 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.575 HG22 HD11 ' A' ' 104' ' ' LEU . 15.2 mm -46.53 -56.29 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 CA-C-O 121.148 0.499 . . . . 0.0 110.763 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.576 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 17.5 ttpp -48.07 -42.43 28.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.982 179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.492 ' HG2' ' N ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -75.18 -39.4 60.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.332 179.903 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.659 HG21 ' O ' ' A' ' 2' ' ' SER . 0.2 OUTLIER -60.0 -50.73 72.61 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.815 179.785 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.911 HD13 HD11 ' A' ' 48' ' ' LEU . 6.4 mt -53.36 -59.07 5.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.258 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -60.22 -33.66 72.57 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.654 179.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -56.4 -36.48 68.95 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 121.338 0.59 . . . . 0.0 109.44 178.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 1.022 HG22 ' HE1' ' A' ' 111' ' ' TYR . 6.9 mt -85.79 -51.65 13.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.002 178.756 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.667 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.38 -57.41 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.138 179.187 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 75.4 m -47.09 -26.03 0.99 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.162 179.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.449 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 71.0 mtt-85 -74.26 -25.05 59.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.146 179.744 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 1.022 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -75.85 -35.09 60.05 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.875 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.743 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.18 -43.69 18.96 Favored 'General case' 0 CA--C 1.506 -0.744 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 179.027 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -61.78 -31.33 71.52 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 113.862 -1.517 . . . . 0.0 109.064 178.18 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.449 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.69 -19.01 22.26 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.64 178.731 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 39.1 t70 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.245 -0.883 . . . . 0.0 111.006 179.987 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.859 0.361 . . . . 0.0 111.25 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 662' ' ' LEU . . . . . 0.814 HD12 ' HB2' ' B' ' 663' ' ' GLU . 3.2 pp -91.98 -29.46 16.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.91 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 663' ' ' GLU . . . . . 0.814 ' HB2' HD12 ' B' ' 662' ' ' LEU . 3.5 mm-40 -175.21 38.65 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.864 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 664' ' ' VAL . . . . . 0.539 HG13 ' O ' ' B' ' 663' ' ' GLU . 5.7 m -159.34 87.51 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.045 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 665' ' ' LEU . . . . . 0.576 ' C ' HD12 ' B' ' 665' ' ' LEU . 4.2 pp -139.12 -166.62 2.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.873 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 666' ' ' SER . . . . . 0.529 ' N ' HD12 ' B' ' 665' ' ' LEU . 1.5 m -138.87 79.56 1.74 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.458 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 18.2 pt-20 -89.24 19.16 4.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.903 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -93.71 7.09 46.14 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.085 179.633 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.774 HD11 ' CE ' ' A' ' 57' ' ' LYS . 0.6 OUTLIER -120.34 19.97 12.01 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.136 179.926 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 670' ' ' PHE . . . . . 0.475 ' CE1' ' HE3' ' A' ' 88' ' ' MET . 1.7 m-85 -57.03 123.75 16.3 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.89 0.376 . . . . 0.0 111.091 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -111.65 171.06 7.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.74 179.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 22.4 p-10 -106.55 109.24 21.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.978 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 673' ' ' VAL . . . . . 0.869 HG21 HD23 ' A' ' 48' ' ' LEU . 27.7 m -58.13 153.76 33.9 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.936 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -68.62 137.83 40.06 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.615 2.21 . . . . 0.0 112.502 -179.833 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 675' ' ' THR . . . . . 0.558 HG21 HG21 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -129.56 116.88 19.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.713 179.875 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 4.8 mttt 179.89 166.04 1.2 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.748 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 2.3 t -135.99 88.61 2.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.91 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -134.01 80.33 1.86 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.891 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 8.6 tp -75.16 -20.52 16.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.355 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 40.0 t . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.936 179.95 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.518 ' HA ' HG21 ' A' ' 103' ' ' THR . 33.8 m80 . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.651 0.262 . . . . 0.0 111.164 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.534 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 11.3 p -161.2 152.24 18.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.281 0.563 . . . . 0.0 111.111 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.432 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 173.95 137.76 2.51 Favored Glycine 0 N--CA 1.448 -0.509 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.566 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -80.86 145.47 31.35 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -178.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.579 ' C ' HD13 ' A' ' 8' ' ' ILE . . . -151.98 171.18 18.23 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.358 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.672 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -103.54 122.01 55.63 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.652 -179.668 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.472 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 4.6 t80 -120.75 106.98 12.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.877 0.37 . . . . 0.0 111.201 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.447 ' HG2' ' CD1' ' A' ' 9' ' ' PHE . 41.9 mm-40 67.98 49.09 0.92 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.864 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.4 mttp 72.25 -3.76 2.2 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.459 ' O ' HG23 ' A' ' 8' ' ' ILE . 19.9 t -101.21 150.3 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 CA-C-O 121.074 0.464 . . . . 0.0 110.458 179.563 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.427 ' HA ' HD12 ' A' ' 8' ' ' ILE . 95.8 p -107.12 114.86 29.18 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.877 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.517 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -134.0 -155.98 7.77 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.028 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.566 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 16.6 mm -122.83 131.96 72.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.872 0.367 . . . . 0.0 111.375 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.917 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.4 OUTLIER -100.94 113.67 37.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 177.752 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.534 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -122.18 116.61 24.48 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.553 0.692 . . . . 0.0 110.854 -179.177 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.477 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 17.5 mt -82.63 142.53 13.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 114.721 -1.127 . . . . 0.0 112.338 -178.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.594 ' O ' HG23 ' A' ' 22' ' ' VAL . 2.4 m120 -117.4 92.84 3.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.026 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.402 ' HB2' ' CD2' ' A' ' 3' ' ' HIS . 0.1 OUTLIER -82.64 -0.3 46.51 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.353 -179.733 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -83.38 1.3 42.02 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.442 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.594 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -100.87 -162.56 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.908 0.385 . . . . 0.0 110.988 -179.998 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 t -177.98 101.05 0.22 Allowed Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.168 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.403 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 15.7 Cg_exo -66.34 161.62 73.7 Favored 'Cis proline' 0 C--N 1.346 0.408 0 C-N-CA 123.46 -1.475 . . . . 0.0 112.608 0.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.727 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -55.29 -172.38 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.872 179.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -163.27 142.15 8.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.486 0.66 . . . . 0.0 112.352 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.704 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 3.0 tt -108.37 149.13 29.12 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.829 -1.078 . . . . 0.0 108.744 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.57 HG23 HG23 ' A' ' 39' ' ' THR . 0.6 OUTLIER -146.35 104.11 3.76 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -178.798 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.489 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 83.3 t90 -92.06 110.54 21.91 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.777 178.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.474 ' O ' ' N ' ' A' ' 15' ' ' ILE . 42.8 ttt180 -109.66 131.18 55.3 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.777 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.3 t -49.85 155.99 0.79 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.688 0.28 . . . . 0.0 110.597 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.6 m -74.08 -34.63 64.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.317 0.579 . . . . 0.0 109.843 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -87.12 -16.58 35.07 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.054 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.78 33.75 10.86 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.333 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -86.9 -25.02 24.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.673 0.273 . . . . 0.0 111.476 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.17 164.22 2.7 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.285 0.564 . . . . 0.0 111.491 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.489 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.7 OUTLIER -145.64 147.93 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.961 -178.851 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.428 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 58.2 m80 -122.72 120.76 34.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.654 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.57 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.46 145.06 26.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.77 -179.884 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.704 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.1 t -128.49 139.03 52.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.624 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.438 ' O ' HG12 ' A' ' 45' ' ' ILE . 23.0 t -104.0 94.22 3.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 177.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.493 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.6 OUTLIER -42.22 -22.85 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.212 -0.449 . . . . 0.0 112.027 -178.783 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.403 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -76.79 -49.75 15.12 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.954 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.415 HG23 ' HB ' ' A' ' 41' ' ' VAL . 30.2 p -64.94 -28.22 69.38 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 178.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.895 HD12 ' HB3' ' A' ' 62' ' ' LEU . 31.3 mm -56.4 105.73 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.548 178.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -51.8 -31.72 28.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.188 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.451 ' HG3' HG12 ' A' ' 63' ' ' ILE . 3.2 pttt -172.61 166.94 5.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.574 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 1.06 HD11 HD13 ' A' ' 104' ' ' LEU . 11.9 tp -109.0 121.87 46.06 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.047 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.911 ' HG3' HD11 ' A' ' 63' ' ' ILE . 25.2 mm100 -110.41 138.34 46.93 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.289 179.495 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.716 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -156.85 140.27 15.75 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.61 0.243 . . . . 0.0 111.05 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.545 HG23 ' HB2' ' A' ' 59' ' ' MET . 33.5 p . . . . . 0 CA--C 1.53 0.184 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.895 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.4 ' HE3' ' HB2' ' A' ' 94' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.879 0.371 . . . . 0.0 110.732 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.545 ' HB2' HG23 ' A' ' 51' ' ' THR . 3.5 mpp? -149.64 138.65 21.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.656 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.716 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 39.0 mt -124.8 149.83 46.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.29 178.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.427 ' N ' ' O ' ' A' ' 49' ' ' GLN . 11.0 mtp180 -151.02 156.0 40.22 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.938 0.399 . . . . 0.0 111.604 -179.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.895 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -127.9 118.72 24.15 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.106 178.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.911 HD11 ' HG3' ' A' ' 49' ' ' GLN . 6.6 mm -77.29 153.93 5.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.775 0.321 . . . . 0.0 111.049 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.298 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.494 180.0 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.489 HG22 ' N ' ' A' ' 67' ' ' ASP . 13.3 p . . . . . 0 N--CA 1.457 -0.095 0 CA-C-O 120.897 0.38 . . . . 0.0 111.417 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.489 ' N ' HG22 ' A' ' 66' ' ' VAL . 4.2 m-20 -99.9 47.45 0.94 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.588 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -68.32 -11.39 59.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.478 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.3 m -53.98 -25.1 19.2 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.853 0.358 . . . . 0.0 111.087 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 42.3 mmtt -77.17 -70.18 0.48 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.668 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.9 ptmt 42.63 81.43 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.363 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.403 ' CD ' ' N ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -145.47 -174.16 4.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.052 -179.945 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 78' ' ' ASN . 6.2 mptt -102.8 -171.29 1.93 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.959 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -113.94 -36.51 4.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.017 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 167.89 -30.3 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.149 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -97.02 29.21 3.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.238 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 61.72 16.9 52.82 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.841 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.443 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 15.5 m-20 -67.2 -152.61 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.401 ' HG2' HG12 ' A' ' 81' ' ' VAL . 2.5 tt0 -153.28 118.97 5.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.769 0.319 . . . . 0.0 110.826 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.2 t -94.38 -66.9 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.439 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.455 ' O ' HG13 ' A' ' 81' ' ' VAL . 5.0 p 33.15 80.2 0.26 Allowed Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.639 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -41.66 124.56 2.6 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 123.005 2.47 . . . . 0.0 112.844 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 31.4 mttt -73.21 159.9 83.94 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.908 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.422 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.3 Cg_exo . . . . . 0 N--CA 1.46 -0.484 0 C-N-CA 123.52 2.814 . . . . 0.0 112.384 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.746 0.308 . . . . 0.0 110.768 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.497 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 7.5 m-70 -92.04 111.57 23.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.401 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 12.2 ttt -98.99 134.26 42.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.148 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.917 ' CD2' HD11 ' A' ' 16' ' ' ILE . 2.7 m-85 -136.04 122.36 20.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.792 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.8 114.28 26.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.884 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.546 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 11.1 m-85 -91.35 145.18 24.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.88 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -99.24 34.83 2.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.605 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.674 ' HB3' HG23 ' A' ' 96' ' ' VAL . 1.1 m-20 -178.99 118.06 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.609 -179.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.423 ' HA ' ' CG ' ' A' ' 97' ' ' MET . 0.7 OUTLIER -60.06 -15.38 22.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.691 179.477 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.13 -43.07 58.88 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.066 0.46 . . . . 0.0 110.024 179.555 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.674 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -65.93 -51.76 57.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.295 179.061 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.423 ' CG ' ' HA ' ' A' ' 94' ' ' ARG . 0.5 OUTLIER -61.49 -36.32 80.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.285 179.372 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.406 ' HB2' ' O ' ' A' ' 94' ' ' ARG . 8.2 t70 -66.59 -34.23 77.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.112 0.482 . . . . 0.0 110.086 179.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.418 ' O ' ' OG1' ' A' ' 103' ' ' THR . 53.4 m-20 -81.82 -26.43 34.34 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.531 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.464 HD12 ' CG2' ' A' ' 16' ' ' ILE . 2.2 mm -86.15 -59.79 2.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.088 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 9.9 ttmt -44.51 -30.32 0.86 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.168 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.424 ' HG3' ' N ' ' A' ' 103' ' ' THR . 19.8 ptp -78.86 -39.29 35.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.326 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.518 HG21 ' HA ' ' A' ' 3' ' ' HIS . 0.3 OUTLIER -58.4 -60.07 4.36 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.846 179.737 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 1.06 HD13 HD11 ' A' ' 48' ' ' LEU . 2.7 mt -48.0 -57.43 5.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.912 179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.13 -41.43 79.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.969 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -54.67 -35.04 63.14 Favored 'General case' 0 C--O 1.231 0.132 0 CA-C-O 121.165 0.507 . . . . 0.0 110.337 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.04 HG22 ' HE1' ' A' ' 111' ' ' TYR . 11.9 mt -85.74 -51.03 13.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.468 179.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.656 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -42.45 -58.13 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.486 179.356 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -47.13 -27.52 1.44 Allowed 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.296 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.463 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 0.0 OUTLIER -73.38 -24.67 60.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.001 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 1.04 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -74.59 -34.96 62.98 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.425 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.765 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.63 -43.32 17.11 Favored 'General case' 0 CA--C 1.504 -0.804 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 179.38 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . 0.404 ' HB2' ' HA ' ' A' ' 110' ' ' ARG . 1.2 m-20 -62.31 -32.06 72.75 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 113.973 -1.467 . . . . 0.0 108.99 178.193 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.463 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.383 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.64 178.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.5 m170 . . . . . 0 CA--C 1.528 0.119 0 CA-C-O 120.519 0.2 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.575 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 49.7 p -156.3 152.85 28.18 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.193 0.52 . . . . 0.0 111.503 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.524 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . -174.91 179.93 45.9 Favored Glycine 0 N--CA 1.448 -0.562 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.521 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -120.6 129.27 53.68 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 117.738 0.769 . . . . 0.0 111.459 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.707 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -141.41 171.15 14.45 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.889 -178.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.652 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -100.61 121.92 51.98 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.018 179.853 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.47 ' HB2' ' CE2' ' A' ' 29' ' ' TRP . 0.7 OUTLIER -120.26 106.02 11.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.03 0.443 . . . . 0.0 111.86 179.531 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 68.16 52.71 0.65 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.562 178.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 71.19 -4.25 1.85 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.913 179.552 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.471 ' O ' HG23 ' A' ' 8' ' ' ILE . 25.2 t -103.52 148.56 8.34 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.566 0 CA-C-O 121.239 0.542 . . . . 0.0 110.527 179.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.481 ' HA ' HD12 ' A' ' 8' ' ' ILE . 1.0 OUTLIER -115.32 113.76 24.25 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.086 -179.962 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.855 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -133.63 -122.22 2.27 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.922 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.855 HD13 ' O ' ' A' ' 14' ' ' GLY . 18.7 mm -141.74 136.58 31.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.766 0.317 . . . . 0.0 111.146 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.913 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.82 141.76 16.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 106.301 -1.74 . . . . 0.0 106.301 176.543 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.575 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.32 115.73 5.09 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.393 -0.923 . . . . 0.0 111.55 -178.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.894 HD13 HG22 ' A' ' 103' ' ' THR . 5.0 mt -86.68 132.3 32.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.908 -178.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.595 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -110.72 92.82 4.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.265 179.45 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -81.39 0.51 37.06 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.517 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -82.55 0.69 41.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.259 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.595 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -101.9 -162.93 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.885 0.374 . . . . 0.0 110.88 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.3 p -174.75 101.51 0.27 Allowed Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.333 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.463 ' HB3' ' HB3' ' A' ' 43' ' ' SER . 11.3 Cg_exo -69.52 166.34 73.67 Favored 'Cis proline' 0 C--N 1.347 0.474 0 C-N-CA 123.604 -1.415 . . . . 0.0 112.562 0.467 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.551 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -61.07 176.67 0.4 Allowed 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.143 179.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.476 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.78 135.07 4.65 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.24 179.326 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.791 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.96 129.43 55.11 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.88 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.791 HG22 ' CG2' ' A' ' 37' ' ' VAL . 0.3 OUTLIER -113.36 110.41 20.29 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -178.653 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.57 ' HD1' HG13 ' A' ' 16' ' ' ILE . 72.7 t90 -91.77 113.56 25.86 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.505 ' O ' ' N ' ' A' ' 15' ' ' ILE . 2.6 ptm180 -114.21 134.61 54.8 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.914 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.461 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 0.2 OUTLIER -49.9 168.5 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.47 179.868 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 54.8 m -76.98 -39.08 51.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.347 0.594 . . . . 0.0 109.903 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -84.85 -14.91 46.49 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.178 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.81 33.89 12.09 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.383 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -83.19 -29.84 28.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.752 0.311 . . . . 0.0 111.332 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.0 157.54 18.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.344 0.592 . . . . 0.0 111.349 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.791 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.9 OUTLIER -145.73 130.34 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.718 -178.823 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.461 ' CB ' ' CE2' ' A' ' 9' ' ' PHE . 2.7 m80 -107.71 122.76 47.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.944 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.659 HG23 HG23 ' A' ' 28' ' ' THR . 0.3 OUTLIER -96.51 129.83 43.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.794 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.531 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -117.4 139.9 42.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.338 -179.649 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.749 HG12 ' OG ' ' A' ' 43' ' ' SER . 2.8 t -103.88 95.86 4.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 177.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.793 HD11 HD22 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -42.13 -24.8 0.05 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.062 -178.919 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.749 ' OG ' HG12 ' A' ' 41' ' ' VAL . 3.1 p -74.94 -48.75 22.87 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 179.236 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.474 HG23 ' HB ' ' A' ' 41' ' ' VAL . 44.9 p -64.71 -28.01 69.31 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.87 HD12 ' HB3' ' A' ' 62' ' ' LEU . 33.8 mm -57.15 105.69 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.533 178.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.474 ' N ' ' O ' ' A' ' 63' ' ' ILE . 2.6 t0 -47.87 -33.55 7.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.805 0.336 . . . . 0.0 111.071 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.415 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 0.2 OUTLIER -172.47 163.39 5.48 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.805 179.63 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.859 HD11 HD13 ' A' ' 104' ' ' LEU . 14.0 tp -109.11 124.85 51.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.01 -179.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.495 ' CD ' HD11 ' A' ' 63' ' ' ILE . 17.2 mt-30 -119.99 144.93 47.23 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.611 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.666 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.06 147.88 21.63 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.7 -0.227 . . . . 0.0 110.793 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.409 HG23 ' HB2' ' A' ' 59' ' ' MET . 71.2 p . . . . . 0 C--N 1.333 -0.135 0 CA-C-O 120.741 0.305 . . . . 0.0 111.144 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.423 ' HG2' ' HB2' ' A' ' 91' ' ' PHE . 1.0 OUTLIER . . . . . 0 N--CA 1.463 0.185 0 CA-C-O 120.919 0.39 . . . . 0.0 111.698 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.409 ' HB2' HG23 ' A' ' 51' ' ' THR . 24.0 mtm -150.09 138.52 20.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.432 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.666 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 20.9 mt -117.8 142.19 47.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.225 178.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.443 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 13.8 ttm180 -142.51 150.01 39.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.984 0.421 . . . . 0.0 111.846 -179.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.87 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -128.4 117.32 21.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.949 178.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.861 HG23 ' HG2' ' A' ' 86' ' ' ARG . 10.3 mm -76.47 146.07 9.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.764 -179.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.408 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.386 179.972 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.48 HG22 ' N ' ' A' ' 67' ' ' ASP . 13.2 p . . . . . 0 N--CA 1.457 -0.113 0 CA-C-O 120.814 0.34 . . . . 0.0 111.258 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.48 ' N ' HG22 ' A' ' 66' ' ' VAL . 5.2 m-20 -101.13 39.39 1.41 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.772 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.41 -23.03 64.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.113 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.1 t -60.39 -20.41 59.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.105 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt -83.24 -67.32 0.8 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.867 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.437 ' HG3' HG23 ' A' ' 81' ' ' VAL . 28.3 mttt 60.17 92.35 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.764 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.74 -179.02 4.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.065 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.8 mttp -131.82 -167.2 1.83 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.708 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -136.86 -178.67 5.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.893 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -57.32 -22.09 39.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.408 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -108.73 34.8 3.48 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.855 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 55.22 25.22 39.23 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.558 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -67.42 -169.95 0.12 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.797 0.332 . . . . 0.0 110.903 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -136.62 122.01 19.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.637 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.6 t -91.1 -64.91 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.357 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.437 HG23 ' HG3' ' A' ' 71' ' ' LYS . 4.4 p 34.85 78.09 0.35 Allowed Pre-proline 0 CA--C 1.531 0.212 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.958 179.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -42.73 125.31 3.79 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 123.125 2.55 . . . . 0.0 112.648 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.402 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -60.59 161.42 14.53 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.076 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 5.0 Cg_exo . . . . . 0 N--CA 1.461 -0.394 0 C-N-CA 123.578 2.852 . . . . 0.0 112.363 -179.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.861 ' HG2' HG23 ' A' ' 63' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.601 0.238 . . . . 0.0 110.734 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.47 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 31.4 m-70 -96.87 112.56 24.26 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.09 119.17 32.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.97 0.414 . . . . 0.0 111.391 -179.236 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.913 ' CD1' HD11 ' A' ' 16' ' ' ILE . 89.7 m-85 -122.94 116.75 24.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.58 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.416 ' HB3' ' HB ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.52 114.57 28.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.785 0.326 . . . . 0.0 110.628 179.936 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.707 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 30.7 m-85 -93.5 152.63 18.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.371 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -110.39 28.47 8.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.603 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.458 ' CB ' HG23 ' A' ' 96' ' ' VAL . 9.0 m-20 -171.59 112.16 0.33 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.635 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.446 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 2.5 ttp85 -55.87 -19.48 11.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.911 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.22 -47.35 61.81 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.684 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.466 HG11 ' H ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -66.67 -46.1 86.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.451 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -63.27 -36.35 83.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.918 179.329 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.451 ' N ' ' HG3' ' A' ' 97' ' ' MET . 11.0 m-20 -62.6 -34.14 76.4 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.148 0.499 . . . . 0.0 110.047 179.19 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 45.1 m-20 -81.84 -35.06 29.8 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.527 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.612 HG23 HD11 ' A' ' 18' ' ' ILE . 9.4 mm -76.45 -59.83 2.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.717 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.418 ' HG3' ' CB ' ' A' ' 50' ' ' ALA . 5.8 ttmt -51.62 -29.69 18.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.148 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.42 ' HG3' ' N ' ' A' ' 103' ' ' THR . 9.4 ptp -82.49 -37.98 24.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.92 -179.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.894 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -70.29 -42.09 72.52 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.018 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.859 HD13 HD11 ' A' ' 48' ' ' LEU . 28.4 mt -55.14 -52.1 64.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.016 0.436 . . . . 0.0 110.017 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -46.22 91.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.26 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 -47.06 -34.14 5.55 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.12 0.485 . . . . 0.0 110.864 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.047 HG22 ' HE1' ' A' ' 111' ' ' TYR . 12.3 mt -85.62 -52.27 12.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.264 179.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.689 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.48 -57.65 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.497 179.323 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -47.55 -26.06 1.32 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.347 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.455 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 0.0 OUTLIER -75.69 -24.8 56.29 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.925 179.865 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 1.047 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -73.69 -34.35 64.83 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 179.233 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.757 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.53 -43.24 17.37 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 179.058 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -62.01 -32.16 72.62 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 113.898 -1.501 . . . . 0.0 109.022 178.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.455 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.437 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.611 178.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.414 ' O ' ' N ' ' A' ' 18' ' ' ILE . 34.6 m170 . . . . . 0 CA--C 1.531 0.247 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.566 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 4.0 p -152.67 153.89 34.2 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.125 0.488 . . . . 0.0 111.333 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.502 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 172.07 138.93 2.67 Favored Glycine 0 C--O 1.225 -0.421 0 N-CA-C 110.731 -0.948 . . . . 0.0 110.731 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.565 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -83.13 145.98 28.91 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -178.5 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.58 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -157.5 171.27 20.67 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.162 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.68 HD12 ' HA ' ' A' ' 13' ' ' SER . 5.2 mm -101.24 127.58 54.37 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.477 ' CZ ' ' CD2' ' A' ' 38' ' ' HIS . 5.9 t80 -124.39 108.23 11.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.996 0.427 . . . . 0.0 111.041 178.046 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 6.8 mm-40 68.67 49.2 0.74 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.829 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp 72.82 -6.25 1.7 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.135 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.529 ' O ' HG23 ' A' ' 8' ' ' ILE . 14.3 t -101.04 144.91 12.21 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.497 0 CA-C-O 121.219 0.533 . . . . 0.0 110.562 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.68 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -99.16 114.18 26.81 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.938 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -136.46 -170.42 11.98 Favored Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.886 -0.673 . . . . 0.0 111.846 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.565 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 14.5 mm -105.76 136.11 41.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 120.788 0.327 . . . . 0.0 111.186 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.826 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.51 140.62 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 176.962 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.566 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.3 117.9 5.74 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.716 -0.794 . . . . 0.0 111.554 -178.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.632 HD12 ' HB ' ' A' ' 103' ' ' THR . 22.5 mt -82.02 142.81 13.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 114.461 -1.245 . . . . 0.0 112.184 -178.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.67 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.6 t30 -118.2 92.82 3.92 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.972 179.14 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.29 -0.82 42.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.314 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -82.45 0.62 41.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.661 0.267 . . . . 0.0 111.184 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.67 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.46 -162.34 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 120.824 0.345 . . . . 0.0 110.654 179.994 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.1 t -176.29 101.6 0.24 Allowed Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.4 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.45 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 9.7 Cg_exo -70.98 161.37 89.87 Favored 'Cis proline' 0 C--N 1.347 0.492 0 C-N-CA 123.682 -1.382 . . . . 0.0 112.673 0.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.456 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -54.64 178.23 0.03 OUTLIER 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.498 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.525 ' HG2' HG21 ' A' ' 22' ' ' VAL . 7.9 pt-20 -163.63 135.18 4.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.135 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.802 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.9 130.44 55.02 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.123 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.471 HG22 ' CG2' ' A' ' 37' ' ' VAL . 10.4 m -113.46 113.06 24.63 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.496 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 73.2 t90 -91.92 110.38 21.73 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.8 ttt180 -106.25 131.0 54.0 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.838 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.7 m -49.96 153.89 1.24 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.706 0.289 . . . . 0.0 110.562 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 18.8 m -72.97 -33.69 66.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.281 0.563 . . . . 0.0 109.7 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -87.96 -17.16 31.9 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.002 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.89 33.61 10.88 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.31 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -88.48 -24.39 22.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.645 0.259 . . . . 0.0 111.485 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.04 166.61 2.98 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.383 0.611 . . . . 0.0 111.465 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.496 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.6 OUTLIER -143.66 155.48 16.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.919 -178.865 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.477 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 37.8 m80 -130.15 119.39 22.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.695 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.43 129.05 43.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.763 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.577 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -116.78 139.72 42.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.379 -179.543 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.429 ' HB ' HG23 ' A' ' 44' ' ' THR . 25.3 t -103.97 95.37 3.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 177.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.72 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -42.59 -23.95 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.953 -178.849 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.45 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.8 OUTLIER -76.42 -48.15 20.71 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 179.257 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.429 HG23 ' HB ' ' A' ' 41' ' ' VAL . 34.8 p -64.53 -27.84 69.24 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.823 HD12 ' HB3' ' A' ' 62' ' ' LEU . 48.0 mm -56.46 110.56 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.548 178.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 63' ' ' ILE . 9.0 t0 -54.34 -31.65 54.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.794 0.33 . . . . 0.0 110.935 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.424 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 10.8 pttt -172.66 164.34 5.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.827 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 1.049 HD11 HD13 ' A' ' 104' ' ' LEU . 18.8 tp -109.02 117.35 33.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.409 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -113.2 147.45 37.43 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.551 0.215 . . . . 0.0 110.691 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.652 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.2 152.01 25.68 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.662 -0.244 . . . . 0.0 111.162 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.515 HG23 ' HB2' ' A' ' 59' ' ' MET . 17.7 p . . . . . 0 C--N 1.331 -0.209 0 CA-C-O 120.796 0.331 . . . . 0.0 111.168 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.405 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 1.8 mpt? . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.774 0.321 . . . . 0.0 111.153 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.515 ' HB2' HG23 ' A' ' 51' ' ' THR . 37.9 mtm -149.81 138.3 20.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.033 0.444 . . . . 0.0 111.73 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.652 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 17.2 mt -122.11 141.96 50.87 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.572 178.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 87' ' ' HIS . 42.1 ttp180 -142.48 150.74 40.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.104 0.478 . . . . 0.0 112.284 -178.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.823 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.6 mp -128.15 115.51 18.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.565 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.424 ' HB ' ' HG2' ' A' ' 47' ' ' LYS . 7.8 mm -76.42 156.5 5.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.623 0.249 . . . . 0.0 111.046 -179.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.498 -179.934 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.537 HG22 ' N ' ' A' ' 67' ' ' ASP . 13.1 p . . . . . 0 CA--C 1.528 0.097 0 CA-C-O 120.808 0.337 . . . . 0.0 110.994 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.537 ' N ' HG22 ' A' ' 66' ' ' VAL . 11.6 p30 -130.31 51.55 2.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.697 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.793 ' HA ' HG13 ' A' ' 81' ' ' VAL . 6.1 pt-20 -64.63 -16.44 62.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.401 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.1 m -105.81 33.61 3.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.904 0.383 . . . . 0.0 110.793 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.76 -40.78 0.69 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.967 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.3 mttp 63.45 95.44 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.955 0.407 . . . . 0.0 110.771 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.39 133.84 40.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.984 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.415 ' CG ' ' HA2' ' A' ' 77' ' ' GLY . 0.0 OUTLIER -68.28 149.21 49.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.131 -179.856 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.403 ' O ' ' CB ' ' A' ' 75' ' ' ASN . 0.6 OUTLIER -94.37 -36.19 12.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.834 179.793 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . 0.403 ' CB ' ' O ' ' A' ' 74' ' ' ASP . 0.7 OUTLIER 165.41 -28.42 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.115 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -116.55 30.78 7.13 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.385 -179.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.415 ' HA2' ' CG ' ' A' ' 73' ' ' LYS . . . 54.93 29.4 51.03 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.569 -0.824 . . . . 0.0 112.576 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -78.48 -0.86 31.06 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 55.64 108.81 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.821 0.343 . . . . 0.0 111.625 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 7.6 t -115.24 142.38 28.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.386 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.793 HG13 ' HA ' ' A' ' 68' ' ' GLU . 96.3 t -112.41 83.96 5.79 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.467 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -44.36 142.62 4.24 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.714 2.276 . . . . 0.0 112.489 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.5 mttt -89.32 164.96 28.22 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.018 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo . . . . . 0 N--CA 1.462 -0.376 0 C-N-CA 123.624 2.882 . . . . 0.0 112.019 -179.239 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.627 0.251 . . . . 0.0 110.476 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.485 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 7.1 m-70 -95.9 111.65 23.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.783 0.325 . . . . 0.0 110.501 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 3.8 ttt -93.95 137.85 32.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.98 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.826 ' CD1' HD11 ' A' ' 16' ' ' ILE . 87.9 m-85 -136.26 116.88 13.89 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.938 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.551 ' HB2' HG12 ' A' ' 8' ' ' ILE . 1.1 m -91.0 114.74 27.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.827 0.346 . . . . 0.0 110.64 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.47 ' CE2' HG13 ' A' ' 100' ' ' ILE . 9.3 m-85 -92.62 135.78 33.79 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.569 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -101.75 31.03 4.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.475 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.454 ' CB ' HG23 ' A' ' 96' ' ' VAL . 4.6 m-20 -176.42 120.68 0.15 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.757 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.485 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -59.89 -16.66 31.06 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.67 179.544 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -74.37 -50.75 17.38 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 120.95 0.405 . . . . 0.0 110.402 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.454 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -66.22 -40.13 86.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.687 179.323 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.485 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -68.41 -37.97 80.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.038 179.531 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.427 ' N ' ' HG3' ' A' ' 97' ' ' MET . 17.8 t0 -65.9 -26.67 67.72 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.998 178.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.425 ' O ' ' OG1' ' A' ' 103' ' ' THR . 79.7 m-20 -81.66 -65.71 0.98 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.412 179.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.715 HG22 HD11 ' A' ' 104' ' ' LEU . 15.1 mm -48.28 -57.87 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-O 121.115 0.483 . . . . 0.0 110.623 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.63 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 17.2 ttpp -46.77 -39.18 11.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.983 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 30.3 mtm -78.01 -43.75 28.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.497 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.632 ' HB ' HD12 ' A' ' 18' ' ' ILE . 0.2 OUTLIER -56.96 -53.61 56.03 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.084 -179.991 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 1.049 HD13 HD11 ' A' ' 48' ' ' LEU . 3.4 mt -49.99 -53.27 27.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.993 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -56.87 -46.28 81.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.007 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -49.9 -35.04 22.22 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 121.176 0.512 . . . . 0.0 110.3 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.036 HG22 ' HE1' ' A' ' 111' ' ' TYR . 10.2 mt -85.66 -51.83 12.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.379 179.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.686 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.28 -57.2 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.37 179.338 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -46.95 -28.22 1.54 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.253 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.538 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.0 OUTLIER -72.89 -24.89 60.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.28 179.896 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 1.036 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -75.08 -34.79 61.82 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.665 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.76 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.47 -43.68 16.94 Favored 'General case' 0 CA--C 1.505 -0.752 0 N-CA-C 107.918 -1.142 . . . . 0.0 107.918 179.114 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -61.39 -31.36 71.27 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 113.883 -1.508 . . . . 0.0 109.027 178.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.456 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.449 -0.488 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.56 178.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.2 m170 . . . . . 0 CA--C 1.528 0.097 0 CA-C-O 120.599 0.238 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.535 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 8.1 p -161.52 159.76 28.27 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.199 0.523 . . . . 0.0 111.37 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . 168.32 136.84 2.12 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.109 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.567 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -80.83 142.48 33.64 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -178.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.656 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -148.08 171.31 16.05 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.402 -179.145 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.678 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -104.1 122.64 57.17 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.439 -179.766 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.469 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 5.1 t80 -122.77 107.64 12.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.942 0.401 . . . . 0.0 111.153 178.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 8.0 mt-10 68.34 48.4 0.88 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.92 179.11 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.9 mttm 73.15 -4.73 2.11 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.451 ' O ' HG23 ' A' ' 8' ' ' ILE . 18.9 t -100.91 149.45 6.25 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 CA-C-O 121.094 0.473 . . . . 0.0 110.54 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.402 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -110.42 114.03 27.14 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.8 179.834 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.862 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -130.91 -138.19 4.23 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.206 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.862 HD13 ' O ' ' A' ' 14' ' ' GLY . 15.4 mm -135.64 131.87 51.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.725 0.298 . . . . 0.0 111.551 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.865 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -101.33 115.54 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 177.524 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.535 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -125.36 116.1 21.36 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.589 0.709 . . . . 0.0 110.936 -179.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.881 HD13 HG22 ' A' ' 103' ' ' THR . 7.2 mt -82.25 142.74 13.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.824 -178.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.596 ' O ' HG23 ' A' ' 22' ' ' VAL . 2.4 m120 -117.66 93.92 4.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.368 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.403 ' CG ' HG12 ' A' ' 107' ' ' ILE . 1.2 tm-20 -81.61 -0.16 41.13 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.397 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -83.64 1.36 42.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.561 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.596 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -100.55 -162.48 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.959 0.409 . . . . 0.0 111.045 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.6 t -176.86 101.04 0.23 Allowed Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.32 179.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.427 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 38.1 Cg_endo -67.98 161.87 79.35 Favored 'Cis proline' 0 C--N 1.347 0.457 0 C-N-CA 123.349 -1.521 . . . . 0.0 112.422 0.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.562 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -53.48 -174.71 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.868 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -161.23 144.09 12.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.564 0.697 . . . . 0.0 112.312 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.707 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 3.0 tt -108.25 149.14 29.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.753 -1.112 . . . . 0.0 108.541 178.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.1 m -147.42 104.65 3.66 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.168 -0.613 . . . . 0.0 112.557 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.499 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 84.9 t90 -92.02 110.44 21.81 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.727 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.479 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.5 ttm180 -110.69 130.59 55.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.925 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.3 t -49.86 156.81 0.67 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.66 0.267 . . . . 0.0 110.533 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.416 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 28.4 m -74.52 -35.71 63.18 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.438 0.637 . . . . 0.0 109.817 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -85.6 -16.01 40.69 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.119 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.62 34.22 12.03 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.358 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -87.37 -24.37 24.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.706 0.289 . . . . 0.0 111.54 -179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.27 163.01 2.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.293 0.568 . . . . 0.0 111.521 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.7 148.58 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.033 -178.864 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -123.58 120.08 31.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.61 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.49 146.42 24.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.856 0.36 . . . . 0.0 110.934 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.707 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.2 t -131.17 139.13 51.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.494 -179.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.416 HG12 ' HB3' ' A' ' 43' ' ' SER . 46.4 t -103.95 95.91 4.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 177.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.909 HD11 ' CD2' ' A' ' 104' ' ' LEU . 1.1 mm? -42.46 -22.2 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.427 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 2.1 t -77.21 -48.26 18.05 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 43.2 p -64.95 -28.11 69.3 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.85 HD12 ' HB3' ' A' ' 62' ' ' LEU . 46.1 mm -56.6 108.63 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.648 178.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.428 ' N ' ' O ' ' A' ' 63' ' ' ILE . 1.6 t0 -54.15 -31.81 53.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.886 0.374 . . . . 0.0 110.971 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.427 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 0.7 OUTLIER -171.67 164.59 6.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.75 179.814 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.862 HD11 HD13 ' A' ' 104' ' ' LEU . 11.4 tp -109.05 118.22 36.22 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.874 -179.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.482 ' O ' ' N ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -108.75 139.12 44.01 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.299 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.716 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -156.86 143.92 18.7 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.759 0.314 . . . . 0.0 111.291 -179.551 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.419 ' CG2' ' HB2' ' A' ' 59' ' ' MET . 7.0 p . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.414 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.467 ' HG2' ' CA ' ' A' ' 94' ' ' ARG . 2.2 mpt? . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.898 0.38 . . . . 0.0 111.235 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.624 ' HG3' ' HA ' ' A' ' 90' ' ' SER . 0.0 OUTLIER -149.95 137.88 20.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.572 -179.859 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.716 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 29.6 mt -127.8 148.89 50.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.971 178.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.482 ' N ' ' O ' ' A' ' 49' ' ' GLN . 12.6 ttt180 -153.17 152.4 31.2 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -179.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.85 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.4 mp -128.21 116.73 20.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.717 178.224 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.625 HG23 ' HG2' ' A' ' 86' ' ' ARG . 19.0 mm -76.59 156.72 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.723 0.297 . . . . 0.0 111.257 -179.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.435 ' N ' HG22 ' A' ' 63' ' ' ILE . . . . . . . . 0 N--CA 1.452 -0.236 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.31 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.492 HG22 ' N ' ' A' ' 67' ' ' ASP . 12.2 p . . . . . 0 N--CA 1.457 -0.108 0 CA-C-O 120.801 0.334 . . . . 0.0 111.319 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.492 ' N ' HG22 ' A' ' 66' ' ' VAL . 11.6 p-10 -122.29 53.2 1.25 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.661 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -62.95 -15.14 54.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.464 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.0 t -53.38 -25.04 13.93 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.948 0.404 . . . . 0.0 111.24 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.7 mmtm -74.12 -69.1 0.47 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.693 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.1 ptpt 42.57 81.13 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.419 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.429 ' NH1' HG11 ' A' ' 80' ' ' VAL . 0.0 OUTLIER -148.76 -175.94 5.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.16 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.41 ' HG3' ' O ' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -108.44 -173.14 2.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.898 -179.736 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -105.79 -41.19 5.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.987 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 168.17 -31.32 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.05 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -98.5 39.3 1.26 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.003 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 59.5 18.8 45.55 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.64 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.41 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 16.5 m-80 -61.58 -156.45 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 110.46 -0.2 . . . . 0.0 110.46 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -162.22 114.43 1.69 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.803 0.335 . . . . 0.0 110.767 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.799 HG12 ' HD3' ' A' ' 82' ' ' PRO . 42.8 t -96.3 -69.94 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.494 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.5 HG22 ' O ' ' A' ' 81' ' ' VAL . 4.1 p 35.46 70.55 0.97 Allowed Pre-proline 0 CA--C 1.53 0.203 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.584 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.799 ' HD3' HG12 ' A' ' 80' ' ' VAL . 4.7 Cg_exo -40.18 128.79 2.25 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 123.435 2.757 . . . . 0.0 112.76 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.9 pttm -94.98 164.7 18.71 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.946 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.455 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 4.3 Cg_exo . . . . . 0 N--CA 1.461 -0.389 0 C-N-CA 123.603 2.869 . . . . 0.0 112.255 -179.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.625 ' HG2' HG23 ' A' ' 63' ' ' ILE . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.602 0.239 . . . . 0.0 110.528 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.462 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 6.8 m-70 -93.7 111.21 22.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.343 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.404 ' HA ' ' HG3' ' A' ' 61' ' ' ARG . 0.1 OUTLIER -107.07 137.36 45.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.971 0.415 . . . . 0.0 111.149 -179.637 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.865 ' CD2' HD11 ' A' ' 16' ' ' ILE . 1.1 m-85 -137.0 128.84 29.05 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.775 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.624 ' HA ' ' HG3' ' A' ' 59' ' ' MET . 0.9 OUTLIER -97.22 114.42 26.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.727 179.718 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.656 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 33.1 m-85 -91.12 145.58 24.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.109 0.48 . . . . 0.0 111.496 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -108.31 27.65 9.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.487 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -165.67 111.02 0.88 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.851 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.467 ' CA ' ' HG2' ' A' ' 58' ' ' MET . 0.0 OUTLIER -58.71 -23.62 59.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.429 179.696 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -72.95 -44.07 61.57 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.8 179.152 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.41 HG13 ' CA ' ' A' ' 5' ' ' GLY . 37.7 t -65.43 -51.96 57.49 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.445 178.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.419 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -60.67 -36.0 77.63 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.853 179.209 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.408 ' N ' ' HG3' ' A' ' 97' ' ' MET . 4.0 m-20 -61.05 -33.75 73.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.089 179.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -81.64 -25.23 35.8 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.578 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.581 HG22 HD12 ' A' ' 104' ' ' LEU . 9.1 mm -84.87 -60.14 2.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.002 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.419 ' HG3' ' CB ' ' A' ' 50' ' ' ALA . 2.7 ttmm -53.31 -27.48 23.32 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.766 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.457 ' HG3' ' N ' ' A' ' 103' ' ' THR . 9.5 ptp -81.57 -39.96 23.79 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.75 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.881 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -74.95 -32.91 61.86 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-O 120.984 0.421 . . . . 0.0 110.023 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.909 ' CD2' HD11 ' A' ' 42' ' ' LEU . 11.2 mt -60.71 -58.6 7.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.458 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.445 ' HA ' HG13 ' A' ' 108' ' ' ILE . 0.4 OUTLIER -68.34 -33.19 73.85 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.892 179.721 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -52.8 -34.72 54.93 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.273 0.559 . . . . 0.0 109.993 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.964 HG22 ' HE1' ' A' ' 111' ' ' TYR . 6.1 mt -84.95 -52.14 12.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.141 179.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.604 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.75 -57.81 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.334 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.091 178.961 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.403 ' HA ' ' HG2' ' A' ' 112' ' ' LYS . 0.1 OUTLIER -47.04 -26.29 1.02 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.131 179.757 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 6.0 mtt-85 -73.05 -25.04 60.78 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.35 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.964 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -76.59 -36.15 57.7 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.727 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -79.68 -43.75 22.13 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.903 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -61.73 -31.01 71.15 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 113.913 -1.494 . . . . 0.0 108.99 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.453 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.447 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.698 178.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.418 ' O ' ' N ' ' A' ' 18' ' ' ILE . 37.1 m80 . . . . . 0 CA--C 1.53 0.204 0 N-CA-C 111.49 0.182 . . . . 0.0 111.49 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.57 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 4.9 p -152.26 153.07 33.02 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 121.205 0.526 . . . . 0.0 111.262 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.489 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 173.03 139.07 2.75 Favored Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 110.707 -0.957 . . . . 0.0 110.707 -179.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.552 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.84 142.51 31.46 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -178.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.569 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -151.81 171.1 18.26 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.179 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.653 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.77 127.05 55.58 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.266 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.554 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.493 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 7.2 t80 -128.08 110.53 12.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.957 0.408 . . . . 0.0 111.093 178.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 3.7 mm-40 67.46 50.09 0.96 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.892 179.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 69.83 -4.42 1.46 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.187 179.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.478 ' O ' HG23 ' A' ' 8' ' ' ILE . 17.9 t -101.38 149.05 6.66 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 CA-C-O 121.122 0.487 . . . . 0.0 110.561 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.454 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -111.85 113.49 25.86 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.033 179.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.879 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.98 -133.05 3.4 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.952 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.879 HD13 ' O ' ' A' ' 14' ' ' GLY . 18.7 mm -135.89 136.11 50.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 120.688 0.28 . . . . 0.0 111.255 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.864 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.68 140.52 19.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 106.425 -1.695 . . . . 0.0 106.425 176.7 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.57 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.54 118.01 5.68 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 119.629 -0.829 . . . . 0.0 111.591 -178.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.64 HD12 ' HB ' ' A' ' 103' ' ' THR . 20.9 mt -81.52 142.88 13.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 114.501 -1.227 . . . . 0.0 112.164 -178.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.618 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -119.5 92.7 3.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.914 179.034 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.68 -0.2 41.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.319 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -82.49 0.37 42.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.647 -0.251 . . . . 0.0 111.096 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.618 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.31 -163.01 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.823 0.344 . . . . 0.0 110.775 179.92 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.6 p -175.1 101.48 0.26 Allowed Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.369 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.441 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 12.4 Cg_exo -69.48 166.34 73.54 Favored 'Cis proline' 0 C--N 1.346 0.445 0 C-N-CA 123.612 -1.411 . . . . 0.0 112.704 0.348 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.484 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -59.53 178.57 0.15 Allowed 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.342 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.522 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.73 134.52 4.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.209 179.042 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.797 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.93 129.12 55.12 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.904 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.54 HG22 ' CG2' ' A' ' 37' ' ' VAL . 6.8 m -112.33 113.41 25.61 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -178.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.533 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 76.3 t90 -91.79 110.36 21.7 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.261 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.492 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.5 ttt180 -109.41 130.33 55.5 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.727 0.298 . . . . 0.0 111.204 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.401 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 31.1 m -49.9 159.83 0.37 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.508 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.422 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 48.3 m -75.98 -37.58 58.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.333 0.587 . . . . 0.0 109.845 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -85.56 -12.91 50.46 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.155 -0.929 . . . . 0.0 111.233 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 83.73 35.4 16.41 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.361 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -87.56 -24.87 23.89 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.709 0.29 . . . . 0.0 111.383 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.75 163.94 2.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.321 0.581 . . . . 0.0 111.427 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.54 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.6 OUTLIER -143.77 155.45 16.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.981 -178.903 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.478 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 27.3 m80 -130.69 119.56 22.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.795 179.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.56 128.54 43.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.739 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.592 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -114.94 141.55 31.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.46 -179.629 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.434 ' HB ' HG23 ' A' ' 44' ' ' THR . 21.5 t -104.07 95.92 4.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 177.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.794 HD11 HD22 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -44.18 -21.94 0.05 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.835 -179.114 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.441 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER -76.92 -47.14 21.89 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.083 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.434 HG23 ' HB ' ' A' ' 41' ' ' VAL . 51.5 p -64.52 -28.08 69.41 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.869 HD12 ' HB3' ' A' ' 62' ' ' LEU . 49.9 mm -56.68 103.57 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.411 178.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.416 ' N ' ' O ' ' A' ' 63' ' ' ILE . 24.2 t70 -58.26 -20.26 40.74 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.807 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.471 ' HG2' HG12 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -172.6 160.18 4.59 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.105 0.478 . . . . 0.0 111.453 -179.877 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.799 HD21 ' HB2' ' A' ' 104' ' ' LEU . 12.2 tp -109.03 120.33 42.23 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.334 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' A' ' 61' ' ' ARG . 0.4 OUTLIER -122.52 145.59 48.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.63 0.252 . . . . 0.0 111.295 -179.641 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.618 ' CB ' HD22 ' A' ' 60' ' ' LEU . . . -157.3 149.86 23.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.667 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.585 HG23 ' HB2' ' A' ' 59' ' ' MET . 43.3 p . . . . . 0 CA--C 1.53 0.179 0 C-N-CA 121.045 -0.262 . . . . 0.0 110.87 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.77 0.319 . . . . 0.0 110.585 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.585 ' HB2' HG23 ' A' ' 51' ' ' THR . 23.8 mtm -143.97 142.93 30.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.861 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.618 HD22 ' CB ' ' A' ' 50' ' ' ALA . 17.9 mt -118.17 146.25 44.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.044 178.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.41 ' N ' ' O ' ' A' ' 49' ' ' GLN . 18.6 ttp180 -143.12 145.59 32.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.972 0.415 . . . . 0.0 112.119 -178.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.869 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -128.19 109.07 11.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.889 178.231 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.471 HG12 ' HG2' ' A' ' 47' ' ' LYS . 7.8 mm -76.64 156.41 5.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.994 -0.282 . . . . 0.0 110.891 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.356 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.417 179.939 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.446 HG22 ' N ' ' A' ' 67' ' ' ASP . 9.3 p . . . . . 0 CA--C 1.528 0.119 0 CA-C-O 120.707 0.289 . . . . 0.0 110.994 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.446 ' N ' HG22 ' A' ' 66' ' ' VAL . 6.5 t70 -136.99 38.36 2.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.197 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 44.67 30.16 0.49 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.312 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 64.6 m -102.1 -22.76 14.17 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.215 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 30.7 mmtm -56.4 -82.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.971 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.7 mttm 55.09 89.81 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.865 0.364 . . . . 0.0 111.129 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.41 ' HG2' ' CG ' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -124.57 134.42 52.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.863 179.95 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.7 mmtt -73.51 148.52 43.02 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.776 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -103.93 -31.74 9.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.037 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 168.57 -31.38 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.101 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -105.11 20.46 18.82 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.327 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 53.84 36.93 56.49 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.532 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -83.6 2.97 34.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.701 0.286 . . . . 0.0 111.646 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 79' ' ' GLU . 9.5 pt-20 42.39 74.38 0.11 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.223 -0.444 . . . . 0.0 112.008 179.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.448 HG12 ' N ' ' A' ' 81' ' ' VAL . 40.5 t -76.87 155.41 5.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.32 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.448 ' N ' HG12 ' A' ' 80' ' ' VAL . 52.3 t -110.9 78.96 1.73 Allowed Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.341 179.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.41 ' CG ' ' HG2' ' A' ' 72' ' ' ARG . 93.9 Cg_exo -41.24 156.02 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.907 2.405 . . . . 0.0 112.795 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.9 ptpp? -44.69 164.94 0.16 Allowed Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.217 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.438 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.8 Cg_exo . . . . . 0 N--CA 1.462 -0.335 0 C-N-CA 123.543 2.828 . . . . 0.0 112.771 -178.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.61 0.243 . . . . 0.0 110.6 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.525 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 10.8 m-70 -93.13 111.18 22.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.73 0.3 . . . . 0.0 110.303 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 16.6 ttt -94.18 118.26 31.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.283 -179.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.864 ' CD1' HD11 ' A' ' 16' ' ' ILE . 92.8 m-85 -116.98 116.63 27.76 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.654 179.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.439 ' HB3' ' HB ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -94.57 114.58 26.58 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.972 0.415 . . . . 0.0 110.545 179.931 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.518 ' CE1' ' HB2' ' A' ' 7' ' ' ALA . 5.8 m-85 -89.63 147.32 23.97 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.394 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -109.47 29.14 7.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.0 179.133 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.428 ' CB ' HG23 ' A' ' 96' ' ' VAL . 7.5 m-20 -174.97 117.69 0.18 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.585 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.481 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -59.47 -14.93 14.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.778 179.614 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.02 -50.83 18.02 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.025 0.44 . . . . 0.0 110.267 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.428 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -64.43 -43.71 97.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.658 179.247 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.481 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -64.38 -36.94 85.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.931 179.381 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -62.88 -28.73 70.24 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.817 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.455 ' O ' ' HG2' ' A' ' 102' ' ' MET . 5.4 m120 -81.69 -65.41 1.02 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.276 179.265 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.642 HG22 HD11 ' A' ' 104' ' ' LEU . 22.6 mm -47.32 -57.64 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.212 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.432 ' HA ' HD12 ' A' ' 104' ' ' LEU . 0.1 OUTLIER -50.03 -35.46 24.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.733 -179.416 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.531 ' HG3' ' N ' ' A' ' 103' ' ' THR . 9.0 ptp -83.04 -41.49 18.6 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.647 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.64 ' HB ' HD12 ' A' ' 18' ' ' ILE . 0.2 OUTLIER -56.85 -50.76 71.47 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 120.822 0.344 . . . . 0.0 110.564 179.505 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.799 ' HB2' HD21 ' A' ' 48' ' ' LEU . 5.5 mt -52.73 -52.5 55.99 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 179.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.71 ' HG2' HD23 ' A' ' 48' ' ' LEU . 58.6 mm-40 -55.46 -47.76 75.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.017 179.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -49.62 -34.8 19.06 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 121.134 0.492 . . . . 0.0 110.607 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.012 HG22 ' HE1' ' A' ' 111' ' ' TYR . 9.2 mt -85.69 -52.07 12.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.49 179.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.667 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -42.52 -57.06 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.622 179.484 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.449 ' HA ' ' HG2' ' A' ' 112' ' ' LYS . 10.1 t -47.98 -26.95 1.96 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.942 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.452 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 11.7 mtp-105 -72.36 -25.03 61.37 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.022 179.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 1.012 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -75.54 -34.95 60.79 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.599 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.767 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.73 -43.17 17.12 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.987 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -61.3 -32.36 72.21 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 113.815 -1.539 . . . . 0.0 108.99 178.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.452 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.449 -0.481 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.727 178.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.415 ' CD2' ' HG2' ' A' ' 20' ' ' GLU . 16.4 m80 . . . . . 0 CA--C 1.529 0.17 0 CA-C-O 120.542 0.21 . . . . 0.0 111.249 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.546 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 6.5 p -156.54 136.96 13.03 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 121.196 0.522 . . . . 0.0 111.145 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.517 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -171.73 138.54 4.89 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 110.751 -0.939 . . . . 0.0 110.751 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.565 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -81.29 142.75 32.81 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.516 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -155.74 170.98 20.79 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.364 -179.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.607 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -100.85 126.17 54.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.239 -179.826 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.537 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 58.4 t80 -117.25 108.6 15.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.047 0.451 . . . . 0.0 111.569 178.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 67.1 mt-10 58.49 55.55 4.82 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.84 178.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.4 mtmm 71.99 -6.66 1.44 Allowed 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.46 ' O ' HG23 ' A' ' 8' ' ' ILE . 34.0 t -101.73 150.16 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.549 0 CA-C-O 121.235 0.54 . . . . 0.0 110.545 179.383 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.438 ' HA ' HD12 ' A' ' 8' ' ' ILE . 90.4 p -106.1 144.76 32.35 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.003 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.908 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -171.67 -141.86 3.51 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.034 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.908 HD13 ' O ' ' A' ' 14' ' ' GLY . 13.8 mm -132.38 136.19 56.66 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.475 0 CA-C-O 120.938 0.399 . . . . 0.0 111.465 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.8 HD11 ' CG ' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.76 141.37 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 N-CA-C 106.332 -1.729 . . . . 0.0 106.332 176.759 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.546 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.61 118.59 5.85 Favored 'General case' 0 C--N 1.313 -1.002 0 C-N-CA 119.663 -0.815 . . . . 0.0 111.478 -178.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.626 HD12 ' HB ' ' A' ' 103' ' ' THR . 20.1 mt -82.0 142.99 12.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.255 -178.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.643 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -119.8 92.51 3.8 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.872 178.871 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.415 ' HG2' ' CD2' ' A' ' 3' ' ' HIS . 0.7 OUTLIER -82.85 0.92 41.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.376 -179.651 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -82.79 0.81 42.06 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.06 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.643 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.39 -162.07 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.852 0.358 . . . . 0.0 110.709 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.407 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 11.6 p -175.01 101.23 0.26 Allowed Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.541 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.434 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 9.8 Cg_exo -70.98 165.94 78.69 Favored 'Cis proline' 0 C--N 1.348 0.504 0 C-N-CA 123.617 -1.41 . . . . 0.0 112.634 0.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.44 ' CB ' HG21 ' A' ' 107' ' ' ILE . . . -59.66 177.92 0.19 Allowed 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.406 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.561 ' HG2' HG21 ' A' ' 22' ' ' VAL . 6.7 pt-20 -163.68 137.15 5.55 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.003 179.077 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.775 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.86 127.67 53.93 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 178.99 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.617 HG22 ' CG2' ' A' ' 37' ' ' VAL . 3.1 m -109.67 111.15 22.44 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 -178.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.537 ' CE2' ' HB3' ' A' ' 9' ' ' PHE . 65.6 t90 -91.95 113.68 26.02 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 116.233 -0.439 . . . . 0.0 109.868 178.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.433 ' O ' ' N ' ' A' ' 15' ' ' ILE . 2.5 ttt180 -106.91 133.52 51.43 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.658 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 27.3 m -49.72 166.49 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.251 -0.277 . . . . 0.0 110.251 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.0 m -76.8 -43.23 37.51 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.479 0.657 . . . . 0.0 109.894 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -83.96 -13.78 52.51 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.185 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.22 34.22 10.93 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.276 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.79 -23.08 29.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.684 0.278 . . . . 0.0 111.574 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.9 163.59 2.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.32 0.581 . . . . 0.0 111.422 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.617 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.6 146.03 19.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.985 -178.747 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.448 ' ND1' ' CZ ' ' A' ' 9' ' ' PHE . 1.4 m-70 -122.04 123.53 41.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.828 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.51 126.32 41.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.814 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.568 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -112.47 140.16 33.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.265 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.43 ' HB ' HG23 ' A' ' 44' ' ' THR . 23.3 t -104.01 96.49 4.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 177.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.73 HD11 HD22 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -43.05 -24.28 0.07 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.774 -179.019 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.434 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.8 OUTLIER -74.95 -47.95 26.89 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.281 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.43 HG23 ' HB ' ' A' ' 41' ' ' VAL . 48.7 p -64.64 -28.11 69.39 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 178.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.875 HD12 ' HB3' ' A' ' 62' ' ' LEU . 41.8 mm -57.59 99.83 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.526 178.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.453 ' N ' ' O ' ' A' ' 63' ' ' ILE . 16.5 t70 -47.48 -28.72 2.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.7 0.286 . . . . 0.0 111.31 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.45 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 1.4 pttt -172.72 156.97 3.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.894 0.378 . . . . 0.0 110.741 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.959 HD11 HD13 ' A' ' 104' ' ' LEU . 3.6 tp -109.1 122.47 47.36 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.714 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.616 ' OE1' HD11 ' A' ' 63' ' ' ILE . 17.9 mt-30 -118.75 151.99 37.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.793 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.661 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.16 150.47 23.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.78 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.594 HG23 ' HB2' ' A' ' 59' ' ' MET . 25.9 p . . . . . 0 C--N 1.332 -0.156 0 CA-C-O 120.63 0.252 . . . . 0.0 110.84 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.419 ' HG2' ' CB ' ' A' ' 94' ' ' ARG . 1.6 mpp? . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.764 0.316 . . . . 0.0 110.833 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.594 ' HB2' HG23 ' A' ' 51' ' ' THR . 14.2 mtm -149.69 143.6 25.57 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.648 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.661 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 24.0 mt -120.27 140.15 51.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.084 178.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.401 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 0.6 OUTLIER -135.42 148.84 49.45 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 120.917 0.389 . . . . 0.0 111.842 -179.169 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.875 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.4 mp -127.87 113.14 15.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.876 178.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.832 HG23 ' HG2' ' A' ' 86' ' ' ARG . 8.8 mm -76.66 145.53 10.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.649 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.381 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.558 -179.991 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.467 HG22 ' N ' ' A' ' 67' ' ' ASP . 11.5 p . . . . . 0 N--CA 1.457 -0.122 0 CA-C-O 120.878 0.37 . . . . 0.0 111.318 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.467 ' N ' HG22 ' A' ' 66' ' ' VAL . 4.8 m-20 -123.01 43.49 2.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.762 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.1 -20.87 57.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.17 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.32 -21.98 51.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.073 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.1 mmtm -67.11 -65.82 0.63 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.881 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.1 ptmt 43.15 80.78 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.453 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.16 164.41 17.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.942 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.3 mttp -116.68 154.93 29.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.921 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -86.96 170.72 11.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.933 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -59.88 -20.4 56.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.244 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -98.15 31.8 2.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.938 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 59.35 24.63 59.34 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.488 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 12.7 m-20 -78.88 -167.62 1.18 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.727 0.298 . . . . 0.0 110.779 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -147.0 126.82 13.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.867 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 59.6 t -95.07 -65.54 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.373 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.435 ' O ' HG13 ' A' ' 81' ' ' VAL . 4.5 p 34.11 78.26 0.33 Allowed Pre-proline 0 CA--C 1.53 0.188 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.855 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -44.02 124.14 4.58 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.891 2.394 . . . . 0.0 112.676 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.404 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 3.6 mtpt -84.59 159.57 58.08 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.965 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 4.1 Cg_exo . . . . . 0 N--CA 1.46 -0.487 0 C-N-CA 123.533 2.822 . . . . 0.0 112.402 -179.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.832 ' HG2' HG23 ' A' ' 63' ' ' ILE . 37.4 mtt180 . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.565 0.222 . . . . 0.0 110.541 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.478 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 20.7 m-70 -97.32 111.32 23.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.69 0.281 . . . . 0.0 110.349 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 7.5 ttt -94.08 112.97 24.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.997 0.427 . . . . 0.0 111.175 -179.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.8 ' CG ' HD11 ' A' ' 16' ' ' ILE . 90.8 m-85 -116.04 116.63 28.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.628 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -99.2 114.5 27.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.973 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.516 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 5.4 m-85 -95.04 133.66 38.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.149 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 37.5 m-20 -93.64 43.67 1.12 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.685 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.521 ' CB ' HG23 ' A' ' 96' ' ' VAL . 4.5 m-20 176.8 109.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.409 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.459 ' O ' ' HG3' ' A' ' 97' ' ' MET . 0.0 OUTLIER -52.96 -21.06 3.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.959 -179.995 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.34 -44.97 70.55 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 120.831 0.348 . . . . 0.0 110.633 179.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.521 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -66.17 -49.84 73.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.882 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.459 ' HG3' ' O ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -62.73 -36.57 83.43 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.351 179.5 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.453 ' O ' ' HG2' ' A' ' 102' ' ' MET . 8.6 t70 -67.6 -35.1 78.33 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.047 0.451 . . . . 0.0 110.053 179.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 68.6 m-20 -82.23 -29.58 31.25 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.712 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.517 HD11 ' N ' ' A' ' 5' ' ' GLY . 1.2 mm -83.19 -59.91 2.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.471 -179.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 6.6 ttmt -44.41 -28.69 0.58 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.328 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.453 ' HG2' ' O ' ' A' ' 98' ' ' ASP . 6.3 ptm -79.85 -40.29 28.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.424 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.626 ' HB ' HD12 ' A' ' 18' ' ' ILE . 0.2 OUTLIER -57.79 -58.89 6.38 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.715 179.563 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.959 HD13 HD11 ' A' ' 48' ' ' LEU . 4.7 mt -47.16 -50.48 20.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.76 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.869 HE21 HD23 ' A' ' 48' ' ' LEU . 49.9 mm-40 -56.65 -50.59 71.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.316 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.432 ' HG2' HG13 ' A' ' 107' ' ' ILE . 1.2 pt20 -50.88 -31.3 17.02 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 121.022 0.439 . . . . 0.0 110.921 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.038 HG22 ' HE1' ' A' ' 111' ' ' TYR . 8.4 mt -85.61 -52.94 11.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.652 179.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.715 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.51 -56.78 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.808 179.614 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.427 ' HA ' ' HG2' ' A' ' 112' ' ' LYS . 41.2 t -47.83 -26.57 1.7 Allowed 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.264 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 0.0 OUTLIER -74.75 -24.84 58.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.715 179.816 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 1.038 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -74.08 -34.2 63.91 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 179.154 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.765 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.76 -43.22 17.01 Favored 'General case' 0 CA--C 1.505 -0.753 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 179.059 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -61.67 -32.2 72.37 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.901 -1.5 . . . . 0.0 108.992 178.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.453 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.435 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.556 178.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.411 ' NE2' ' HB2' ' A' ' 20' ' ' GLU . 26.1 m170 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.777 0.323 . . . . 0.0 111.055 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.553 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 50.7 p -160.99 155.18 22.9 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.081 0.467 . . . . 0.0 111.087 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.439 ' O ' ' HB ' ' A' ' 16' ' ' ILE . . . 172.67 136.36 2.14 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.284 -179.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.576 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -79.79 138.08 37.16 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.102 0.477 . . . . 0.0 112.086 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.67 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -147.11 171.6 15.06 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.535 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.651 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.15 129.95 51.35 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.254 -179.884 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.538 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 62.2 t80 -124.34 109.81 13.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.979 0.418 . . . . 0.0 111.418 178.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 61.59 45.35 8.23 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.643 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.7 mtpp 78.19 -4.48 2.2 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 179.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.467 ' O ' HG23 ' A' ' 8' ' ' ILE . 28.2 t -99.94 150.82 5.19 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.466 0 CA-C-O 121.119 0.485 . . . . 0.0 110.369 179.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.403 ' HA ' HD12 ' A' ' 8' ' ' ILE . 90.5 p -105.69 116.0 31.19 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.127 -179.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.425 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -138.54 -158.55 7.77 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.13 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.576 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 18.7 mm -119.8 131.82 71.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.765 0.317 . . . . 0.0 111.325 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.861 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.4 OUTLIER -101.19 114.02 39.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -123.1 115.89 22.57 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.582 0.706 . . . . 0.0 110.831 -179.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.766 HD13 HG22 ' A' ' 103' ' ' THR . 15.7 mt -85.25 142.9 12.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 114.749 -1.114 . . . . 0.0 111.891 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.602 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.7 m120 -117.77 97.44 5.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.279 179.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.411 ' HB2' ' NE2' ' A' ' 3' ' ' HIS . 0.0 OUTLIER -84.1 -1.81 55.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.299 -179.757 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -82.92 1.37 39.94 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.486 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -98.35 -162.41 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.846 0.355 . . . . 0.0 110.943 180.0 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.0 p -173.97 99.98 0.3 Allowed Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.345 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.476 ' CG ' ' HB2' ' A' ' 43' ' ' SER . 56.6 Cg_endo -71.09 164.29 83.34 Favored 'Cis proline' 0 C--N 1.346 0.427 0 C-N-CA 123.605 -1.415 . . . . 0.0 112.867 0.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.582 ' CB ' HG21 ' A' ' 107' ' ' ILE . . . -54.99 -175.84 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.978 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -163.53 147.11 10.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.629 0.728 . . . . 0.0 112.482 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.693 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 2.8 tt -108.2 149.01 29.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.646 -1.161 . . . . 0.0 108.466 178.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.755 HG23 HG23 ' A' ' 39' ' ' THR . 0.2 OUTLIER -145.42 102.6 3.73 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -178.676 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.538 ' CE2' ' HB3' ' A' ' 9' ' ' PHE . 78.4 t90 -92.13 114.04 26.48 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.735 178.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.457 ' O ' ' N ' ' A' ' 15' ' ' ILE . 12.6 ptp180 -114.83 135.13 54.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.639 0.256 . . . . 0.0 110.534 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.5 m -49.81 158.24 0.5 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.717 0.294 . . . . 0.0 110.499 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 32.4 m -72.49 -36.0 68.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.416 0.627 . . . . 0.0 109.707 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -86.13 -18.26 32.78 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.024 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.76 32.56 9.94 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.439 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -85.79 -21.58 28.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.592 0.234 . . . . 0.0 111.52 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.1 158.71 2.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.356 0.598 . . . . 0.0 111.422 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.488 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.68 140.39 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.945 -178.72 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.496 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 0.6 OUTLIER -115.86 125.51 52.75 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.587 179.539 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.755 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -98.07 146.19 25.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.054 -179.677 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.693 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.2 t -129.91 136.7 58.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.144 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.422 ' O ' HG12 ' A' ' 45' ' ' ILE . 47.8 t -104.04 95.86 4.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.427 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.678 HD11 HD22 ' A' ' 104' ' ' LEU . 0.9 OUTLIER -41.93 -24.97 0.05 Allowed 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.642 -178.81 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.476 ' HB2' ' CG ' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -72.99 -51.27 18.91 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 178.621 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 30.8 p -64.93 -28.41 69.51 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 178.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.849 HD12 ' HB3' ' A' ' 62' ' ' LEU . 42.1 mm -56.39 103.31 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.22 178.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 63' ' ' ILE . 16.9 t70 -54.53 -31.93 57.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.154 -0.476 . . . . 0.0 112.048 -179.19 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.427 ' O ' ' CG2' ' A' ' 45' ' ' ILE . 53.2 mtmt -157.6 162.97 38.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.539 0.685 . . . . 0.0 112.285 -179.463 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.675 HD13 HD11 ' A' ' 108' ' ' ILE . 9.0 tp -111.52 121.68 45.82 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.118 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.615 ' NE2' HD11 ' A' ' 63' ' ' ILE . 12.0 mt-30 -125.01 136.44 53.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.62 0.247 . . . . 0.0 111.181 -179.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.671 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.07 141.23 16.37 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.041 179.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.642 HG23 ' HB3' ' A' ' 59' ' ' MET . 37.4 p . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.241 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.429 ' HB2' ' HG2' ' A' ' 97' ' ' MET . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.085 0 CA-C-O 121.177 0.513 . . . . 0.0 111.351 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.642 ' HB3' HG23 ' A' ' 51' ' ' THR . 7.8 ttp -149.95 138.03 20.34 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.845 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.671 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 26.7 mt -119.51 150.18 40.68 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.117 178.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.561 ' N ' ' O ' ' A' ' 49' ' ' GLN . 2.3 ttt180 -150.91 148.18 28.11 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -178.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.849 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.3 mp -128.6 118.78 23.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.896 178.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.615 HD11 ' NE2' ' A' ' 49' ' ' GLN . 25.0 mm -76.53 156.45 5.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.649 0.262 . . . . 0.0 111.033 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.445 ' N ' HG22 ' A' ' 63' ' ' ILE . . . . . . . . 0 N--CA 1.452 -0.297 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.524 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.48 HG22 ' N ' ' A' ' 67' ' ' ASP . 12.9 p . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.767 0.318 . . . . 0.0 111.081 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.48 ' N ' HG22 ' A' ' 66' ' ' VAL . 16.6 m-20 -115.66 40.24 2.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.009 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.506 ' HA ' HG13 ' A' ' 81' ' ' VAL . 20.8 pt-20 -64.6 -21.06 66.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.058 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 41.5 t -88.69 -22.81 23.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.106 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.6 mmmt -83.97 -41.01 17.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.865 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.609 ' HG2' HG22 ' A' ' 81' ' ' VAL . 16.1 mtmt 61.98 93.23 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.028 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.408 ' N ' ' O ' ' A' ' 80' ' ' VAL . 0.0 OUTLIER -61.83 -176.46 0.09 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.708 179.862 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -141.75 -170.54 3.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.795 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -125.21 -68.08 0.86 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.12 0.486 . . . . 0.0 111.043 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 179.24 -33.36 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.105 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -95.95 38.47 1.18 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.931 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 72.13 8.24 69.17 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.768 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -60.02 -173.74 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.809 0.338 . . . . 0.0 110.924 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -154.11 137.12 15.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.864 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.408 ' O ' ' N ' ' A' ' 72' ' ' ARG . 2.1 t -128.35 145.13 35.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.35 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.609 HG22 ' HG2' ' A' ' 71' ' ' LYS . 81.5 t -123.46 69.96 43.89 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.129 179.231 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_exo -43.1 124.7 3.87 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.789 2.326 . . . . 0.0 112.724 -179.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.3 mmtt -59.56 164.32 5.56 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.094 0.473 . . . . 0.0 110.978 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.439 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 4.6 Cg_exo . . . . . 0 N--CA 1.46 -0.454 0 C-N-CA 123.601 2.867 . . . . 0.0 112.284 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.477 ' NE ' HD12 ' A' ' 63' ' ' ILE . 30.2 mtt180 . . . . . 0 C--O 1.232 0.163 0 N-CA-C 110.286 -0.265 . . . . 0.0 110.286 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.479 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 15.2 m-70 -97.82 111.52 23.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.637 0.256 . . . . 0.0 110.558 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.85 122.45 42.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.941 0.401 . . . . 0.0 110.899 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.861 ' CD1' HD11 ' A' ' 16' ' ' ILE . 79.5 m-85 -125.58 116.87 22.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.775 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.437 ' HA ' ' HG3' ' A' ' 59' ' ' MET . 0.8 OUTLIER -95.83 114.55 26.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.145 -179.788 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.67 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 23.6 m-85 -91.42 158.63 16.4 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.169 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 -115.61 29.94 7.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.552 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.5 ' CB ' HG23 ' A' ' 96' ' ' VAL . 4.2 m-20 -173.43 115.84 0.25 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.532 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.449 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 10.4 ttp85 -58.95 -15.92 15.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.017 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.45 -43.7 54.99 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 121.03 0.443 . . . . 0.0 110.174 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.5 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -67.75 -48.48 75.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.437 179.102 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.449 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -62.05 -36.08 80.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.998 179.153 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.424 ' N ' ' HG3' ' A' ' 97' ' ' MET . 2.0 m-20 -62.57 -33.87 75.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.255 179.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 16.6 m-20 -81.87 -30.44 32.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.613 179.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.529 HG23 HD11 ' A' ' 18' ' ' ILE . 3.7 mm -79.53 -60.28 2.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.982 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.411 ' HG3' ' CB ' ' A' ' 50' ' ' ALA . 12.0 ttmt -51.85 -28.19 15.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.537 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 12.4 mtm -81.88 -29.39 32.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.941 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.766 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -82.42 -41.44 19.88 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.123 179.894 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.678 HD22 HD11 ' A' ' 42' ' ' LEU . 32.6 mt -56.81 -52.5 64.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.017 0.437 . . . . 0.0 109.855 179.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.662 ' HG2' HD23 ' A' ' 48' ' ' LEU . 5.3 mm-40 -61.98 -48.05 82.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.012 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -47.24 -33.06 5.07 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.985 0.422 . . . . 0.0 111.014 -179.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.043 HG22 ' HE1' ' A' ' 111' ' ' TYR . 3.5 mt -85.77 -52.14 12.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.68 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.716 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.14 -59.34 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.63 179.758 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -47.08 -24.89 0.73 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.228 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.447 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 49.8 mtp85 -74.69 -25.31 59.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.385 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 1.043 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -76.18 -34.19 59.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.184 0.516 . . . . 0.0 109.611 179.656 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.739 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.21 -43.61 19.0 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 178.98 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -62.29 -31.67 72.3 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 113.737 -1.574 . . . . 0.0 109.07 178.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.447 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.449 -0.487 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.676 178.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.407 ' NE2' ' HB2' ' A' ' 20' ' ' GLU . 29.8 m170 . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.571 0.224 . . . . 0.0 111.359 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.57 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 3.5 p -152.65 155.28 37.0 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.046 0.451 . . . . 0.0 111.051 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.499 ' O ' ' HB ' ' A' ' 16' ' ' ILE . . . 174.29 139.97 3.13 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 111.101 -0.799 . . . . 0.0 111.101 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.555 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -84.04 143.99 29.38 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.206 0.527 . . . . 0.0 112.333 -178.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.55 ' C ' HD13 ' A' ' 8' ' ' ILE . . . -153.48 171.26 18.96 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.19 -179.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.668 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.99 123.49 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.563 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.468 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.6 t80 -123.85 109.55 13.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.978 0.418 . . . . 0.0 111.082 178.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 30.6 mt-10 67.84 51.27 0.79 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.735 179.087 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.8 mmtp 69.07 -2.74 1.69 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.264 -0.425 . . . . 0.0 112.12 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.476 ' O ' HG23 ' A' ' 8' ' ' ILE . 20.1 t -102.81 148.79 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.47 0 CA-C-O 121.096 0.474 . . . . 0.0 110.625 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.459 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -111.22 112.47 24.27 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.941 179.835 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.89 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.42 -134.62 3.63 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.829 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.89 HD13 ' O ' ' A' ' 14' ' ' GLY . 18.0 mm -135.85 135.62 50.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.721 0.296 . . . . 0.0 111.332 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.94 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.57 141.23 17.77 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.66 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 176.476 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.57 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -150.93 117.44 5.73 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 119.574 -0.851 . . . . 0.0 111.489 -178.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.958 HD13 HG22 ' A' ' 103' ' ' THR . 6.2 mt -87.12 142.28 13.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 114.565 -1.198 . . . . 0.0 111.703 -178.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.633 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -120.13 92.99 3.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.467 179.758 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.407 ' HB2' ' NE2' ' A' ' 3' ' ' HIS . 0.1 OUTLIER -80.69 -0.05 36.54 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.411 -179.862 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -82.93 0.53 43.97 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.289 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.633 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -101.59 -162.5 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.844 0.354 . . . . 0.0 110.853 179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.5 t -174.06 101.33 0.3 Allowed Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.504 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.439 ' HB3' ' OG ' ' A' ' 43' ' ' SER . 61.1 Cg_endo -73.15 160.3 95.95 Favored 'Cis proline' 0 C--N 1.347 0.486 0 C-N-CA 123.455 -1.477 . . . . 0.0 112.758 0.367 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.412 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -52.15 175.39 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.52 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.466 ' CG ' HG21 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -163.65 136.31 5.24 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.14 179.343 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.815 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.99 149.15 28.74 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.787 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.709 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.5 m -135.15 112.97 10.92 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -178.368 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.556 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 79.4 t90 -92.04 110.64 22.02 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 178.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 15' ' ' ILE . 4.2 ttt180 -110.4 131.23 55.24 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.972 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.7 t -49.83 158.86 0.44 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.475 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.416 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 46.1 m -74.74 -37.18 62.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.459 0.647 . . . . 0.0 109.773 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -84.37 -15.96 44.53 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.124 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.59 34.55 11.55 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.322 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -85.37 -26.8 26.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.742 0.306 . . . . 0.0 111.309 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.31 164.24 3.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.319 0.58 . . . . 0.0 111.441 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.709 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.64 147.0 18.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.041 -178.769 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.411 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 38.9 m80 -121.01 119.86 33.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.587 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.43 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.43 142.85 28.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.803 -179.905 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.524 ' CG2' ' CD2' ' A' ' 87' ' ' HIS . 1.1 t -131.54 140.22 48.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.49 -179.437 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.416 ' O ' HG12 ' A' ' 45' ' ' ILE . 49.9 t -103.79 96.43 4.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 177.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.782 HD11 HD22 ' A' ' 104' ' ' LEU . 0.8 OUTLIER -41.94 -24.77 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.931 -178.819 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.439 ' OG ' ' HB3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -74.54 -49.09 23.3 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.535 -0.542 . . . . 0.0 109.535 179.218 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 46.6 p -64.64 -27.82 69.19 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.878 HD12 ' HB3' ' A' ' 62' ' ' LEU . 43.2 mm -56.66 106.92 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.623 178.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.424 ' N ' ' O ' ' A' ' 63' ' ' ILE . 19.5 t70 -52.56 -30.88 33.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.119 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.436 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 11.0 pttt -172.49 163.8 5.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.97 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.993 HD11 HD13 ' A' ' 104' ' ' LEU . 21.2 tp -108.95 116.68 32.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.56 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -110.92 144.14 40.46 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.61 0.243 . . . . 0.0 110.439 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.642 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.09 148.9 22.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.619 0.247 . . . . 0.0 111.277 -179.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.623 HG23 ' HB2' ' A' ' 59' ' ' MET . 19.6 p . . . . . 0 C--N 1.331 -0.216 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.888 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.402 ' HG2' ' CA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.805 0.336 . . . . 0.0 110.875 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.623 ' HB2' HG23 ' A' ' 51' ' ' THR . 1.8 mpp? -144.58 138.49 27.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.286 -179.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.642 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 15.2 mt -118.71 140.37 50.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.313 178.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.403 ' HD3' ' CB ' ' A' ' 88' ' ' MET . 25.5 ttp180 -141.33 150.42 42.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.076 0.465 . . . . 0.0 112.017 -179.106 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.878 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -128.41 114.13 16.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.836 178.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.488 ' HA ' ' HB3' ' A' ' 86' ' ' ARG . 6.7 mm -76.77 156.52 5.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.659 0.266 . . . . 0.0 111.043 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.509 -179.886 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.482 HG22 ' N ' ' A' ' 67' ' ' ASP . 13.3 p . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.862 0.363 . . . . 0.0 111.312 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.482 ' N ' HG22 ' A' ' 66' ' ' VAL . 19.7 p-10 -100.39 43.94 1.04 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.798 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.95 -12.07 61.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.308 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -55.0 -24.36 23.88 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.937 0.399 . . . . 0.0 111.115 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.6 mmmt -74.98 -69.36 0.47 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.687 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 42.97 82.31 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.241 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.402 ' HD3' ' C ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -129.33 168.01 16.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.277 -179.925 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 18.0 mmtp -80.45 -166.91 1.17 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.699 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -109.42 -48.65 3.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.057 0.456 . . . . 0.0 110.931 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 168.87 -31.46 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.089 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -100.13 -16.57 17.78 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.324 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 135.54 -7.05 4.25 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.95 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -57.61 -166.11 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.734 0.302 . . . . 0.0 110.904 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -146.39 131.11 17.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.743 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.4 t -95.08 -66.51 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.5 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.444 ' O ' HG13 ' A' ' 81' ' ' VAL . 4.4 p 34.53 81.24 0.24 Allowed Pre-proline 0 CA--C 1.53 0.199 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.684 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_exo -42.11 128.25 4.16 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.954 2.436 . . . . 0.0 112.823 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.0 159.07 85.68 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.949 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo . . . . . 0 N--CA 1.461 -0.44 0 C-N-CA 123.492 2.795 . . . . 0.0 112.488 -179.125 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.488 ' HB3' ' HA ' ' A' ' 63' ' ' ILE . 23.2 ptt-85 . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.579 0.228 . . . . 0.0 110.798 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.524 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 5.1 m-70 -99.74 111.01 23.37 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.403 ' CB ' ' HD3' ' A' ' 61' ' ' ARG . 15.4 ttt -94.19 136.31 34.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.071 0.462 . . . . 0.0 111.818 -179.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.94 ' CD2' HD11 ' A' ' 16' ' ' ILE . 19.3 m-85 -133.51 116.69 16.27 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.365 179.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.422 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.8 OUTLIER -87.1 115.94 24.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.968 0.413 . . . . 0.0 110.793 -179.959 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.47 ' CE2' HG13 ' A' ' 100' ' ' ILE . 8.6 m-85 -91.1 137.54 32.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.592 -179.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -101.62 29.4 4.9 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.532 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.463 ' CB ' HG23 ' A' ' 96' ' ' VAL . 4.9 m-20 -175.97 119.95 0.16 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.432 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.474 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 10.7 ttp85 -60.98 -15.06 27.26 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.718 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -75.67 -47.57 25.71 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.954 0.407 . . . . 0.0 110.387 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.463 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -66.91 -42.86 89.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.722 179.286 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.474 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -65.76 -36.95 85.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.953 179.415 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.412 ' N ' ' HG3' ' A' ' 97' ' ' MET . 6.4 m-20 -65.25 -27.24 68.51 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.269 179.047 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.452 ' O ' ' HG2' ' A' ' 102' ' ' MET . 66.9 m-20 -81.74 -52.49 7.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.599 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.835 HG22 HD11 ' A' ' 104' ' ' LEU . 12.6 mm -63.16 -59.3 4.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.094 0.473 . . . . 0.0 110.488 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.52 ' HA ' HD12 ' A' ' 104' ' ' LEU . 6.4 ttmt -47.33 -36.31 9.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.415 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.452 ' HG2' ' O ' ' A' ' 99' ' ' ASN . 7.7 ptp -83.47 -37.78 22.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.726 -179.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.958 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -70.9 -27.68 63.97 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.181 -178.954 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.993 HD13 HD11 ' A' ' 48' ' ' LEU . 5.4 mt -71.22 -43.34 67.53 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.41 ' HA ' HG13 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -62.97 -50.39 70.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.243 -0.889 . . . . 0.0 112.449 -179.448 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.49 ' HG3' ' O ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -49.29 -30.29 7.17 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.072 0.463 . . . . 0.0 110.656 -179.295 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.02 HG22 ' HE1' ' A' ' 111' ' ' TYR . 9.0 mt -85.03 -52.72 12.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.412 179.314 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.674 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.39 -56.75 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.298 179.396 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -46.88 -28.15 1.49 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.295 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.542 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.0 OUTLIER -73.46 -25.01 60.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.177 179.73 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 1.02 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -74.04 -35.22 64.32 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 179.576 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.751 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.28 -42.89 18.23 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 179.019 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -61.54 -32.03 72.08 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.014 -1.448 . . . . 0.0 108.957 178.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.444 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.449 -0.483 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.752 178.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.662 ' HA ' HG21 ' A' ' 103' ' ' THR . 1.6 t-160 . . . . . 0 CA--C 1.528 0.099 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.462 ' C ' HD11 ' A' ' 100' ' ' ILE . 0.5 OUTLIER -137.99 161.7 36.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.023 0.44 . . . . 0.0 110.875 179.881 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.531 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 171.54 138.76 2.61 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 111.168 -0.773 . . . . 0.0 111.168 -179.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.556 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -84.13 140.95 31.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.075 0.464 . . . . 0.0 112.228 -178.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.563 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -149.65 171.25 16.97 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.254 -179.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.661 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.93 125.12 56.12 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.707 -179.667 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.476 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.5 t80 -125.28 109.49 12.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.912 0.387 . . . . 0.0 111.12 178.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 47.1 mt-10 67.51 49.15 1.03 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.9 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 mmmt 71.76 -4.88 1.8 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.225 -0.443 . . . . 0.0 112.17 179.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.462 ' O ' HG23 ' A' ' 8' ' ' ILE . 17.1 t -100.91 148.72 6.75 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.458 0 CA-C-O 121.087 0.47 . . . . 0.0 110.526 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.459 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -111.6 113.09 25.27 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.898 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.877 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.4 -133.29 3.47 Favored Glycine 0 N--CA 1.445 -0.713 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.03 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.877 HD13 ' O ' ' A' ' 14' ' ' GLY . 19.4 mm -136.31 135.9 49.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 120.648 0.261 . . . . 0.0 111.297 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.879 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.81 140.8 18.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 106.452 -1.684 . . . . 0.0 106.452 176.637 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.447 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.32 117.17 5.49 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 121.687 0.756 . . . . 0.0 111.244 -178.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.825 HD13 ' HB ' ' A' ' 103' ' ' THR . 7.5 mt -81.73 143.22 12.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 114.481 -1.236 . . . . 0.0 112.578 -178.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -126.17 111.71 14.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.245 179.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.451 ' HG2' ' NE2' ' A' ' 3' ' ' HIS . 0.0 OUTLIER -100.41 -2.58 33.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.261 -179.541 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.87 -4.87 40.48 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.985 0.421 . . . . 0.0 110.241 178.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.437 HG21 ' CG ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -92.29 -159.7 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.176 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.427 179.784 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.428 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 33.4 p -179.27 99.29 0.2 Allowed Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.545 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.451 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 10.6 Cg_exo -71.04 164.97 81.54 Favored 'Cis proline' 0 C--N 1.347 0.471 0 C-N-CA 123.697 -1.376 . . . . 0.0 112.625 0.322 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.439 ' CB ' HG21 ' A' ' 107' ' ' ILE . . . -56.14 176.15 0.08 Allowed 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.562 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.518 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.84 139.6 6.41 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.017 178.97 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.777 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.4 OUTLIER -107.71 146.37 32.19 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 178.722 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.69 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.0 OUTLIER -128.49 112.93 14.87 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -178.201 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.535 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 78.5 t90 -92.13 110.63 22.01 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.488 ' O ' ' N ' ' A' ' 15' ' ' ILE . 18.9 ttm180 -110.6 131.55 54.95 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.67 0.271 . . . . 0.0 110.934 -179.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.3 m -49.97 159.33 0.42 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.489 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.415 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 42.5 m -74.91 -37.1 62.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.358 0.599 . . . . 0.0 109.737 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -84.91 -15.96 42.76 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.184 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.94 34.28 11.23 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.311 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -85.26 -26.22 26.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.722 0.296 . . . . 0.0 111.386 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.43 164.79 3.18 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.24 0.543 . . . . 0.0 111.546 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.69 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.35 146.89 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.051 -178.822 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.419 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 35.3 m80 -121.04 120.33 35.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.614 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.62 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.42 138.8 33.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.691 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.572 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -125.32 140.43 48.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.458 -179.623 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.538 ' CG1' HG23 ' A' ' 44' ' ' THR . 44.1 t -104.08 94.42 3.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 177.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.665 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.6 OUTLIER -42.1 -24.8 0.05 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.088 -0.506 . . . . 0.0 112.031 -178.864 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.451 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 1.2 t -76.02 -48.62 20.28 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.538 HG23 ' CG1' ' A' ' 41' ' ' VAL . 30.0 p -64.58 -27.88 69.25 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 178.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.86 HD12 ' HB3' ' A' ' 62' ' ' LEU . 44.8 mm -56.54 109.12 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.536 178.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 63' ' ' ILE . 24.3 t0 -53.22 -31.84 45.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.829 0.347 . . . . 0.0 110.933 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.414 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 11.2 pttt -172.66 164.65 5.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.836 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 1.054 HD11 HD13 ' A' ' 104' ' ' LEU . 8.2 tp -108.88 116.36 31.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.611 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -110.04 144.86 38.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.638 0.256 . . . . 0.0 110.542 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.656 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -156.98 145.74 19.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.634 0.254 . . . . 0.0 111.082 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.533 HG23 ' HB2' ' A' ' 59' ' ' MET . 54.5 p . . . . . 0 C--N 1.332 -0.193 0 CA-C-O 120.724 0.297 . . . . 0.0 110.978 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.2 mpp? . . . . . 0 C--O 1.23 0.057 0 CA-C-O 120.819 0.342 . . . . 0.0 110.771 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.533 ' HB2' HG23 ' A' ' 51' ' ' THR . 29.8 mtm -149.5 142.31 24.67 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.637 -179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.656 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 18.7 mt -119.47 143.37 47.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.065 178.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.421 ' HG3' ' O ' ' A' ' 87' ' ' HIS . 24.3 ttp180 -143.59 150.58 39.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.968 0.413 . . . . 0.0 111.699 -179.049 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.86 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.7 mp -128.02 115.18 18.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.776 178.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.458 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 6.4 mm -76.53 156.44 5.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.661 0.267 . . . . 0.0 110.89 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.356 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.484 -179.799 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.509 HG22 ' N ' ' A' ' 67' ' ' ASP . 14.6 p . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.962 0.411 . . . . 0.0 111.313 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.509 ' N ' HG22 ' A' ' 66' ' ' VAL . 21.0 p-10 -108.01 55.62 0.64 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.877 -0.602 . . . . 0.0 109.857 179.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.95 41.45 1.0 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.371 -179.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 32.8 t -110.52 -19.68 12.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.082 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.9 mmtp -81.54 -55.43 4.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.857 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.477 ' HA ' HG23 ' A' ' 81' ' ' VAL . 0.6 OUTLIER 61.34 93.07 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.899 179.974 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -95.37 -173.71 2.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.918 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.432 ' CA ' HG23 ' A' ' 80' ' ' VAL . 0.0 OUTLIER -128.0 -176.63 3.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.712 179.779 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -106.09 -39.58 5.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.988 0.423 . . . . 0.0 110.81 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 165.14 -30.14 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.821 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -108.56 40.11 1.85 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.032 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 69.35 11.4 64.53 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.47 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.408 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 0.6 OUTLIER -56.6 -165.69 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.108 0 CA-C-O 120.692 0.282 . . . . 0.0 110.84 179.893 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -135.54 120.88 19.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.858 0.361 . . . . 0.0 111.016 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.432 HG23 ' CA ' ' A' ' 73' ' ' LYS . 63.0 t -91.99 -63.52 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.494 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.661 ' O ' HG12 ' A' ' 81' ' ' VAL . 0.9 OUTLIER 40.7 94.21 0.05 OUTLIER Pre-proline 0 CA--C 1.535 0.38 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.093 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -50.66 134.11 39.8 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.515 2.144 . . . . 0.0 112.478 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.73 161.53 73.93 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.915 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo . . . . . 0 N--CA 1.461 -0.426 0 C-N-CA 123.563 2.842 . . . . 0.0 112.278 -179.182 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.701 0.286 . . . . 0.0 110.761 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.506 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 4.3 m-70 -100.73 111.34 23.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.834 0.349 . . . . 0.0 110.262 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.3 142.14 27.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.149 0.5 . . . . 0.0 111.406 -179.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.879 ' CD2' HD11 ' A' ' 16' ' ' ILE . 61.0 m-85 -139.86 116.83 11.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.574 179.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -91.22 115.16 27.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.926 0.393 . . . . 0.0 110.596 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.458 ' CE2' HG13 ' A' ' 100' ' ' ILE . 8.7 m-85 -91.05 136.85 32.8 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.533 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 20.2 m-20 -100.24 29.52 4.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.424 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.46 ' CB ' HG23 ' A' ' 96' ' ' VAL . 5.2 m-20 -175.58 116.74 0.15 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.541 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.481 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -57.2 -16.48 8.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.957 179.803 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.43 -49.75 21.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.852 0.358 . . . . 0.0 110.265 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.46 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -65.82 -41.52 90.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.637 179.26 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.481 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -66.67 -37.94 85.8 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.955 179.472 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.429 ' N ' ' HG3' ' A' ' 97' ' ' MET . 20.1 m-20 -66.67 -24.64 66.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.112 0.482 . . . . 0.0 109.921 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -81.71 -63.24 1.43 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.358 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.761 HG22 HD11 ' A' ' 104' ' ' LEU . 14.3 mm -53.48 -53.85 22.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.579 179.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.454 ' HA ' HD12 ' A' ' 104' ' ' LEU . 0.2 OUTLIER -51.4 -29.55 16.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.924 179.908 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 5.1 mtm -83.08 -48.11 10.94 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.132 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.825 ' HB ' HD13 ' A' ' 18' ' ' ILE . 0.2 OUTLIER -53.38 -58.11 8.27 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.109 179.554 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 1.054 HD13 HD11 ' A' ' 48' ' ' LEU . 3.9 mt -46.34 -53.34 11.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.192 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.33 -45.58 87.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.167 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.438 ' HG2' HG13 ' A' ' 107' ' ' ILE . 0.5 OUTLIER -51.34 -32.95 27.4 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.048 0.452 . . . . 0.0 110.287 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.029 HG22 ' HE1' ' A' ' 111' ' ' TYR . 10.3 mt -85.82 -52.11 12.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.51 179.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.695 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.14 -57.22 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.56 179.623 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.25 -27.05 1.37 Allowed 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.597 -0.728 . . . . 0.0 111.067 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.439 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 27.1 mtt180 -73.25 -25.08 60.57 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.359 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 1.029 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -75.68 -34.15 60.42 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.734 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.762 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.66 -43.35 17.02 Favored 'General case' 0 CA--C 1.507 -0.7 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.945 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -61.44 -32.07 72.03 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 113.858 -1.519 . . . . 0.0 108.987 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.439 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.454 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.666 178.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 29.6 m170 . . . . . 0 CA--C 1.529 0.148 0 N-CA-C 111.456 0.169 . . . . 0.0 111.456 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.558 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 2.6 p -154.0 150.41 28.24 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.303 0.573 . . . . 0.0 111.335 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.471 ' O ' ' HB ' ' A' ' 16' ' ' ILE . . . 178.64 138.68 3.25 Favored Glycine 0 N--CA 1.448 -0.511 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 -179.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.58 145.74 29.55 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.556 ' C ' HD13 ' A' ' 8' ' ' ILE . . . -154.41 171.38 19.43 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.337 -179.11 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.666 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.63 122.58 55.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.82 -179.466 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.454 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.6 t80 -123.1 109.35 13.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.949 0.404 . . . . 0.0 111.237 178.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.426 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 24.8 mt-10 68.11 49.07 0.89 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.812 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 13.1 mttm 71.5 -3.82 2.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.237 -0.438 . . . . 0.0 112.137 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.436 ' O ' HG23 ' A' ' 8' ' ' ILE . 18.2 t -101.68 148.5 7.37 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.55 0 CA-C-O 121.123 0.487 . . . . 0.0 110.587 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.456 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -110.7 112.89 25.08 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.806 179.865 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.888 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.5 -135.12 3.69 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.006 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.888 HD13 ' O ' ' A' ' 14' ' ' GLY . 18.2 mm -135.87 134.93 51.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.543 0 CA-C-O 120.608 0.242 . . . . 0.0 111.435 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.897 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.43 141.71 16.85 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.649 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 176.388 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.558 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -150.87 118.62 6.15 Favored 'General case' 0 C--N 1.31 -1.117 0 C-N-CA 119.64 -0.824 . . . . 0.0 111.542 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.764 HD13 ' HB ' ' A' ' 103' ' ' THR . 11.0 mt -86.71 142.02 13.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 114.697 -1.138 . . . . 0.0 111.887 -178.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.626 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.8 t30 -118.97 93.1 3.98 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.316 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -80.79 0.02 36.64 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.33 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -82.66 0.6 42.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.624 0.249 . . . . 0.0 111.304 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.626 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.04 -162.76 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.807 0.337 . . . . 0.0 110.832 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.4 t -175.97 101.75 0.25 Allowed Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.339 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.446 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 11.0 Cg_exo -69.95 161.46 86.7 Favored 'Cis proline' 0 C--N 1.347 0.483 0 C-N-CA 123.597 -1.418 . . . . 0.0 112.619 0.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.647 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -54.76 178.49 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.3 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.457 ' CG ' HG21 ' A' ' 22' ' ' VAL . 2.5 pp20? -163.67 133.92 4.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.331 179.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.853 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.92 144.5 35.09 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 178.706 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.722 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.3 m -131.48 113.64 13.93 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.702 0.631 . . . . 0.0 112.702 -178.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.553 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 78.8 t90 -92.06 110.43 21.8 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 178.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.462 ' O ' ' N ' ' A' ' 15' ' ' ILE . 22.4 ttt-85 -110.2 131.11 55.35 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.674 0.274 . . . . 0.0 110.822 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.1 m -49.91 158.22 0.53 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.626 0.25 . . . . 0.0 110.493 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.416 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 44.7 m -74.1 -37.0 64.29 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.421 0.629 . . . . 0.0 109.751 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.48 -16.25 43.14 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.021 -0.991 . . . . 0.0 111.087 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.66 34.42 11.59 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.302 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -85.88 -25.76 26.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.688 0.28 . . . . 0.0 111.425 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.68 164.18 2.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.314 0.578 . . . . 0.0 111.35 -179.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.722 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.65 147.91 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.048 -178.767 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 50.0 m-70 -122.09 119.19 30.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.734 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.428 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.49 141.2 30.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.831 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.552 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -127.5 141.01 47.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.449 -179.511 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.449 ' O ' HG12 ' A' ' 45' ' ' ILE . 21.1 t -103.89 93.54 2.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 178.138 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.713 HD11 HD22 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -41.23 -25.12 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.09 -0.504 . . . . 0.0 112.11 -178.827 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.446 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER -74.66 -49.79 20.11 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 179.175 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.408 HG23 ' HB ' ' A' ' 41' ' ' VAL . 30.0 p -64.66 -27.51 68.98 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.9 HD12 ' HB3' ' A' ' 62' ' ' LEU . 34.5 mm -56.6 109.24 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.661 179.044 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.414 ' N ' ' O ' ' A' ' 63' ' ' ILE . 12.6 t70 -51.76 -34.01 37.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.137 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.43 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 0.7 OUTLIER -169.64 165.41 10.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.089 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.763 HD11 HD13 ' A' ' 104' ' ' LEU . 45.1 tp -108.77 118.3 36.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.499 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.412 ' HB3' ' HB3' ' A' ' 61' ' ' ARG . 4.4 tt0 -115.76 147.22 41.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.602 0.239 . . . . 0.0 110.512 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.664 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.14 137.2 12.62 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.148 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.422 HG23 ' HB2' ' A' ' 59' ' ' MET . 42.8 p . . . . . 0 CA--C 1.53 0.207 0 CA-C-O 120.58 0.229 . . . . 0.0 110.865 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.427 ' HB2' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.645 0.26 . . . . 0.0 110.632 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.435 ' O ' HD23 ' A' ' 60' ' ' LEU . 35.2 mtm -149.65 155.51 40.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.132 0.491 . . . . 0.0 111.983 -179.365 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.664 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 28.6 mt -123.38 149.76 44.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.165 178.419 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.412 ' HB3' ' HB3' ' A' ' 49' ' ' GLN . 28.4 ttp180 -146.18 150.87 36.67 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.916 0.389 . . . . 0.0 112.029 -179.131 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.9 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.3 mp -128.34 116.87 20.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.175 178.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.8 HD12 ' HD3' ' A' ' 86' ' ' ARG . 22.6 mm -76.64 156.47 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.683 0.277 . . . . 0.0 111.011 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.425 ' N ' HG22 ' A' ' 63' ' ' ILE . . . . . . . . 0 N--CA 1.451 -0.354 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.352 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.435 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 10.2 p . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.595 0.236 . . . . 0.0 110.613 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.432 ' N ' HG22 ' A' ' 66' ' ' VAL . 10.9 t0 -128.02 35.75 4.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.757 0.313 . . . . 0.0 111.411 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 40.31 31.87 0.11 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.522 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.8 m -95.32 -26.61 15.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.877 0.37 . . . . 0.0 110.986 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.09 -77.74 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.751 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.6 mtpm? 56.15 89.95 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.002 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.99 123.15 48.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.823 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -75.38 159.93 30.85 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.851 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -97.32 -64.04 1.08 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.085 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -178.05 -34.71 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.172 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -92.0 40.8 1.05 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.115 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 59.43 18.01 42.02 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.777 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -90.97 118.21 30.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.746 0.307 . . . . 0.0 110.836 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -87.57 115.8 25.25 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.822 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 17.4 t -111.79 139.25 37.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.638 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.419 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 35.9 t -96.34 90.12 0.68 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.462 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 81' ' ' VAL . 1.4 Cg_endo -45.44 151.0 1.12 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.861 2.374 . . . . 0.0 112.759 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 18.1 mttt -46.47 166.34 0.17 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.543 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.435 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 7.8 Cg_exo . . . . . 0 N--CA 1.464 -0.22 0 C-N-CA 123.72 2.947 . . . . 0.0 112.294 -179.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.8 ' HD3' HD12 ' A' ' 63' ' ' ILE . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.676 0.274 . . . . 0.0 110.776 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.47 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 5.6 m-70 -102.84 111.26 23.5 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 179.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 2.8 ttt -109.34 131.5 55.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.269 -179.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.897 ' CD2' HD11 ' A' ' 16' ' ' ILE . 0.3 OUTLIER -131.05 117.18 18.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.376 179.684 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.13 114.32 21.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.231 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.508 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 7.8 m-85 -91.17 136.36 33.14 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.945 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 59.3 m-20 -93.52 43.46 1.12 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.789 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.602 ' HB3' HG23 ' A' ' 96' ' ' VAL . 1.8 m-20 175.2 113.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.229 -179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.438 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -56.16 -17.41 7.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.079 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.95 -45.66 56.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.1 0.476 . . . . 0.0 110.171 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.602 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -65.32 -49.57 77.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.396 179.087 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.448 ' O ' HD11 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -62.62 -37.09 84.92 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.727 179.731 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.408 ' HA ' ' HG2' ' A' ' 101' ' ' LYS . 69.1 m-20 -73.35 -31.08 63.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.029 0.442 . . . . 0.0 110.445 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -80.25 -27.92 38.57 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.291 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.536 HG23 HD11 ' A' ' 18' ' ' ILE . 1.6 mm -85.13 -52.82 11.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.699 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.408 ' HG2' ' HA ' ' A' ' 98' ' ' ASP . 8.6 ptpt -48.59 -28.97 3.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.796 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.415 ' HG2' ' N ' ' A' ' 103' ' ' THR . 0.8 OUTLIER -78.11 -39.81 40.19 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.081 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.764 ' HB ' HD13 ' A' ' 18' ' ' ILE . 0.2 OUTLIER -59.05 -61.03 2.94 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.501 179.551 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.763 HD13 HD11 ' A' ' 48' ' ' LEU . 7.3 mt -46.76 -56.09 6.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.715 179.397 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.67 -45.51 77.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.054 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -51.92 -35.36 45.42 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-O 121.168 0.508 . . . . 0.0 110.57 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.042 HG22 ' HE1' ' A' ' 111' ' ' TYR . 11.3 mt -85.75 -51.08 13.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.669 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.678 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -42.25 -57.03 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.585 179.654 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.15 -28.47 1.83 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.261 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.521 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 3.1 mtt180 -72.44 -24.89 61.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.28 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 1.042 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -74.57 -36.11 63.05 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 179.77 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.752 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.46 -43.45 17.24 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 107.875 -1.158 . . . . 0.0 107.875 179.039 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -60.96 -30.35 70.19 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 113.93 -1.486 . . . . 0.0 108.922 178.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.456 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.438 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.594 178.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.427 ' CE1' ' HB2' ' A' ' 20' ' ' GLU . 30.5 m170 . . . . . 0 CA--C 1.528 0.123 0 N-CA-C 111.5 0.185 . . . . 0.0 111.5 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.56 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 2.7 p -151.85 154.69 36.66 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.222 0.534 . . . . 0.0 111.242 179.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.515 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 172.37 137.98 2.47 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 -179.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.571 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.94 144.34 30.08 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -178.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.673 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . . . -155.38 171.38 19.97 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.062 -179.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.711 HD12 ' HA ' ' A' ' 13' ' ' SER . 4.8 mm -102.16 128.82 54.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.459 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.8 t80 -127.29 109.38 11.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.0 0.429 . . . . 0.0 110.889 177.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 22.4 mt-10 69.0 50.38 0.59 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.747 179.242 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.6 mttt 69.77 -4.76 1.36 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.134 -0.484 . . . . 0.0 112.084 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.531 ' O ' HG23 ' A' ' 8' ' ' ILE . 13.8 t -101.55 144.24 13.39 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.476 0 CA-C-O 121.201 0.524 . . . . 0.0 110.745 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.711 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -99.25 113.83 26.31 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.898 179.957 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -136.04 -168.1 11.42 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.84 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.571 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 14.0 mm -107.59 136.21 43.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.76 0.314 . . . . 0.0 111.285 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.912 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.73 141.37 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 176.808 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.56 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.52 117.25 5.44 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 119.634 -0.827 . . . . 0.0 111.469 -178.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.878 HD11 HG23 ' A' ' 100' ' ' ILE . 5.3 mt -85.63 142.75 12.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.629 -178.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.64 ' O ' HG23 ' A' ' 22' ' ' VAL . 2.6 t30 -119.45 96.37 5.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.609 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.558 ' HG3' HD11 ' A' ' 107' ' ' ILE . 1.5 mt-10 -79.86 -0.86 36.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.261 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -81.86 -0.06 41.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.612 0.244 . . . . 0.0 111.387 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.64 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -100.97 -162.45 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.82 0.343 . . . . 0.0 110.74 179.883 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 53.8 p -176.51 100.23 0.24 Allowed Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.37 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.435 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 13.4 Cg_exo -68.91 165.82 73.18 Favored 'Cis proline' 0 C--N 1.346 0.409 0 C-N-CA 123.626 -1.406 . . . . 0.0 112.723 0.36 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.686 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -56.79 178.03 0.07 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.153 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.431 ' HG2' ' HA ' ' A' ' 41' ' ' VAL . 9.1 mt-10 -163.4 133.49 4.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.429 179.458 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.808 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -108.11 140.78 40.8 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.58 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.511 HG22 ' CG2' ' A' ' 37' ' ' VAL . 8.2 m -126.08 112.86 16.34 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -178.314 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.511 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 73.8 t90 -91.98 110.4 21.76 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 15' ' ' ILE . 15.3 ttt180 -107.35 131.03 54.69 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.668 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 27.1 t -49.88 156.21 0.77 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.718 0.294 . . . . 0.0 110.654 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 21.4 m -73.77 -34.35 64.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.223 0.535 . . . . 0.0 109.832 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -87.36 -16.58 34.58 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.187 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.35 33.72 11.39 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.306 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -87.61 -25.83 23.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.694 0.283 . . . . 0.0 111.451 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.53 165.1 3.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.308 0.575 . . . . 0.0 111.537 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.511 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.5 OUTLIER -142.42 155.43 18.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.934 -178.853 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -130.03 119.33 22.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.709 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.48 138.9 33.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.599 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.553 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -126.16 141.12 46.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.5 -179.5 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.527 ' CG1' HG23 ' A' ' 44' ' ' THR . 41.7 t -103.87 94.39 3.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.057 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.749 HD11 HD22 ' A' ' 104' ' ' LEU . 0.5 OUTLIER -41.94 -25.49 0.06 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.836 -179.085 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.435 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -74.88 -49.2 21.24 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 179.236 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.527 HG23 ' CG1' ' A' ' 41' ' ' VAL . 30.3 p -64.7 -27.54 68.98 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.451 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.861 HD12 ' HB3' ' A' ' 62' ' ' LEU . 39.9 mm -56.32 104.44 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.357 178.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' A' ' 63' ' ' ILE . 31.5 t70 -47.98 -31.73 5.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.841 0.353 . . . . 0.0 111.297 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.426 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 1.1 pttt -172.54 162.13 5.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.792 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.979 HD11 HD13 ' A' ' 104' ' ' LEU . 10.6 tp -108.91 122.42 47.18 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.757 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.476 ' OE1' HD11 ' A' ' 63' ' ' ILE . 11.6 mt-30 -119.65 146.31 45.68 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.567 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.683 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.08 138.86 14.21 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.673 -0.239 . . . . 0.0 111.101 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 37.1 p . . . . . 0 C--N 1.332 -0.167 0 CA-C-O 120.643 0.259 . . . . 0.0 110.894 -179.903 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.419 ' HG2' ' N ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.674 0.273 . . . . 0.0 110.75 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 25.1 mtm -149.79 138.38 20.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.073 0.463 . . . . 0.0 112.012 -179.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.683 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 22.3 mt -118.06 145.01 45.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.712 178.272 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.44 ' HG3' ' HA ' ' A' ' 88' ' ' MET . 10.5 ttm-85 -143.43 147.38 34.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.005 0.431 . . . . 0.0 112.131 -179.004 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.861 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.6 mp -128.3 115.05 17.7 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.662 178.436 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.476 HD11 ' OE1' ' A' ' 49' ' ' GLN . 6.8 mm -76.76 156.19 5.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 C-N-CA 121.02 -0.272 . . . . 0.0 111.016 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.242 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.551 -179.782 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.508 HG22 ' N ' ' A' ' 67' ' ' ASP . 15.0 p . . . . . 0 N--CA 1.456 -0.148 0 CA-C-O 121.047 0.451 . . . . 0.0 111.431 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.508 ' N ' HG22 ' A' ' 66' ' ' VAL . 0.5 OUTLIER -109.19 57.22 0.61 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.82 179.076 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -88.25 33.67 0.74 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.555 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 67.8 p -81.88 -19.1 41.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.793 0.33 . . . . 0.0 111.067 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.3 mmtp -79.82 -78.33 0.16 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.855 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.697 ' HG2' HG23 ' A' ' 81' ' ' VAL . 6.2 mttt 58.89 91.84 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.765 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.21 -178.32 7.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.197 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.6 mmtt -82.43 -178.93 7.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.762 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -113.38 -37.34 4.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.032 0.444 . . . . 0.0 111.039 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 168.88 -32.3 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.019 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -105.68 38.56 1.96 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.926 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.26 16.31 57.84 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.651 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 36.2 m-20 -72.9 -166.19 0.28 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.705 0.288 . . . . 0.0 110.742 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -139.19 108.03 5.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.876 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.401 ' O ' ' C ' ' A' ' 81' ' ' VAL . 59.2 t -77.88 -66.05 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.283 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.697 HG23 ' HG2' ' A' ' 71' ' ' LYS . 4.7 p 33.22 83.58 0.2 Allowed Pre-proline 0 CA--C 1.531 0.24 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.674 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -41.32 124.79 2.4 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.947 2.431 . . . . 0.0 112.869 -179.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 10.3 mtmt -78.05 162.33 67.58 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.051 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo . . . . . 0 N--CA 1.46 -0.476 0 C-N-CA 123.629 2.886 . . . . 0.0 112.388 -179.065 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.47 ' HB3' ' HA ' ' A' ' 63' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.527 0.085 0 CA-C-O 120.673 0.273 . . . . 0.0 110.747 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.507 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 10.5 m-70 -96.72 111.66 23.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.335 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.44 ' HA ' ' HG3' ' A' ' 61' ' ' ARG . 6.6 ttt -94.13 124.63 38.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.095 0.474 . . . . 0.0 111.282 -179.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.912 ' CD1' HD11 ' A' ' 16' ' ' ILE . 89.8 m-85 -122.93 116.85 24.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.551 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.523 ' HB3' HG12 ' A' ' 8' ' ' ILE . 0.3 OUTLIER -92.2 114.66 27.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.837 0.351 . . . . 0.0 110.849 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.673 ' CE1' ' HB2' ' A' ' 7' ' ' ALA . 31.1 m-85 -97.34 143.54 27.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.111 0.481 . . . . 0.0 111.399 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 20.1 m-20 -106.57 38.29 2.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.777 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.521 ' CB ' HG23 ' A' ' 96' ' ' VAL . 5.3 m-20 -179.87 122.92 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.991 -179.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.459 ' HA ' ' HG3' ' A' ' 97' ' ' MET . 20.0 tpt85 -65.83 -14.41 61.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.474 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.91 -43.07 56.28 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 121.211 0.529 . . . . 0.0 110.023 179.452 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.521 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -62.6 -51.74 68.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.145 179.059 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.459 ' HG3' ' HA ' ' A' ' 94' ' ' ARG . 0.9 OUTLIER -51.87 -44.87 63.87 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.392 178.656 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.446 ' O ' ' HB2' ' A' ' 102' ' ' MET . 1.2 m-20 -53.41 -29.44 35.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.975 179.03 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.5 m-20 -82.48 -53.83 5.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.125 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.878 HG23 HD11 ' A' ' 18' ' ' ILE . 11.0 mm -70.88 -60.46 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.963 -179.318 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.452 ' HA ' HD12 ' A' ' 104' ' ' LEU . 10.6 ttmt -48.6 -35.38 13.45 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.516 -179.152 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.446 ' HB2' ' O ' ' A' ' 98' ' ' ASP . 33.3 mtm -83.45 -29.62 27.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.715 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.865 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -76.36 -45.35 32.41 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.485 -179.648 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.979 HD13 HD11 ' A' ' 48' ' ' LEU . 5.4 mt -53.53 -53.86 45.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.038 0.447 . . . . 0.0 109.923 179.32 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -56.7 -47.43 79.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.146 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -47.28 -36.01 8.59 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 121.26 0.552 . . . . 0.0 110.37 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.039 HG22 ' HE1' ' A' ' 111' ' ' TYR . 12.3 mt -85.75 -51.81 12.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.143 179.094 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.683 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.4 -59.19 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.34 179.129 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -46.76 -27.38 1.18 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.228 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.459 ' HB3' ' O ' ' A' ' 107' ' ' ILE . 0.0 OUTLIER -73.97 -24.79 59.67 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.88 179.964 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 1.039 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -73.98 -37.08 64.57 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.265 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.726 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -80.23 -43.62 21.12 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 179.14 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -61.4 -30.78 70.77 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.886 -1.507 . . . . 0.0 109.051 178.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.452 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.393 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.631 178.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 25.6 m170 . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.617 0.246 . . . . 0.0 111.11 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.533 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 0.5 OUTLIER -160.09 160.57 33.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.206 0.526 . . . . 0.0 111.282 179.747 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.535 ' HA3' HG12 ' A' ' 96' ' ' VAL . . . 166.73 135.73 1.91 Allowed Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -179.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.577 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -80.32 148.46 30.68 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.568 ' C ' HD13 ' A' ' 8' ' ' ILE . . . -154.52 171.23 19.75 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.462 -179.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.673 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -103.0 120.67 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.582 -179.644 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.477 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 4.5 t80 -119.6 106.67 12.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.899 0.38 . . . . 0.0 111.361 178.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 16.6 mt-10 67.71 49.42 0.96 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.928 179.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.3 mtmt 72.64 -3.56 2.33 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 179.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.451 ' O ' HG23 ' A' ' 8' ' ' ILE . 22.5 t -102.08 151.17 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 CA-C-O 121.066 0.46 . . . . 0.0 110.483 179.61 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.425 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.8 OUTLIER -107.16 114.08 27.92 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.843 179.982 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.458 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -133.55 -158.55 8.72 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.061 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.577 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 17.0 mm -120.21 132.23 70.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.77 0.319 . . . . 0.0 111.38 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.88 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -101.19 114.87 41.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 177.843 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.533 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -124.03 115.79 21.76 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.539 0.685 . . . . 0.0 110.784 -179.248 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.919 HD13 HG22 ' A' ' 103' ' ' THR . 7.8 mt -82.47 142.75 13.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 114.709 -1.132 . . . . 0.0 112.031 -178.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.578 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.4 OUTLIER -118.45 93.12 4.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.201 179.294 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.07 0.5 44.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.414 -179.689 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -83.36 1.46 41.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.35 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.578 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -100.86 -162.46 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.864 0.364 . . . . 0.0 110.972 -179.828 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 94.1 p -176.15 100.36 0.25 Allowed Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.324 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.411 ' HG2' ' CB ' ' A' ' 43' ' ' SER . 14.6 Cg_exo -66.81 165.06 67.43 Favored 'Cis proline' 0 C--N 1.347 0.475 0 C-N-CA 123.644 -1.398 . . . . 0.0 112.474 0.473 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.54 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -57.34 -171.83 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.663 179.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -163.36 141.75 7.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.443 0.64 . . . . 0.0 112.249 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.707 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 3.1 tt -108.17 149.05 29.04 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.984 -1.007 . . . . 0.0 108.574 178.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.47 HG23 HG23 ' A' ' 39' ' ' THR . 1.3 m -146.9 104.19 3.69 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -178.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.495 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 82.2 t90 -92.13 110.59 21.97 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.683 178.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.469 ' O ' ' N ' ' A' ' 15' ' ' ILE . 2.3 ttt180 -108.75 130.33 55.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.852 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.8 m -49.96 154.44 1.11 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.696 0.284 . . . . 0.0 110.607 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 21.6 m -72.94 -34.42 66.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.354 0.597 . . . . 0.0 109.703 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -87.03 -16.9 34.27 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.123 179.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.01 34.08 11.34 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.338 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 57.7 m-20 -89.54 -22.63 22.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.644 0.259 . . . . 0.0 111.542 -179.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.96 162.66 2.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.38 0.61 . . . . 0.0 111.434 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.495 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.61 144.95 20.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.025 -178.871 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.473 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 21.9 m80 -118.92 120.2 36.58 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.613 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.47 HG23 HG23 ' A' ' 28' ' ' THR . 0.3 OUTLIER -96.51 144.43 26.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.724 -179.934 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.707 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.2 t -128.75 138.76 53.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.559 -179.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.428 ' HB ' HG23 ' A' ' 44' ' ' THR . 21.7 t -103.86 94.3 3.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 177.568 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.852 HD11 HD23 ' A' ' 104' ' ' LEU . 0.9 OUTLIER -42.29 -22.88 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.226 -0.443 . . . . 0.0 112.171 -178.744 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.411 ' CB ' ' HG2' ' A' ' 24' ' ' PRO . 0.4 OUTLIER -76.03 -49.93 16.2 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.858 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.428 HG23 ' HB ' ' A' ' 41' ' ' VAL . 29.6 p -65.15 -28.01 69.12 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.369 178.576 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.847 HD12 ' HB3' ' A' ' 62' ' ' LEU . 44.5 mm -56.46 109.92 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.591 179.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -53.76 -37.33 63.29 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.847 0.356 . . . . 0.0 110.835 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.417 ' HG3' HG12 ' A' ' 63' ' ' ILE . 1.3 pttt -167.37 168.57 13.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.834 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.778 HD11 HD13 ' A' ' 104' ' ' LEU . 11.6 tp -109.01 115.62 30.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.706 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.481 ' O ' ' N ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -106.7 141.93 37.16 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 179.728 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.678 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.01 139.2 14.61 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.664 0.269 . . . . 0.0 111.308 -179.712 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.461 HG23 ' HB2' ' A' ' 59' ' ' MET . 71.6 p . . . . . 0 C--N 1.331 -0.203 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.102 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.422 ' HE2' ' CB ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.712 0.291 . . . . 0.0 110.85 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.461 ' HB2' HG23 ' A' ' 51' ' ' THR . 35.2 mtm -149.78 151.66 33.94 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.005 0.431 . . . . 0.0 111.868 -179.446 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.678 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 33.6 mt -123.95 152.46 42.46 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.3 178.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.481 ' N ' ' O ' ' A' ' 49' ' ' GLN . 24.0 ttm180 -151.9 151.56 31.42 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -179.357 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.861 HD21 HD22 ' A' ' 104' ' ' LEU . 1.4 mp -126.65 117.84 23.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.856 178.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.871 HD12 ' HD3' ' A' ' 86' ' ' ARG . 10.6 mm -76.62 156.52 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.765 0.317 . . . . 0.0 111.055 -179.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.293 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.434 179.979 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.514 HG22 ' N ' ' A' ' 67' ' ' ASP . 13.9 p . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.836 0.35 . . . . 0.0 111.097 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.514 ' N ' HG22 ' A' ' 66' ' ' VAL . 9.6 m-20 -114.14 63.44 0.66 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.799 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -63.22 -17.73 62.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.294 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.9 t -58.4 -21.9 52.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.198 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.7 mmmp? -75.46 -68.44 0.56 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.907 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.4 mttt 55.89 89.59 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.966 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.01 -179.93 4.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.908 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 10.7 mttt -133.76 -168.44 2.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.779 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -135.04 -175.39 3.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.858 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -57.58 -22.09 42.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.316 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 -110.0 33.72 4.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.953 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.14 24.52 44.12 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.474 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -62.46 -169.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.848 0.356 . . . . 0.0 110.899 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -135.65 114.99 12.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.638 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 96.3 t -86.89 -60.6 2.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.39 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.446 ' O ' HG13 ' A' ' 81' ' ' VAL . 4.2 p 34.98 88.29 0.1 OUTLIER Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.854 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.42 ' O ' HG21 ' A' ' 66' ' ' VAL . 92.6 Cg_exo -42.12 140.35 2.3 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.94 2.427 . . . . 0.0 112.775 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 46.4 mmtt -93.56 163.87 22.99 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.036 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.449 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.7 Cg_exo . . . . . 0 N--CA 1.461 -0.399 0 C-N-CA 123.602 2.868 . . . . 0.0 112.311 -179.05 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.871 ' HD3' HD12 ' A' ' 63' ' ' ILE . 55.9 mtt180 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.784 0.326 . . . . 0.0 110.721 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.468 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 7.1 m-70 -95.39 111.53 23.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.568 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.404 ' CA ' ' HG3' ' A' ' 61' ' ' ARG . 4.5 ttt -109.19 134.56 51.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.066 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.88 ' CD2' HD11 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -135.08 116.81 15.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.77 179.821 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.69 114.42 23.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.871 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.499 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 7.9 m-85 -91.17 140.92 29.35 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.12 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -97.2 38.54 1.24 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.775 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.655 ' HB3' HG23 ' A' ' 96' ' ' VAL . 1.3 m-20 178.41 116.08 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.553 -179.719 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.427 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -57.49 -18.14 17.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.674 179.584 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.17 -42.22 66.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.177 0.513 . . . . 0.0 110.122 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.655 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -66.26 -53.01 40.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.287 179.012 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.427 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -61.2 -36.8 80.88 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.335 179.309 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.452 ' O ' ' HE2' ' A' ' 102' ' ' MET . 26.8 t70 -67.81 -32.56 73.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.097 0.475 . . . . 0.0 110.181 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 68.1 m-20 -81.63 -33.25 31.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.237 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.69 HG22 HD12 ' A' ' 104' ' ' LEU . 3.2 mm -79.39 -60.09 2.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.616 179.568 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.421 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 5.9 ttmt -49.0 -29.58 5.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.508 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.452 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 31.5 mtm -79.13 -32.02 44.32 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.701 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.919 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -86.51 -22.98 26.08 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 120.983 0.42 . . . . 0.0 110.235 179.623 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.861 HD22 HD21 ' A' ' 62' ' ' LEU . 9.5 mt -73.26 -44.73 58.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.803 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.533 ' HA ' HG13 ' A' ' 108' ' ' ILE . 0.7 OUTLIER -80.63 -33.1 35.99 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -179.431 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.542 ' HG2' ' HA ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -55.71 -36.34 67.09 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 121.309 0.576 . . . . 0.0 110.122 179.832 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.953 HG22 ' HE1' ' A' ' 111' ' ' TYR . 17.7 mt -75.96 -52.05 18.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.441 179.164 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.549 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -43.86 -55.61 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.267 0.556 . . . . 0.0 111.142 179.09 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -46.85 -28.07 1.44 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.237 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.516 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.3 OUTLIER -73.19 -24.76 60.58 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.146 179.751 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.953 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -74.47 -36.53 63.32 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 179.68 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.743 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -80.6 -43.62 20.25 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 179.211 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -61.45 -31.25 71.19 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 113.887 -1.506 . . . . 0.0 108.955 178.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.452 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.454 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.638 178.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.404 ' O ' ' N ' ' A' ' 18' ' ' ILE . 18.8 m80 . . . . . 0 CA--C 1.529 0.155 0 CA-C-O 120.522 0.201 . . . . 0.0 111.45 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.586 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 7.5 p -156.48 151.06 25.7 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.222 0.534 . . . . 0.0 111.209 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.495 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 175.2 140.04 3.24 Favored Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 -179.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.547 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -83.03 136.09 34.62 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -178.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.736 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -144.79 171.24 14.69 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.011 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.656 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.84 127.81 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-O 120.696 0.284 . . . . 0.0 111.664 -179.672 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.496 ' CZ ' ' CD2' ' A' ' 38' ' ' HIS . 6.8 t80 -127.81 110.08 12.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.986 0.422 . . . . 0.0 111.288 178.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 59.7 mt-10 67.75 47.77 1.12 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.988 179.104 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp 72.29 -5.41 1.78 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.152 179.333 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.478 ' O ' HG23 ' A' ' 8' ' ' ILE . 14.3 t -99.75 148.14 6.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 CA-C-O 121.028 0.442 . . . . 0.0 110.424 179.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.442 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -110.47 113.1 25.47 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.023 179.975 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.876 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.67 -134.29 3.57 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.613 -0.722 . . . . 0.0 111.905 179.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.876 HD13 ' O ' ' A' ' 14' ' ' GLY . 17.3 mm -135.82 135.86 50.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.584 0.23 . . . . 0.0 111.405 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.937 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.41 140.52 19.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 106.295 -1.742 . . . . 0.0 106.295 176.61 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.586 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.33 119.07 6.12 Favored 'General case' 0 C--N 1.313 -0.997 0 C-N-CA 119.591 -0.844 . . . . 0.0 111.915 -178.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.715 HD12 ' HB ' ' A' ' 103' ' ' THR . 7.1 mt -82.59 142.82 13.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 114.57 -1.196 . . . . 0.0 112.142 -178.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.616 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -117.32 92.78 3.94 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.822 178.883 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.31 -0.85 42.89 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.348 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -82.7 0.56 42.81 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.132 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.616 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.87 -163.6 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.908 0.385 . . . . 0.0 110.694 179.939 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.426 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 1.8 t -175.08 102.29 0.26 Allowed Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.274 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.426 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 8.5 Cg_exo -70.48 162.41 86.21 Favored 'Cis proline' 0 C--N 1.345 0.38 0 C-N-CA 123.49 -1.462 . . . . 0.0 112.674 0.45 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.549 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -54.3 178.47 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.376 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.559 ' OE1' HG22 ' A' ' 41' ' ' VAL . 20.4 mt-10 -163.12 135.41 5.3 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.011 179.195 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.824 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.79 139.54 42.23 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 178.813 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.706 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.4 m -124.82 113.12 17.5 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -178.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.538 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 78.5 t90 -91.97 110.5 21.86 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 178.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.471 ' O ' ' N ' ' A' ' 15' ' ' ILE . 49.0 ttt180 -110.5 130.93 55.45 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.955 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.0 m -49.84 158.5 0.48 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.492 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.426 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 45.3 m -74.25 -37.05 63.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.371 0.605 . . . . 0.0 109.71 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -84.64 -16.03 43.36 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.992 -1.004 . . . . 0.0 111.114 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.51 34.5 11.79 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.315 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -85.51 -25.92 26.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.753 0.311 . . . . 0.0 111.408 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.5 164.22 3.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.352 0.596 . . . . 0.0 111.441 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.706 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.65 147.94 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.125 -178.793 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.496 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 15.5 m80 -123.16 121.19 35.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.825 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.51 139.98 31.81 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.838 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.576 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -127.07 140.43 49.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.467 -179.627 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.559 HG22 ' OE1' ' A' ' 26' ' ' GLU . 21.9 t -103.83 95.76 4.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 177.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.755 HD11 HD22 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -42.7 -23.78 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.85 -178.994 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.415 ' CB ' ' HG2' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -76.03 -48.81 19.49 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 179.242 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.416 HG23 ' HB ' ' A' ' 41' ' ' VAL . 40.6 p -64.47 -27.19 68.81 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.548 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.81 HD12 ' HB3' ' A' ' 62' ' ' LEU . 47.9 mm -56.36 107.38 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.472 178.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.434 ' N ' ' O ' ' A' ' 63' ' ' ILE . 15.6 t70 -53.25 -28.48 27.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.543 -179.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.441 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 0.0 OUTLIER -172.83 163.46 5.01 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.02 0.438 . . . . 0.0 110.963 179.852 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.792 HD11 HD13 ' A' ' 104' ' ' LEU . 15.0 tp -109.17 122.19 46.76 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.722 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.441 ' HB2' ' HB3' ' A' ' 61' ' ' ARG . 4.2 mt-30 -124.22 146.56 48.64 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-O 120.776 0.322 . . . . 0.0 111.177 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.655 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.16 145.1 19.16 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.61 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.436 ' O ' ' HE1' ' A' ' 97' ' ' MET . 72.4 p . . . . . 0 C--N 1.333 -0.124 0 CA-C-O 120.804 0.335 . . . . 0.0 111.182 -179.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.409 ' HB3' ' HG2' ' A' ' 97' ' ' MET . 3.0 mpp? . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.837 0.351 . . . . 0.0 111.457 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.409 ' HB2' HG23 ' A' ' 51' ' ' THR . 3.0 mpp? -149.79 142.36 24.47 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.589 -179.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.655 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 21.8 mt -116.63 145.64 43.26 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.032 178.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.441 ' HB3' ' HB2' ' A' ' 49' ' ' GLN . 10.2 ttm180 -143.6 148.82 36.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.092 0.472 . . . . 0.0 112.237 -179.098 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.81 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -128.29 115.94 19.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.625 178.276 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.625 HG23 ' HG2' ' A' ' 86' ' ' ARG . 24.8 mm -76.41 156.5 5.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.807 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.421 ' N ' HG22 ' A' ' 63' ' ' ILE . . . . . . . . 0 N--CA 1.45 -0.372 0 C-N-CA 120.734 -0.745 . . . . 0.0 112.631 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.513 HG22 ' N ' ' A' ' 67' ' ' ASP . 14.8 p . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.759 0.314 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.513 ' N ' HG22 ' A' ' 66' ' ' VAL . 2.3 m-20 -112.28 75.87 0.94 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.767 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -62.79 -17.57 61.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.31 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.4 m -57.27 -22.77 43.85 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.144 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.9 mmtm -63.01 -65.38 0.69 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.79 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.7 mttp 58.23 92.25 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.851 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -110.32 166.98 10.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.873 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.2 mttp -133.95 -168.02 2.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.812 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -136.54 -176.69 4.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.879 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 -59.11 -20.86 57.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.326 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -105.86 29.07 6.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.016 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.31 26.08 35.5 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.551 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 26.8 m-20 -65.9 -163.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.699 0.285 . . . . 0.0 110.917 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -137.22 116.81 12.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.662 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.406 ' O ' ' O ' ' A' ' 81' ' ' VAL . 99.3 t -86.63 -60.67 2.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.613 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.63 ' O ' HG12 ' A' ' 81' ' ' VAL . 0.9 OUTLIER 43.6 98.84 0.03 OUTLIER Pre-proline 0 CA--C 1.537 0.452 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.109 179.868 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.478 ' O ' HG21 ' A' ' 66' ' ' VAL . 81.8 Cg_exo -45.01 149.64 1.17 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.591 2.194 . . . . 0.0 112.707 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.1 mtpt -105.14 162.17 20.54 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.953 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.411 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.9 Cg_exo . . . . . 0 N--CA 1.461 -0.393 0 C-N-CA 123.598 2.865 . . . . 0.0 112.269 -179.116 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.625 ' HG2' HG23 ' A' ' 63' ' ' ILE . 14.3 mtt180 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.633 0.254 . . . . 0.0 110.585 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.478 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 27.6 m-70 -97.04 111.37 23.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.802 0.334 . . . . 0.0 110.216 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 3.1 mtp -94.3 126.36 39.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.339 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.937 ' CD1' HD11 ' A' ' 16' ' ' ILE . 88.8 m-85 -130.55 116.57 18.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.508 179.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.437 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -98.18 114.49 26.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.842 0.353 . . . . 0.0 110.661 179.863 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.736 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 43.0 m-85 -94.37 139.64 30.84 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.559 -179.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 -99.19 31.98 2.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.712 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.488 ' HB3' HG23 ' A' ' 96' ' ' VAL . 2.1 m-20 -175.41 113.68 0.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.722 -179.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.465 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 10.1 ttp85 -56.62 -19.28 15.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.784 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.62 -47.77 58.42 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-O 120.851 0.358 . . . . 0.0 110.752 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.488 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -67.0 -45.4 87.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 178.927 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.465 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -63.91 -37.24 86.67 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.755 179.202 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.456 ' N ' ' HG3' ' A' ' 97' ' ' MET . 9.3 m-20 -60.14 -30.18 69.13 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 121.179 0.514 . . . . 0.0 109.948 178.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -81.69 -63.26 1.43 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.169 179.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.663 HG22 HD11 ' A' ' 104' ' ' LEU . 9.0 mm -48.56 -59.89 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.948 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.438 ' HA ' HD12 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -48.54 -30.69 5.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.648 -179.997 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.401 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 17.1 mtm -83.45 -45.68 13.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.405 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.715 ' HB ' HD12 ' A' ' 18' ' ' ILE . 0.3 OUTLIER -57.23 -53.05 62.53 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.756 179.747 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.792 HD13 HD11 ' A' ' 48' ' ' LEU . 6.4 mt -49.87 -53.61 24.67 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.176 0.512 . . . . 0.0 109.924 179.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.697 ' HG2' HD23 ' A' ' 48' ' ' LEU . 59.9 mm-40 -56.45 -47.56 78.87 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.963 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -49.82 -34.51 19.92 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-O 121.112 0.482 . . . . 0.0 110.494 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.027 HG22 ' HE1' ' A' ' 111' ' ' TYR . 3.4 mt -85.71 -51.73 13.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.374 179.337 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.705 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.48 -57.02 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.43 179.266 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.416 ' HA ' ' HG2' ' A' ' 112' ' ' LYS . 35.0 t -47.33 -28.54 2.06 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.209 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.525 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.7 OUTLIER -71.9 -24.99 61.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.12 179.879 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 1.027 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -74.85 -35.04 62.36 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.526 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.764 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.77 -43.02 17.24 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 178.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -61.42 -32.02 71.97 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 113.898 -1.501 . . . . 0.0 108.957 178.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.456 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.428 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.616 178.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.9 m170 . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.602 0.239 . . . . 0.0 111.153 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.532 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 12.5 p -156.66 159.49 38.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.2 0.524 . . . . 0.0 111.107 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.581 ' HA3' HG12 ' A' ' 96' ' ' VAL . . . 168.24 136.49 2.06 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.58 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.5 148.16 28.27 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -178.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.505 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -157.23 171.45 20.4 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.225 -179.076 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.648 HD12 ' HA ' ' A' ' 13' ' ' SER . 4.3 mm -101.7 122.77 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.982 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.492 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 3.7 t80 -118.44 105.27 11.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.951 0.405 . . . . 0.0 111.051 178.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 4.3 mm-40 67.45 54.75 0.67 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.756 179.283 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.1 mttm 70.19 -4.66 1.49 Allowed 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 179.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.515 ' O ' HG23 ' A' ' 8' ' ' ILE . 21.7 t -104.04 146.7 11.17 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.501 0 CA-C-O 121.134 0.492 . . . . 0.0 110.806 179.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.648 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -98.48 114.81 27.33 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.459 179.705 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -133.97 -177.37 14.89 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.365 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.58 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 15.5 mm -105.38 130.5 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-O 120.815 0.341 . . . . 0.0 111.237 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.876 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.4 OUTLIER -101.14 113.63 37.83 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.967 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.532 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -122.47 114.7 21.05 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 121.452 0.644 . . . . 0.0 110.623 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.77 HD13 HG22 ' A' ' 103' ' ' THR . 10.7 mt -82.41 142.82 13.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.906 -178.391 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.595 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -116.94 94.78 4.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.292 179.471 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.31 0.69 40.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.384 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -82.78 0.61 42.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.385 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.595 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -100.93 -161.94 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.884 0.373 . . . . 0.0 110.911 -179.957 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.0 t -178.84 100.57 0.2 Allowed Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.307 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.433 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 16.8 Cg_exo -65.68 160.99 72.8 Favored 'Cis proline' 0 C--N 1.346 0.412 0 C-N-CA 123.526 -1.447 . . . . 0.0 112.585 0.301 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.766 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -55.77 -171.36 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.805 179.428 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -163.3 142.06 8.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.465 0.65 . . . . 0.0 112.193 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.707 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 2.7 tt -108.22 147.61 31.12 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.92 -1.036 . . . . 0.0 108.578 178.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.5 m -143.42 104.29 4.22 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.492 ' CH2' ' HB3' ' A' ' 9' ' ' PHE . 82.3 t90 -92.07 110.59 21.97 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.903 178.678 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -109.39 129.27 55.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.644 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.1 t -49.77 156.68 0.67 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.613 0.244 . . . . 0.0 110.514 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.0 m -72.28 -36.2 68.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.352 0.596 . . . . 0.0 109.75 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -82.27 -18.51 42.16 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.063 179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.58 34.81 15.18 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.435 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -93.03 -21.25 19.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.629 0.252 . . . . 0.0 111.62 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.24 161.24 6.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.341 0.591 . . . . 0.0 111.492 -179.774 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.478 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.64 148.95 16.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.107 -178.873 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.478 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 16.3 m80 -123.3 120.47 33.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.606 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.51 143.14 27.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.948 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.707 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.2 t -127.11 138.81 53.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.479 -179.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.445 ' O ' HG12 ' A' ' 45' ' ' ILE . 21.8 t -104.02 94.15 3.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 177.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.607 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.6 OUTLIER -41.31 -23.47 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.221 -178.698 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.433 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 1.2 t -77.34 -49.07 15.73 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.427 HG23 ' HB ' ' A' ' 41' ' ' VAL . 30.6 p -64.9 -27.73 69.06 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.488 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.886 HD12 ' HB3' ' A' ' 62' ' ' LEU . 40.6 mm -55.99 110.19 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.582 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -57.28 -29.56 63.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.519 -179.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.438 ' CG ' HG13 ' A' ' 63' ' ' ILE . 1.2 pttt -172.47 168.97 5.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.033 0.444 . . . . 0.0 111.09 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.915 HD22 ' NE2' ' A' ' 105' ' ' GLN . 1.1 tp -109.21 117.09 33.21 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.239 -179.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.527 ' O ' ' N ' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -111.17 138.85 47.1 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 179.033 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.674 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -156.84 141.44 16.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.71 0.29 . . . . 0.0 111.129 -179.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.515 HG23 ' HB2' ' A' ' 59' ' ' MET . 43.9 p . . . . . 0 CA--C 1.531 0.215 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.95 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.493 ' HE2' ' HB2' ' A' ' 94' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.815 0.34 . . . . 0.0 110.621 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.515 ' HB2' HG23 ' A' ' 51' ' ' THR . 32.8 mtm -149.59 146.6 27.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.484 -179.401 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.674 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 32.1 mt -121.53 152.73 38.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.793 178.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.527 ' N ' ' O ' ' A' ' 49' ' ' GLN . 6.9 ttm180 -151.78 145.3 24.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.802 -179.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.886 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.2 mp -120.46 118.16 29.55 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 178.281 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.611 HD12 ' HG2' ' A' ' 86' ' ' ARG . 26.8 mm -76.48 156.48 5.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.596 0.236 . . . . 0.0 111.058 -179.581 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.445 ' N ' HG22 ' A' ' 63' ' ' ILE . . . . . . . . 0 N--CA 1.452 -0.298 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.548 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.543 HG11 ' HG3' ' A' ' 84' ' ' PRO . 12.0 p . . . . . 0 N--CA 1.457 -0.113 0 CA-C-O 120.817 0.341 . . . . 0.0 111.074 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.539 ' N ' HG22 ' A' ' 66' ' ' VAL . 3.5 m-20 -132.9 64.39 1.61 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.536 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -65.39 -14.79 61.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.561 -179.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.8 m -108.75 34.95 3.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.709 0.29 . . . . 0.0 110.987 -179.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.9 mmmm -122.97 -65.85 1.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.167 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 32.9 mttt 66.1 96.86 0.05 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.394 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.76 132.56 55.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.181 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.8 mmtp -82.32 159.94 22.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.853 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 51.6 p30 -112.45 -173.48 2.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.893 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -60.05 -20.36 57.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.329 -179.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -101.05 24.13 9.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.126 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.21 21.89 34.4 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.731 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -89.79 117.07 28.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.697 0.284 . . . . 0.0 110.771 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -70.26 108.1 4.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.811 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.412 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 21.3 t -111.03 119.49 59.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.751 -179.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.657 ' O ' HG13 ' A' ' 81' ' ' VAL . 14.6 p -99.72 100.71 11.6 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.86 178.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.412 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 74.7 Cg_exo -38.58 143.66 0.23 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.829 2.353 . . . . 0.0 113.121 -178.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.458 ' CA ' HG23 ' A' ' 66' ' ' VAL . 8.7 pttt -112.06 166.36 11.08 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.997 -179.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.543 ' HG3' HG11 ' A' ' 66' ' ' VAL . 2.6 Cg_exo . . . . . 0 N--CA 1.462 -0.333 0 C-N-CA 123.621 2.881 . . . . 0.0 112.232 -179.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.611 ' HG2' HD12 ' A' ' 63' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.689 0.281 . . . . 0.0 110.835 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.489 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 4.3 m-70 -100.82 111.41 23.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.378 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.419 ' CA ' ' HG3' ' A' ' 61' ' ' ARG . 1.0 OUTLIER -104.88 139.03 40.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.179 -179.622 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.876 ' CD2' HD11 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -140.04 120.33 13.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.977 179.888 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.524 ' HB2' HG12 ' A' ' 8' ' ' ILE . 1.2 m -88.66 114.72 25.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.275 -179.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.505 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 6.8 m-85 -95.2 133.61 38.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.9 0.381 . . . . 0.0 111.094 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 24.3 m-20 -92.55 43.76 1.14 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.706 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.704 ' HB3' HG23 ' A' ' 96' ' ' VAL . 1.1 m-20 174.77 114.49 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.293 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.493 ' HB2' ' HE2' ' A' ' 58' ' ' MET . 0.2 OUTLIER -57.32 -16.95 10.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.933 179.7 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.62 -42.48 64.42 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.18 0.514 . . . . 0.0 109.906 179.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.704 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -65.82 -54.25 29.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.266 178.905 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.43 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -59.35 -35.96 74.84 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.438 179.388 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.569 ' O ' ' HE2' ' A' ' 102' ' ' MET . 29.1 t70 -67.08 -31.72 72.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.066 0.46 . . . . 0.0 110.428 179.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 90.3 m-20 -81.74 -30.03 32.63 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.335 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.666 HG23 HD11 ' A' ' 18' ' ' ILE . 4.5 mm -83.23 -59.97 2.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.817 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.61 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 17.8 ttpp -47.55 -38.3 13.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.644 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.569 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 41.6 mtm -79.94 -25.62 40.4 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.242 -179.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.77 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -80.76 -40.74 24.66 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.126 179.962 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.607 ' CD2' HD11 ' A' ' 42' ' ' LEU . 13.2 mt -57.73 -53.01 63.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.267 -0.424 . . . . 0.0 109.993 179.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.915 ' NE2' HD22 ' A' ' 48' ' ' LEU . 4.6 mm-40 -60.59 -43.66 97.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.433 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -47.18 -36.44 8.7 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 121.22 0.533 . . . . 0.0 110.512 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.037 HG22 ' HE1' ' A' ' 111' ' ' TYR . 14.4 mt -85.88 -51.59 13.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.512 179.193 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.673 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.21 -60.49 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.681 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.425 ' HA ' ' HG2' ' A' ' 112' ' ' LYS . 6.6 t -46.96 -25.87 0.88 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.25 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.459 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 15.7 mtt180 -72.26 -25.07 61.47 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.942 179.5 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 1.037 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -75.38 -36.7 60.87 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 179.698 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.737 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.59 -42.87 19.46 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.988 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -61.39 -30.24 70.42 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.007 -1.451 . . . . 0.0 108.967 177.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.459 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.456 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.54 178.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.419 ' CE1' ' HB2' ' A' ' 20' ' ' GLU . 25.2 m170 . . . . . 0 CA--C 1.529 0.158 0 CA-C-O 120.584 0.23 . . . . 0.0 111.119 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.56 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 8.9 p -156.33 142.31 18.05 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.139 0.495 . . . . 0.0 111.228 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.47 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -175.45 140.27 5.13 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 110.746 -0.942 . . . . 0.0 110.746 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.549 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -81.94 139.73 34.44 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.602 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -148.92 171.23 16.66 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.043 -179.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.647 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.96 128.72 55.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-O 120.827 0.346 . . . . 0.0 111.791 -179.55 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.491 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 7.1 t80 -129.19 110.62 12.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.111 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.431 ' HG2' ' CE1' ' A' ' 9' ' ' PHE . 5.6 mm-40 67.41 47.69 1.23 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.947 179.014 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.2 mmtm 72.25 -5.95 1.66 Allowed 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.466 ' O ' HG23 ' A' ' 8' ' ' ILE . 14.4 t -99.23 148.52 6.2 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 CA-C-O 121.034 0.445 . . . . 0.0 110.474 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.455 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -111.34 113.86 26.62 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.084 -179.924 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.874 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -132.31 -133.91 3.48 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.877 -0.678 . . . . 0.0 112.112 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.874 HD13 ' O ' ' A' ' 14' ' ' GLY . 17.5 mm -136.13 135.27 50.18 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.491 0 CA-C-O 120.81 0.338 . . . . 0.0 111.322 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.91 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.32 139.99 20.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 176.669 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.56 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -150.1 118.56 6.47 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 119.489 -0.884 . . . . 0.0 111.68 -178.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.586 HD12 ' HB ' ' A' ' 103' ' ' THR . 11.3 mt -81.57 142.92 13.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 114.469 -1.242 . . . . 0.0 112.053 -178.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.624 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -119.98 92.59 3.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.045 179.052 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.419 ' HB2' ' CE1' ' A' ' 3' ' ' HIS . 1.2 tt0 -82.46 -0.39 46.12 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.33 -179.645 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -83.08 1.31 40.83 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.336 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.624 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -102.58 -162.72 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.842 0.354 . . . . 0.0 110.819 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 8.3 p -174.28 101.08 0.29 Allowed Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.366 179.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.45 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 58.4 Cg_endo -71.84 165.56 81.51 Favored 'Cis proline' 0 C--N 1.346 0.41 0 C-N-CA 123.518 -1.451 . . . . 0.0 112.765 0.466 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.32 175.72 0.21 Allowed 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.549 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.497 ' HG2' HG21 ' A' ' 22' ' ' VAL . 6.6 pt-20 -163.71 138.71 6.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.112 179.179 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.81 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.72 143.92 35.55 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.861 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.724 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.2 m -127.52 113.55 16.28 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -178.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.534 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 77.9 t90 -92.0 110.33 21.69 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.73 130.97 55.43 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.68 0.276 . . . . 0.0 110.905 -179.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.3 t -49.84 158.52 0.48 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.561 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.415 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 48.1 m -73.76 -37.34 65.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.483 0.658 . . . . 0.0 109.69 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -84.2 -16.32 43.81 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.001 -1.0 . . . . 0.0 111.18 179.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.49 34.54 11.74 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.308 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -85.54 -25.61 26.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.677 0.275 . . . . 0.0 111.379 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.73 163.94 2.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.213 0.53 . . . . 0.0 111.423 -179.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.724 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.68 146.16 19.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.196 -178.729 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.464 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 37.4 m80 -119.84 120.75 37.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.664 179.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.496 HG23 HG23 ' A' ' 28' ' ' THR . 0.3 OUTLIER -96.53 137.42 35.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.063 -179.76 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.562 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.1 t -126.53 139.31 52.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.221 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.467 ' CG1' HG23 ' A' ' 44' ' ' THR . 47.0 t -103.96 95.98 4.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 177.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.731 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.9 OUTLIER -41.16 -25.52 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.12 -178.919 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.45 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 2.0 t -76.14 -48.51 20.33 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.465 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.467 HG23 ' CG1' ' A' ' 41' ' ' VAL . 30.9 p -64.69 -27.86 69.2 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 178.449 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.849 HD12 ' HB3' ' A' ' 62' ' ' LEU . 42.0 mm -56.48 107.14 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.512 178.619 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.407 ' N ' ' O ' ' A' ' 63' ' ' ILE . 8.2 t70 -47.89 -33.98 8.3 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.926 0.393 . . . . 0.0 111.011 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.431 ' HG3' HG12 ' A' ' 63' ' ' ILE . 1.8 pttt -172.44 164.02 5.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.72 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 1.034 HD11 HD13 ' A' ' 104' ' ' LEU . 15.1 tp -108.65 123.29 48.74 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.61 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -119.53 148.56 43.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.537 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.674 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.1 148.37 22.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.573 0.225 . . . . 0.0 111.043 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.568 HG23 ' HB2' ' A' ' 59' ' ' MET . 35.7 p . . . . . 0 C--N 1.332 -0.18 0 CA-C-O 120.626 0.25 . . . . 0.0 110.985 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.401 ' HG2' ' CA ' ' A' ' 94' ' ' ARG . 2.1 mpp? . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.671 0.272 . . . . 0.0 110.855 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.568 ' HB2' HG23 ' A' ' 51' ' ' THR . 31.9 mtm -149.7 143.19 25.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.632 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.674 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 25.4 mt -120.48 145.55 47.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.096 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.434 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 14.7 ttm-85 -141.9 151.3 42.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.949 0.404 . . . . 0.0 111.857 -179.058 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.849 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -128.19 117.42 21.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.817 178.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.611 HD12 ' HG2' ' A' ' 86' ' ' ARG . 17.3 mm -76.6 156.52 5.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.792 0.329 . . . . 0.0 111.279 -179.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.416 ' N ' HG22 ' A' ' 63' ' ' ILE . . . . . . . . 0 N--CA 1.452 -0.284 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.447 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.458 HG22 ' N ' ' A' ' 67' ' ' ASP . 7.6 p . . . . . 0 N--CA 1.455 -0.198 0 CA-C-O 120.794 0.331 . . . . 0.0 111.313 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.458 ' N ' HG22 ' A' ' 66' ' ' VAL . 2.4 t0 -113.04 39.57 2.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.807 179.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.59 -21.91 65.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.187 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.2 m -80.02 -21.07 43.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.208 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.4 mmtp -79.63 -68.37 0.67 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.9 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.3 mtpt 60.04 89.25 0.07 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.818 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.28 -176.51 3.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.923 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 11.1 mttt -134.38 -167.74 2.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.674 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -135.91 -179.21 5.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.91 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -56.93 -22.32 36.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.347 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.73 33.49 4.04 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.989 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 55.5 26.17 44.35 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.51 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -66.8 -169.51 0.08 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.816 0.341 . . . . 0.0 111.001 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -135.58 119.39 17.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.568 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.2 t -89.28 -63.92 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.424 -179.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.446 ' O ' HG13 ' A' ' 81' ' ' VAL . 4.8 p 34.21 80.41 0.26 Allowed Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.849 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -45.51 124.69 6.85 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.848 2.365 . . . . 0.0 112.592 -179.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.425 ' O ' HG23 ' A' ' 66' ' ' VAL . 0.2 OUTLIER -72.09 161.62 77.9 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.018 179.976 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.409 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.5 Cg_exo . . . . . 0 N--CA 1.459 -0.519 0 C-N-CA 123.645 2.897 . . . . 0.0 112.42 -179.036 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.611 ' HG2' HD12 ' A' ' 63' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.634 0.255 . . . . 0.0 110.568 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.479 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 17.3 m-70 -99.02 111.37 23.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.732 0.301 . . . . 0.0 110.372 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.81 121.04 35.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.008 0.432 . . . . 0.0 111.199 -179.532 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.91 ' CD1' HD11 ' A' ' 16' ' ' ILE . 92.9 m-85 -122.9 116.73 24.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.467 179.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.412 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -97.11 114.55 26.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.846 -179.937 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.602 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 17.0 m-85 -94.66 137.14 34.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.182 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 24.6 m-20 -97.08 39.26 1.19 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.823 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.497 ' CB ' HG23 ' A' ' 96' ' ' VAL . 5.4 m-20 179.59 111.17 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.553 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.428 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.3 OUTLIER -53.41 -21.67 6.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.781 179.795 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.79 -47.3 66.49 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-O 120.891 0.377 . . . . 0.0 110.834 179.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.497 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -65.76 -47.22 86.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 178.873 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.45 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -64.52 -37.42 87.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.372 179.539 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.45 ' N ' ' HG3' ' A' ' 97' ' ' MET . 35.7 t0 -68.75 -33.88 74.65 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.095 0.474 . . . . 0.0 109.965 179.278 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.435 ' O ' ' OG1' ' A' ' 103' ' ' THR . 53.2 m-20 -81.88 -26.86 33.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.475 179.294 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.47 HD11 ' N ' ' A' ' 5' ' ' GLY . 1.6 mm -86.4 -59.7 2.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.041 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 7.9 ttmt -44.15 -30.6 0.79 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.374 -179.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.77 -37.93 34.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.446 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.586 ' HB ' HD12 ' A' ' 18' ' ' ILE . 0.3 OUTLIER -59.33 -57.42 13.09 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.714 179.588 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 1.034 HD13 HD11 ' A' ' 48' ' ' LEU . 5.7 mt -47.97 -56.03 8.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.892 179.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.37 -44.99 80.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.883 179.444 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -52.19 -34.44 45.3 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-O 121.168 0.509 . . . . 0.0 110.404 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.989 HG22 ' HE1' ' A' ' 111' ' ' TYR . 5.0 mt -85.64 -51.91 12.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.328 179.291 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.693 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -42.26 -57.58 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.501 179.396 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.7 m -46.92 -26.12 0.92 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.178 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.438 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 14.4 mtp85 -74.06 -25.02 59.61 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.282 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.989 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -76.32 -34.34 59.01 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.748 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.01 -43.51 17.88 Favored 'General case' 0 CA--C 1.505 -0.776 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 178.851 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -61.65 -31.56 71.67 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 113.867 -1.515 . . . . 0.0 109.099 178.112 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.438 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.449 -0.516 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.697 178.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 33.8 m170 . . . . . 0 CA--C 1.53 0.183 0 CA-C-O 120.477 0.18 . . . . 0.0 111.434 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.571 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 3.4 p -151.25 155.39 38.69 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.162 0.506 . . . . 0.0 111.328 179.543 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.502 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 173.62 138.02 2.55 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.866 -0.894 . . . . 0.0 110.866 -179.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.558 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.22 133.41 35.25 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -178.53 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.711 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -141.6 171.23 14.35 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.182 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.646 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.66 127.99 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.827 -179.598 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.49 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 7.6 t80 -129.41 110.81 12.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.957 0.408 . . . . 0.0 111.155 178.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.411 ' HG3' ' CE1' ' A' ' 9' ' ' PHE . 36.8 mt-10 67.53 49.38 1.01 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.826 179.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 69.76 -4.69 1.37 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.214 179.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.454 ' O ' HG23 ' A' ' 8' ' ' ILE . 15.7 t -100.07 148.11 6.95 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.479 0 CA-C-O 121.108 0.48 . . . . 0.0 110.41 179.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.434 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -112.1 112.83 24.73 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.956 179.885 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.884 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -130.46 -128.97 3.04 Favored Glycine 0 N--CA 1.445 -0.71 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.958 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.884 HD13 ' O ' ' A' ' 14' ' ' GLY . 19.4 mm -138.66 135.48 43.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 120.692 0.282 . . . . 0.0 111.313 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.89 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.8 141.2 17.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 106.279 -1.748 . . . . 0.0 106.279 176.575 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.571 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.41 116.99 5.4 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 119.532 -0.867 . . . . 0.0 111.549 -178.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.916 HD13 HG22 ' A' ' 103' ' ' THR . 4.7 mt -85.28 137.81 20.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 114.553 -1.203 . . . . 0.0 111.85 -178.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.638 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.7 OUTLIER -116.6 93.43 4.21 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.316 179.545 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -80.36 0.08 34.62 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.475 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -82.7 0.41 43.51 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.36 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.638 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -101.75 -162.27 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.873 0.368 . . . . 0.0 110.886 179.89 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 t -175.73 101.23 0.25 Allowed Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.427 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.442 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 57.5 Cg_endo -71.31 160.23 92.71 Favored 'Cis proline' 0 C--N 1.346 0.434 0 C-N-CA 123.471 -1.47 . . . . 0.0 112.784 0.409 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.572 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -53.64 176.97 0.03 OUTLIER 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.421 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.504 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.64 135.0 4.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.43 179.309 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.81 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -108.08 130.57 55.09 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 178.736 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.738 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.4 m -114.52 113.44 24.44 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -178.201 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.535 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 78.1 t90 -91.94 110.58 21.94 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.246 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.505 ' O ' ' N ' ' A' ' 15' ' ' ILE . 1.5 ttt180 -110.83 131.27 55.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.199 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.413 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 17.1 m -49.91 160.6 0.31 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.424 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.424 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 45.9 m -75.66 -37.34 59.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.341 0.591 . . . . 0.0 109.751 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -85.42 -14.53 45.93 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.107 179.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.65 34.72 12.91 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.323 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.32 -26.1 26.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.812 0.339 . . . . 0.0 111.358 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.28 162.49 2.95 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.275 0.56 . . . . 0.0 111.411 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.738 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.61 145.63 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.035 -178.768 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 31.3 m-70 -120.03 120.99 37.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.779 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.4 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.51 128.52 43.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.708 -179.982 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.559 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -114.72 140.25 36.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.522 -179.547 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.421 HG12 ' HB3' ' A' ' 43' ' ' SER . 28.3 t -104.03 96.29 4.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 177.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.81 HD11 HD22 ' A' ' 104' ' ' LEU . 0.5 OUTLIER -42.81 -24.46 0.06 Allowed 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.874 -178.89 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.442 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 1.5 t -74.84 -48.02 27.36 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.255 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.405 HG23 ' HB ' ' A' ' 41' ' ' VAL . 48.4 p -64.66 -27.71 69.11 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 108.976 -0.749 . . . . 0.0 108.976 178.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.877 HD12 ' HB3' ' A' ' 62' ' ' LEU . 44.6 mm -56.58 108.06 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.645 178.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.444 ' N ' ' O ' ' A' ' 63' ' ' ILE . 14.9 t0 -55.27 -28.13 51.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.395 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.431 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 2.7 ptpt -172.45 161.97 5.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.901 0.381 . . . . 0.0 110.873 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.695 HD11 HD13 ' A' ' 104' ' ' LEU . 46.5 tp -109.09 118.94 38.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.975 -179.607 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.414 ' HB3' ' HB3' ' A' ' 61' ' ' ARG . 3.2 tt0 -117.6 145.68 44.15 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.788 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.66 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.1 145.92 19.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.997 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.526 HG23 ' HB2' ' A' ' 59' ' ' MET . 72.7 p . . . . . 0 CA--C 1.53 0.173 0 CA-C-O 120.595 0.236 . . . . 0.0 110.954 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.835 0.35 . . . . 0.0 110.526 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.526 ' HB2' HG23 ' A' ' 51' ' ' THR . 47.8 mtm -149.6 146.29 27.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.615 -179.424 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.66 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 26.7 mt -119.8 148.75 43.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.596 178.797 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.429 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 1.7 ttt180 -144.52 147.19 32.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.879 0.371 . . . . 0.0 111.559 -179.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.877 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.6 mp -128.37 113.74 15.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.815 178.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.604 ' HA ' ' HB3' ' A' ' 86' ' ' ARG . 7.1 mm -76.7 156.48 5.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.747 0.308 . . . . 0.0 111.239 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.467 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.489 179.937 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.519 HG22 ' N ' ' A' ' 67' ' ' ASP . 11.2 p . . . . . 0 N--CA 1.457 -0.101 0 CA-C-O 120.871 0.367 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.519 ' N ' HG22 ' A' ' 66' ' ' VAL . 7.4 m-20 -91.7 74.22 5.82 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.138 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.51 ' CG ' HG11 ' A' ' 81' ' ' VAL . 9.9 mp0 -54.29 -21.01 8.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.603 -179.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.7 m -48.53 -27.46 2.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.882 0.372 . . . . 0.0 111.317 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.8 mmmt -67.46 -65.83 0.64 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.757 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.3 mttt 60.93 93.01 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.022 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.57 124.46 34.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.754 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -76.18 167.49 21.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.944 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -104.43 -50.48 3.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.203 0.525 . . . . 0.0 111.168 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.3 t30 174.36 -31.54 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.198 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -93.37 40.78 1.07 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.091 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 58.33 19.16 38.9 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.645 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -80.38 174.23 11.81 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.821 0.343 . . . . 0.0 110.8 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -133.29 111.99 11.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.825 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 24.4 t -103.33 141.58 18.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.432 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.51 HG11 ' CG ' ' A' ' 68' ' ' GLU . 45.4 t -110.65 90.6 10.81 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.633 179.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -44.55 145.51 2.6 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.681 2.254 . . . . 0.0 112.57 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.454 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -54.06 154.44 7.72 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.156 -179.889 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.477 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 4.2 Cg_exo . . . . . 0 N--CA 1.46 -0.486 0 C-N-CA 123.513 2.808 . . . . 0.0 112.351 -179.193 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.604 ' HB3' ' HA ' ' A' ' 63' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.697 0.284 . . . . 0.0 111.056 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.523 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 14.4 m-70 -94.93 116.44 28.71 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.183 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.04 110.95 22.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.005 0.431 . . . . 0.0 111.186 -179.413 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.89 ' CD1' HD11 ' A' ' 16' ' ' ILE . 94.2 m-85 -110.93 116.61 31.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.501 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.417 ' HB2' HG12 ' A' ' 8' ' ' ILE . 0.8 OUTLIER -100.79 114.39 28.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.884 0.373 . . . . 0.0 110.711 179.928 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.711 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 42.6 m-85 -93.41 150.69 20.26 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.426 -179.751 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 -107.98 31.54 5.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.404 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.513 ' HB3' HG23 ' A' ' 96' ' ' VAL . 2.1 m-20 -175.93 113.68 0.12 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.468 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.438 ' O ' ' HG3' ' A' ' 97' ' ' MET . 0.0 OUTLIER -56.57 -19.07 14.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 179.77 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.92 -45.07 64.92 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.735 179.764 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.513 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -67.81 -48.27 76.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.966 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.438 ' HG3' ' O ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -62.07 -35.56 79.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.865 179.165 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.4 ' N ' ' HG3' ' A' ' 97' ' ' MET . 7.3 m-20 -61.15 -31.47 71.19 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.217 179.111 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.9 m-80 -81.73 -51.76 7.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.42 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.681 HG23 HD11 ' A' ' 18' ' ' ILE . 10.7 mm -58.46 -59.77 3.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.623 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.412 ' HG3' ' CB ' ' A' ' 50' ' ' ALA . 5.3 ttmt -51.18 -31.75 21.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.912 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 14.1 mtm -83.34 -31.44 26.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.592 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.916 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -82.32 -27.16 32.41 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.798 -179.568 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.81 HD22 HD11 ' A' ' 42' ' ' LEU . 19.3 mt -67.69 -42.08 82.63 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 179.322 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.42 ' HA ' HG13 ' A' ' 108' ' ' ILE . 0.7 OUTLIER -66.29 -48.72 69.48 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.603 -179.362 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.445 ' HG2' ' HA ' ' A' ' 103' ' ' THR . 11.1 pt20 -46.86 -33.39 4.48 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 121.087 0.47 . . . . 0.0 110.973 -178.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.036 HG22 ' HE1' ' A' ' 111' ' ' TYR . 11.3 mt -82.42 -53.36 11.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.603 179.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.686 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.24 -57.15 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.342 179.65 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -46.87 -26.92 1.08 Allowed 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.134 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.446 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 19.7 mtp180 -73.95 -25.05 59.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.29 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 1.036 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -76.1 -35.59 59.25 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.735 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.718 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -80.54 -43.78 20.14 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 178.911 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -61.54 -31.08 71.09 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 113.876 -1.511 . . . . 0.0 109.053 178.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.446 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.407 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.691 178.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.409 ' NE2' ' HB2' ' A' ' 20' ' ' GLU . 24.3 m170 . . . . . 0 CA--C 1.528 0.109 0 CA-C-O 120.567 0.222 . . . . 0.0 111.093 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.581 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 3.9 p -155.79 157.58 36.73 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.122 0.487 . . . . 0.0 111.218 179.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.513 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 171.33 139.15 2.7 Favored Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 111.119 -0.792 . . . . 0.0 111.119 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.78 144.2 30.33 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -178.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.556 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -153.28 171.19 18.94 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.054 -179.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.663 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.79 125.74 55.85 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 CA-C-O 120.745 0.307 . . . . 0.0 111.721 -179.68 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.478 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.2 t80 -125.17 109.16 12.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.938 0.399 . . . . 0.0 111.194 178.498 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.421 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 49.9 mt-10 67.5 48.06 1.16 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.888 179.025 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.6 mttt 73.3 -5.84 1.87 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.2 0.445 . . . . 0.0 112.2 179.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.459 ' O ' HG23 ' A' ' 8' ' ' ILE . 16.8 t -100.21 148.68 6.49 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.496 0 CA-C-O 121.174 0.511 . . . . 0.0 110.448 179.639 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.45 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -110.8 113.18 25.56 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.97 179.883 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.886 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.9 -133.86 3.51 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.803 -0.713 . . . . 0.0 111.983 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.886 HD13 ' O ' ' A' ' 14' ' ' GLY . 18.4 mm -135.93 135.68 50.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.682 0.277 . . . . 0.0 111.319 179.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.932 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.74 140.37 19.82 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 176.5 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.581 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -149.55 117.51 6.31 Favored 'General case' 0 C--N 1.31 -1.115 0 C-N-CA 119.607 -0.837 . . . . 0.0 111.614 -178.581 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.899 HD13 HG22 ' A' ' 103' ' ' THR . 4.3 mt -85.39 142.77 12.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.738 -178.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.613 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -121.26 92.83 3.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.399 179.634 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.409 ' HB2' ' NE2' ' A' ' 3' ' ' HIS . 0.7 OUTLIER -81.18 0.42 36.57 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.487 -179.867 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -82.67 0.65 42.26 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.295 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.613 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -102.24 -162.56 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.924 0.392 . . . . 0.0 110.858 -179.962 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.414 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 10.1 p -174.43 101.07 0.28 Allowed Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.437 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.45 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 56.4 Cg_endo -70.71 165.64 78.76 Favored 'Cis proline' 0 C--N 1.347 0.461 0 C-N-CA 123.438 -1.484 . . . . 0.0 112.807 0.278 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.462 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -58.25 176.74 0.15 Allowed 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.308 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.478 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.7 135.46 4.87 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.287 179.287 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.804 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.85 147.37 31.01 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.786 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.737 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.2 m -132.73 113.65 13.22 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.551 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 79.7 t90 -91.96 110.5 21.86 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 178.331 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.468 ' O ' ' N ' ' A' ' 15' ' ' ILE . 8.8 ttt180 -110.51 131.0 55.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.961 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.5 m -49.87 158.92 0.44 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.53 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.411 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 48.4 m -74.42 -37.35 63.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.379 0.609 . . . . 0.0 109.674 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -84.21 -16.02 44.83 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.027 -0.988 . . . . 0.0 111.154 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.47 34.53 11.81 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.235 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.92 -25.53 26.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.638 0.256 . . . . 0.0 111.364 -179.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.78 163.75 2.86 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.31 0.576 . . . . 0.0 111.403 -179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.737 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.65 146.83 19.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.07 -178.757 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.43 ' ND1' ' CZ ' ' A' ' 9' ' ' PHE . 12.6 m-70 -120.48 120.18 35.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.698 179.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.525 HG23 HG23 ' A' ' 28' ' ' THR . 0.3 OUTLIER -96.43 141.45 29.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.805 -179.772 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.555 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -129.98 139.83 50.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.413 -179.507 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.418 ' O ' HG12 ' A' ' 45' ' ' ILE . 30.7 t -103.87 96.32 4.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 177.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.812 HD11 HD22 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -41.75 -24.21 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.127 -178.775 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.45 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 1.8 t -77.38 -48.59 16.9 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 179.388 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.7 p -64.49 -27.5 69.02 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.867 HD12 ' HB3' ' A' ' 62' ' ' LEU . 36.7 mm -56.48 112.59 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.595 178.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.418 ' N ' ' O ' ' A' ' 63' ' ' ILE . 1.4 t70 -52.37 -35.05 50.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.882 0.373 . . . . 0.0 111.034 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.412 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 12.6 pttt -172.34 167.44 5.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.813 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.631 HD11 HD13 ' A' ' 104' ' ' LEU . 15.1 tp -109.05 118.85 37.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.986 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.4 ' HB3' ' HB3' ' A' ' 61' ' ' ARG . 10.6 tt0 -114.27 145.92 41.12 Favored 'General case' 0 C--O 1.225 -0.224 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.423 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.629 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -156.97 151.07 24.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.129 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.674 HG23 ' HB2' ' A' ' 59' ' ' MET . 9.5 p . . . . . 0 C--N 1.331 -0.196 0 CA-C-O 120.657 0.265 . . . . 0.0 111.295 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.426 ' HG2' ' CA ' ' A' ' 94' ' ' ARG . 3.0 mpp? . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.83 0.348 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.674 ' HB2' HG23 ' A' ' 51' ' ' THR . 31.0 mtm -149.69 138.48 20.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.637 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.629 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 16.0 mt -117.68 143.54 46.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.054 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.513 ' HD3' HD13 ' A' ' 63' ' ' ILE . 0.3 OUTLIER -144.59 149.57 36.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.022 0.439 . . . . 0.0 112.023 -179.043 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.867 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.8 mp -128.08 118.05 22.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.819 178.533 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.711 HD12 ' HG2' ' A' ' 86' ' ' ARG . 10.0 mm -76.5 156.5 5.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.037 -179.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.284 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.53 -179.995 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.504 HG22 ' N ' ' A' ' 67' ' ' ASP . 14.5 p . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.747 0.308 . . . . 0.0 111.174 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.504 ' N ' HG22 ' A' ' 66' ' ' VAL . 14.0 p30 -101.71 73.11 1.41 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.623 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.529 ' HA ' HG13 ' A' ' 81' ' ' VAL . 9.4 mt-10 -54.92 -23.99 21.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.256 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.6 m -63.44 -21.77 66.49 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.0 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -63.33 -62.88 1.39 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.795 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.8 mttm 62.77 94.47 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.819 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.6 128.74 45.02 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.857 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.48 153.96 37.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.913 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.46 -42.16 7.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.984 0.421 . . . . 0.0 111.007 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 167.76 -29.66 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.166 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -101.6 20.79 15.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.356 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.21 36.05 56.29 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.555 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -90.29 0.38 57.26 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 54.77 110.42 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.901 0.381 . . . . 0.0 111.661 179.423 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 7.1 t -113.44 133.54 59.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.619 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.529 HG13 ' HA ' ' A' ' 68' ' ' GLU . 42.5 t -106.17 85.78 1.79 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.605 179.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 81' ' ' VAL . 1.5 Cg_endo -43.85 139.9 5.19 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.954 2.436 . . . . 0.0 112.633 -179.598 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -58.82 165.08 3.53 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.122 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.429 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.3 Cg_exo . . . . . 0 N--CA 1.46 -0.442 0 C-N-CA 123.683 2.922 . . . . 0.0 112.33 -179.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.711 ' HG2' HD12 ' A' ' 63' ' ' ILE . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.697 0.284 . . . . 0.0 110.751 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.502 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 10.0 m-70 -99.09 111.33 23.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.756 0.312 . . . . 0.0 110.164 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.412 ' HA ' ' HG3' ' A' ' 61' ' ' ARG . 9.0 ttt -94.74 134.7 37.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.065 0.46 . . . . 0.0 111.586 -179.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.932 ' CD1' HD11 ' A' ' 16' ' ' ILE . 51.5 m-85 -135.31 116.62 14.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.667 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.443 ' HB3' ' HB ' ' A' ' 8' ' ' ILE . 0.5 OUTLIER -92.22 114.8 27.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.894 0.378 . . . . 0.0 110.491 179.775 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.476 ' CE1' ' HB2' ' A' ' 7' ' ' ALA . 9.0 m-85 -89.74 136.33 33.1 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.733 -179.368 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -101.08 27.79 5.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.306 179.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.441 ' CB ' HG23 ' A' ' 96' ' ' VAL . 9.9 m-20 -175.24 112.76 0.13 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.556 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.458 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -55.79 -19.39 11.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.927 179.72 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.21 -47.95 59.25 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.796 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.441 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -66.83 -45.37 87.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.006 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.458 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -63.9 -37.02 85.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.766 179.31 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.481 ' O ' ' HE2' ' A' ' 102' ' ' MET . 14.1 m-20 -61.14 -31.95 71.66 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.093 0.473 . . . . 0.0 109.941 178.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 -81.97 -54.04 5.64 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.502 179.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.538 HD12 ' CG2' ' A' ' 16' ' ' ILE . 15.3 mm -57.5 -60.01 2.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.896 179.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.404 ' HG3' ' CB ' ' A' ' 50' ' ' ALA . 0.4 OUTLIER -51.6 -37.3 49.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.269 -179.584 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.481 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 39.1 mtm -81.35 -27.72 34.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.218 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.899 HG22 HD13 ' A' ' 18' ' ' ILE . 1.0 OUTLIER -81.49 -31.44 32.9 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.852 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.812 HD22 HD11 ' A' ' 42' ' ' LEU . 33.7 mt -64.8 -55.95 16.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.96 179.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.404 ' NE2' ' O ' ' A' ' 101' ' ' LYS . 0.5 OUTLIER -62.34 -35.9 80.54 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.926 179.64 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -50.39 -36.97 35.11 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-O 121.289 0.566 . . . . 0.0 109.811 179.287 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.015 HG22 ' HE1' ' A' ' 111' ' ' TYR . 12.4 mt -85.78 -52.08 12.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.02 178.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.67 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.53 -58.1 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.342 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.229 179.225 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.4 m -47.29 -25.98 1.11 Allowed 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.133 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.454 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 33.6 mtp180 -74.08 -25.04 59.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.214 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 1.015 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -75.41 -35.28 61.04 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.661 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.74 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.34 -43.46 19.03 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 178.873 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -61.66 -31.59 71.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 113.838 -1.528 . . . . 0.0 108.983 178.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.454 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.447 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.681 178.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.42 ' O ' ' N ' ' A' ' 18' ' ' ILE . 18.6 m80 . . . . . 0 CA--C 1.529 0.159 0 CA-C-O 120.62 0.248 . . . . 0.0 111.009 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.555 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 19.2 p -158.31 133.63 8.71 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 121.244 0.545 . . . . 0.0 111.212 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.534 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -170.29 138.78 5.17 Favored Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.566 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -80.26 142.28 34.75 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -178.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.507 ' C ' HD13 ' A' ' 8' ' ' ILE . . . -154.66 171.19 19.9 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.326 -179.35 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.645 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -99.08 127.59 51.58 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.388 -179.782 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.471 ' CB ' ' CE2' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -127.19 107.18 9.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.994 0.426 . . . . 0.0 111.545 179.122 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 68.04 53.87 0.62 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.221 179.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.06 -0.7 1.64 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.91 179.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.566 ' O ' HG23 ' A' ' 8' ' ' ILE . 37.1 t -105.15 151.91 7.22 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.481 0 CA-C-O 121.201 0.524 . . . . 0.0 110.576 179.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.471 ' HA ' HD12 ' A' ' 8' ' ' ILE . 54.7 p -114.09 115.84 28.19 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.136 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.729 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -138.04 -139.27 3.83 Favored Glycine 0 N--CA 1.444 -0.804 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.94 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.729 HD13 ' O ' ' A' ' 14' ' ' GLY . 15.9 mm -129.32 134.93 62.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.844 0.354 . . . . 0.0 111.219 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.845 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.36 140.62 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 176.703 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.555 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.46 118.1 5.74 Favored 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 119.537 -0.865 . . . . 0.0 111.507 -178.347 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.685 HD12 ' HB ' ' A' ' 103' ' ' THR . 6.9 mt -80.79 142.96 13.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 114.385 -1.28 . . . . 0.0 112.254 -178.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.642 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -119.39 92.65 3.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.96 179.057 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.26 -0.95 47.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.305 -179.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -83.0 1.07 41.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.57 -0.287 . . . . 0.0 111.241 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.642 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -102.91 -162.92 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.837 0.351 . . . . 0.0 110.758 179.998 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.412 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 9.9 p -174.42 101.07 0.28 Allowed Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.333 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.456 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 58.5 Cg_endo -71.74 165.4 81.75 Favored 'Cis proline' 0 C--N 1.347 0.464 0 C-N-CA 123.569 -1.43 . . . . 0.0 112.905 0.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.55 176.57 0.13 Allowed 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.514 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.518 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 13.7 pt-20 -163.76 136.85 5.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.229 179.104 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.796 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.92 129.06 55.12 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.954 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.507 HG22 ' CG2' ' A' ' 37' ' ' VAL . 6.7 m -111.67 113.18 25.39 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.555 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.489 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 75.4 t90 -91.99 110.63 22.0 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.737 178.668 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -107.98 126.84 53.18 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.912 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.4 t -49.77 156.53 0.69 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.378 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.442 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 54.4 m -71.69 -38.04 70.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.433 0.635 . . . . 0.0 109.415 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -78.75 -9.99 59.62 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 114.897 -1.047 . . . . 0.0 111.184 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 69.77 42.38 70.77 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.276 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -101.98 -23.18 14.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.729 0.299 . . . . 0.0 111.262 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -168.19 153.85 6.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.385 0.612 . . . . 0.0 111.487 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.507 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.5 OUTLIER -140.97 155.47 21.74 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.072 -178.634 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.427 ' HB2' ' CE2' ' A' ' 9' ' ' PHE . 10.7 m-70 -131.2 121.96 25.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.491 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.42 127.23 42.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.0 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.567 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -113.11 138.94 40.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.16 -179.915 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.474 ' CG1' HG23 ' A' ' 44' ' ' THR . 44.5 t -103.86 95.85 4.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.067 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.727 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.7 OUTLIER -41.8 -25.09 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.123 -0.489 . . . . 0.0 112.008 -178.905 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.456 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 2.1 t -76.07 -48.64 20.06 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 179.352 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.474 HG23 ' CG1' ' A' ' 41' ' ' VAL . 31.0 p -64.68 -27.89 69.23 Favored 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.407 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.842 HD12 ' HB3' ' A' ' 62' ' ' LEU . 41.6 mm -56.43 108.15 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.471 178.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.423 ' N ' ' O ' ' A' ' 63' ' ' ILE . 50.5 t0 -48.74 -34.03 11.37 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.807 0.337 . . . . 0.0 111.143 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.414 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 2.3 pttt -172.56 165.02 5.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.853 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.77 HD11 HD13 ' A' ' 104' ' ' LEU . 8.3 tp -109.03 119.19 38.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.76 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.411 ' HB2' ' HB3' ' A' ' 61' ' ' ARG . 3.8 mt-30 -115.72 147.13 41.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.413 179.46 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.668 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.03 149.11 22.83 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.79 -0.187 . . . . 0.0 110.969 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.1 p . . . . . 0 CA--C 1.53 0.18 0 CA-C-O 120.628 0.251 . . . . 0.0 110.819 -179.968 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.799 0.333 . . . . 0.0 110.504 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.44 ' O ' HD23 ' A' ' 60' ' ' LEU . 46.2 mtm -149.6 143.03 25.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.755 -179.253 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.668 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 24.8 mt -121.78 145.19 48.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.205 178.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.442 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 14.8 ttm-85 -140.29 150.71 44.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.937 0.399 . . . . 0.0 111.6 -179.373 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.842 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.4 mp -128.07 117.75 22.22 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.958 178.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.46 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 21.4 mm -76.54 156.51 5.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.857 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.415 ' N ' HG22 ' A' ' 63' ' ' ILE . . . . . . . . 0 N--CA 1.452 -0.288 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.614 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.48 HG22 ' N ' ' A' ' 67' ' ' ASP . 11.7 p . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.854 0.359 . . . . 0.0 111.287 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.48 ' N ' HG22 ' A' ' 66' ' ' VAL . 3.0 m-20 -98.06 48.16 1.0 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.806 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.38 -20.41 54.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.262 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.0 m -59.33 -21.45 59.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.163 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.7 mmmt -72.82 -67.66 0.54 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.856 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.506 ' HA ' HG23 ' A' ' 81' ' ' VAL . 11.5 mttm 62.12 94.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.767 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.58 170.29 8.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.839 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -133.01 -166.7 1.8 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.737 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -138.32 -170.16 2.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.993 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -58.78 -21.28 55.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.303 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -110.25 29.09 7.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.01 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.63 26.17 38.14 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.639 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -62.44 -164.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.798 0.332 . . . . 0.0 110.934 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -133.45 115.41 14.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.581 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 90.1 t -86.98 -61.16 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.558 -179.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.676 ' O ' HG12 ' A' ' 81' ' ' VAL . 0.9 OUTLIER 40.85 95.98 0.04 OUTLIER Pre-proline 0 CA--C 1.536 0.414 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.128 179.904 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.499 ' HD2' ' HA ' ' A' ' 81' ' ' VAL . 9.6 Cg_endo -52.05 139.08 52.66 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.599 2.199 . . . . 0.0 112.398 -179.301 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.4 mmmm -69.09 155.97 92.49 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.946 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.42 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 2.3 Cg_endo . . . . . 0 N--CA 1.459 -0.534 0 C-N-CA 123.528 2.818 . . . . 0.0 112.444 -179.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.42 ' HG3' HG23 ' A' ' 63' ' ' ILE . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.509 0.195 . . . . 0.0 110.815 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.459 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 40.9 m-70 -94.05 111.42 23.14 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 179.423 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.25 110.97 22.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.993 0.425 . . . . 0.0 111.241 -179.282 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.845 ' CD1' HD11 ' A' ' 16' ' ' ILE . 96.2 m-85 -115.16 116.6 28.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.537 179.755 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.63 114.53 28.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.637 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.467 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 3.7 m-85 -94.35 137.27 33.71 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.077 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -94.0 41.06 1.08 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.707 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.612 ' HB3' HG23 ' A' ' 96' ' ' VAL . 1.6 m-20 177.97 115.41 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.333 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.425 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -58.2 -16.47 13.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.829 179.721 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -73.19 -45.31 57.1 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-O 121.099 0.476 . . . . 0.0 110.12 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.612 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -65.24 -49.93 76.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.42 179.031 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.425 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -62.69 -36.24 82.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.49 179.523 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -70.43 -35.01 73.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.076 0.465 . . . . 0.0 110.191 179.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.404 ' O ' ' OG1' ' A' ' 103' ' ' THR . 73.1 m-20 -81.75 -27.48 33.79 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.468 179.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.534 HD11 ' N ' ' A' ' 5' ' ' GLY . 1.3 mm -86.21 -59.19 2.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.959 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.432 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 6.5 ttmt -43.98 -31.05 0.81 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.193 -179.55 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.416 ' HG3' ' N ' ' A' ' 103' ' ' THR . 19.8 ptp -77.83 -39.75 42.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.352 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.685 ' HB ' HD12 ' A' ' 18' ' ' ILE . 0.3 OUTLIER -60.13 -52.42 65.43 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.794 179.654 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.77 HD13 HD11 ' A' ' 48' ' ' LEU . 9.5 mt -51.5 -59.45 4.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.369 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.432 ' NE2' ' O ' ' A' ' 101' ' ' LYS . 0.8 OUTLIER -60.49 -34.26 73.8 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.87 179.601 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -56.09 -36.22 67.89 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.232 0.539 . . . . 0.0 109.856 179.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.031 HG22 ' HE1' ' A' ' 111' ' ' TYR . 8.3 mt -85.76 -50.61 14.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.367 179.104 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.679 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.13 -56.4 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.427 179.433 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -46.26 -28.23 1.23 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.047 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.468 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 29.2 mtt180 -72.77 -25.04 61.03 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.346 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 1.031 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -76.34 -35.12 58.91 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 179.884 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.735 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.17 -44.01 18.5 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 178.954 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 54.7 t0 -61.87 -31.24 71.5 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 113.822 -1.535 . . . . 0.0 109.148 178.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.468 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.417 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.85 178.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.442 ' NE2' ' HB2' ' A' ' 20' ' ' GLU . 22.3 m170 . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.613 0.244 . . . . 0.0 110.934 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.577 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 2.6 p -158.49 156.15 29.75 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.205 0.526 . . . . 0.0 111.295 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.493 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 172.75 139.44 2.85 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 110.898 -0.881 . . . . 0.0 110.898 -179.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.544 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -84.0 143.17 29.96 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.621 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . . . -152.46 171.15 18.52 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.079 -179.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.654 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.67 126.48 56.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-O 120.786 0.327 . . . . 0.0 111.715 -179.613 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.481 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.6 t80 -126.63 109.81 12.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.917 0.389 . . . . 0.0 111.128 178.388 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 3.8 mm-40 67.73 50.43 0.87 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.828 179.214 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.1 mttt 69.23 -3.42 1.55 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 179.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.493 ' O ' HG23 ' A' ' 8' ' ' ILE . 17.0 t -101.38 148.58 7.13 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 CA-C-O 121.097 0.475 . . . . 0.0 110.564 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.451 ' HA ' HD12 ' A' ' 8' ' ' ILE . 73.0 p -111.12 114.62 28.01 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.024 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.893 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -134.18 -133.99 3.38 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.953 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.893 HD13 ' O ' ' A' ' 14' ' ' GLY . 18.8 mm -136.35 136.49 48.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.683 0.278 . . . . 0.0 111.34 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.94 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.84 141.47 17.5 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.63 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 176.436 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.577 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.4 118.39 5.86 Favored 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.534 -178.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.935 HD13 HG22 ' A' ' 103' ' ' THR . 4.8 mt -85.33 142.73 12.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 114.537 -1.21 . . . . 0.0 111.796 -178.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.619 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -121.65 93.07 3.89 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.419 179.596 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.442 ' HB2' ' NE2' ' A' ' 3' ' ' HIS . 0.1 OUTLIER -81.19 1.09 33.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.532 -179.777 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -81.86 0.47 39.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.122 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.619 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -101.75 -161.99 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.801 0.334 . . . . 0.0 110.838 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.41 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 15.6 p -175.24 100.93 0.26 Allowed Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.455 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.442 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 10.5 Cg_exo -70.11 166.04 76.04 Favored 'Cis proline' 0 C--N 1.347 0.471 0 C-N-CA 123.55 -1.437 . . . . 0.0 112.512 0.296 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.459 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -60.04 176.99 0.27 Allowed 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.248 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.523 ' HG2' HG21 ' A' ' 22' ' ' VAL . 6.9 pt-20 -163.78 138.19 5.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.141 179.177 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.823 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.76 149.05 28.66 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.874 -0.788 . . . . 0.0 108.874 178.86 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.792 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.3 m -133.84 112.58 11.44 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -178.272 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.538 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 76.8 t90 -92.11 110.68 22.06 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.258 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.411 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.1 ptp180 -112.13 133.44 54.27 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.718 0.294 . . . . 0.0 110.761 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 25.4 m -49.82 161.02 0.26 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.593 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.407 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 53.5 m -74.22 -37.78 63.75 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.404 0.621 . . . . 0.0 109.659 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.72 -17.29 41.76 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.041 179.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.81 33.74 10.83 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.367 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -83.83 -27.85 28.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.714 0.292 . . . . 0.0 111.258 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.96 161.49 5.72 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.283 0.564 . . . . 0.0 111.348 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.792 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.69 140.82 22.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.036 -178.709 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.476 ' CD2' ' CE1' ' A' ' 9' ' ' PHE . 89.4 m-70 -114.58 121.25 42.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.683 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.482 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.54 140.94 30.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.842 -179.856 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.567 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -127.79 140.47 49.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.329 -179.673 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.439 ' O ' HG12 ' A' ' 45' ' ' ILE . 41.1 t -103.95 95.94 4.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 177.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.771 HD11 HD22 ' A' ' 104' ' ' LEU . 0.7 OUTLIER -42.27 -23.83 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.972 -178.955 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.442 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -76.42 -48.32 20.13 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.255 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.411 HG23 ' CG1' ' A' ' 41' ' ' VAL . 38.9 p -64.53 -27.89 69.28 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 178.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.826 HD12 ' HB3' ' A' ' 62' ' ' LEU . 48.4 mm -56.9 108.49 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.582 178.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.414 ' N ' ' O ' ' A' ' 63' ' ' ILE . 8.3 t70 -51.93 -33.77 38.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.871 0.367 . . . . 0.0 110.819 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.422 ' HG3' HG12 ' A' ' 63' ' ' ILE . 13.8 pttt -171.23 165.04 7.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.703 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.725 HD11 HD13 ' A' ' 104' ' ' LEU . 16.6 tp -108.82 122.47 47.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.85 -179.554 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -115.49 141.56 47.89 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.473 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.658 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.06 141.15 16.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.075 -179.739 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.562 HG23 ' HB2' ' A' ' 59' ' ' MET . 44.6 p . . . . . 0 CA--C 1.53 0.174 0 CA-C-N 116.607 -0.27 . . . . 0.0 111.09 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.439 ' HE2' ' H ' ' A' ' 94' ' ' ARG . 1.3 mpt? . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.722 0.296 . . . . 0.0 110.857 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.562 ' HB2' HG23 ' A' ' 51' ' ' THR . 3.1 mpp? -149.88 138.52 20.81 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.93 0.395 . . . . 0.0 111.996 -179.517 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.661 HD12 ' CZ ' ' A' ' 91' ' ' PHE . 15.5 mt -120.0 140.73 50.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.615 178.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.464 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 13.0 ttm180 -143.38 151.67 40.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.032 0.444 . . . . 0.0 112.126 -178.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.826 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -128.52 117.63 21.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.95 178.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.479 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 14.2 mm -76.66 156.43 5.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.718 -0.219 . . . . 0.0 110.805 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.425 ' O ' ' HB2' ' A' ' 84' ' ' PRO . . . . . . . . 0 N--CA 1.452 -0.243 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.531 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.444 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 9.8 p . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.584 0.23 . . . . 0.0 110.771 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.444 ' N ' HG22 ' A' ' 66' ' ' VAL . 12.4 t70 -132.75 36.92 3.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.741 0.305 . . . . 0.0 111.44 -179.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 43.08 29.89 0.23 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.323 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 36.3 m -94.26 -28.15 15.76 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.974 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.6 mmtm -57.06 -79.88 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.708 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.0 mtpt 55.37 89.82 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.2 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.419 ' HG2' ' HG3' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -116.77 121.19 40.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.589 179.644 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -74.39 150.59 39.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.068 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -97.58 -166.19 1.35 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.833 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -65.72 -15.44 62.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.346 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -113.11 14.22 19.47 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.685 -0.234 . . . . 0.0 111.399 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.91 40.46 72.73 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.501 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -84.65 3.09 38.66 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.844 0.312 . . . . 0.0 111.844 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 79' ' ' GLU . 10.3 pt-20 42.24 97.2 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.09 0.472 . . . . 0.0 112.022 179.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.465 HG12 ' N ' ' A' ' 81' ' ' VAL . 13.9 t -109.83 157.66 10.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.721 -179.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.465 ' N ' HG12 ' A' ' 80' ' ' VAL . 52.8 t -111.92 82.24 4.01 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.326 179.288 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.419 ' HG3' ' HG2' ' A' ' 72' ' ' ARG . 83.1 Cg_exo -42.1 149.49 0.29 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.933 2.422 . . . . 0.0 112.954 -179.56 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -46.1 168.61 0.11 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.521 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.444 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 8.1 Cg_exo . . . . . 0 N--CA 1.464 -0.223 0 C-N-CA 123.705 2.937 . . . . 0.0 112.403 -178.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.438 ' CG ' HD12 ' A' ' 63' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.602 0.239 . . . . 0.0 111.028 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.479 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 37.8 m-70 -96.5 111.18 23.39 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.283 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.28 128.01 42.81 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.076 0.465 . . . . 0.0 111.637 -178.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.94 ' CD2' HD11 ' A' ' 16' ' ' ILE . 58.5 m-85 -132.15 116.57 17.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.481 179.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.459 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -91.61 115.04 27.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.953 0.406 . . . . 0.0 110.632 179.867 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.661 ' CZ ' HD12 ' A' ' 60' ' ' LEU . 2.8 m-85 -91.53 137.72 32.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.162 -179.522 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 22.5 m-20 -102.04 34.87 2.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.743 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.6 ' HB3' HG23 ' A' ' 96' ' ' VAL . 10.3 t30 179.14 123.42 0.05 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.943 -179.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.526 ' HA ' ' HG3' ' A' ' 97' ' ' MET . 2.8 mmm-85 -61.85 -14.41 33.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.547 179.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -71.72 -51.14 24.38 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 121.029 0.442 . . . . 0.0 110.352 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.6 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -56.94 -45.28 83.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.624 179.415 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.526 ' HG3' ' HA ' ' A' ' 94' ' ' ARG . 1.0 OUTLIER -57.14 -48.97 77.36 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.584 178.877 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.454 ' O ' ' HE2' ' A' ' 102' ' ' MET . 12.1 t70 -52.87 -32.94 47.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.378 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -82.52 -57.07 3.51 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.09 179.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.546 HD12 ' CG2' ' A' ' 16' ' ' ILE . 11.3 mm -65.08 -60.45 2.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.958 -179.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.419 ' O ' ' NE2' ' A' ' 105' ' ' GLN . 5.6 ttmt -50.18 -37.84 36.87 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.493 -178.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.454 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 14.4 mtm -80.04 -27.16 39.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.037 -179.663 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.935 HG22 HD13 ' A' ' 18' ' ' ILE . 1.0 OUTLIER -81.75 -31.71 31.83 Favored 'General case' 0 N--CA 1.443 -0.793 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 179.811 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.771 HD22 HD11 ' A' ' 42' ' ' LEU . 45.2 mt -65.1 -57.45 8.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.882 179.068 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.419 ' NE2' ' O ' ' A' ' 101' ' ' LYS . 0.1 OUTLIER -63.43 -34.06 76.92 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.932 179.562 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -52.31 -36.78 54.1 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.348 0.594 . . . . 0.0 109.829 179.332 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.015 HG22 ' HE1' ' A' ' 111' ' ' TYR . 12.1 mt -85.84 -51.71 12.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.049 178.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.661 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.63 -57.54 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.326 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.259 179.17 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 10.9 m -47.49 -26.29 1.34 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.027 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.451 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 73.5 mtt180 -73.64 -25.04 60.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.265 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 1.015 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -75.49 -34.9 60.9 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.734 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.747 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.47 -43.31 17.38 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 178.923 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -61.45 -31.54 71.5 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.875 -1.511 . . . . 0.0 109.092 178.15 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.451 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.44 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.611 178.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.454 ' O ' ' N ' ' A' ' 18' ' ' ILE . 30.6 m170 . . . . . 0 CA--C 1.53 0.193 0 N-CA-C 111.381 0.141 . . . . 0.0 111.381 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.487 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 2.0 p -143.73 158.4 43.7 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.982 0.42 . . . . 0.0 111.011 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.505 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 172.26 141.58 3.46 Favored Glycine 0 C--O 1.225 -0.435 0 N-CA-C 110.909 -0.876 . . . . 0.0 110.909 -179.467 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.547 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -84.87 147.06 26.98 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.639 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.589 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -156.14 171.13 20.69 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.202 -179.14 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.681 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.93 122.98 54.81 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 N-CA-C 111.817 0.302 . . . . 0.0 111.817 -179.556 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.483 ' CE1' ' CD2' ' A' ' 38' ' ' HIS . 5.7 t80 -121.86 108.65 13.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.983 0.421 . . . . 0.0 111.111 178.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 61.0 mt-10 67.43 48.95 1.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.911 179.016 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.7 mttm 73.28 -5.31 1.99 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 179.164 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.469 ' O ' HG23 ' A' ' 8' ' ' ILE . 18.6 t -101.13 148.67 6.9 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.514 0 CA-C-O 121.114 0.483 . . . . 0.0 110.534 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.435 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -111.76 112.71 24.59 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.067 179.87 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.885 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.57 -132.31 3.35 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.933 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.885 HD13 ' O ' ' A' ' 14' ' ' GLY . 17.8 mm -136.64 136.4 48.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.708 0.289 . . . . 0.0 111.345 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.913 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.86 140.95 18.47 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 N-CA-C 106.246 -1.761 . . . . 0.0 106.246 176.56 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . 0.487 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.6 118.18 5.72 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.565 -0.854 . . . . 0.0 111.695 -178.454 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.536 HD12 ' HB ' ' A' ' 103' ' ' THR . 48.3 mt -84.06 142.94 12.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 114.623 -1.171 . . . . 0.0 112.155 -178.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.615 ' OD1' HG22 ' A' ' 22' ' ' VAL . 2.4 t-20 -118.84 92.52 3.83 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.653 178.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -82.85 0.67 42.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.601 -179.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -82.53 1.57 37.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.76 0.314 . . . . 0.0 111.066 179.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.615 HG22 ' OD1' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -106.05 -163.03 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.825 -179.779 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.413 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.4 t -175.31 102.9 0.26 Allowed Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.32 179.669 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.45 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 9.4 Cg_exo -70.5 161.71 87.76 Favored 'Cis proline' 0 C--N 1.347 0.46 0 C-N-CA 123.614 -1.411 . . . . 0.0 112.678 0.348 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.443 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -57.4 179.4 0.05 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.403 179.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.517 ' CG ' HG21 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -163.58 135.89 5.13 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.174 179.091 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.829 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.92 138.42 44.19 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.958 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.8 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.0 OUTLIER -123.14 112.31 17.57 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -178.263 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.543 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 77.9 t90 -91.97 110.7 22.06 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 178.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' A' ' 15' ' ' ILE . 8.4 ptm180 -112.25 132.87 54.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.751 0.31 . . . . 0.0 110.916 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.408 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 8.4 t -50.02 161.71 0.24 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.692 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 54.6 m -75.38 -37.81 60.36 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.322 0.582 . . . . 0.0 109.759 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -83.4 -16.06 47.36 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.125 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.66 34.34 11.74 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.303 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -85.28 -26.37 26.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.717 0.294 . . . . 0.0 111.398 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.36 162.11 5.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.327 0.584 . . . . 0.0 111.449 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.8 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.9 OUTLIER -145.65 140.45 21.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.811 -178.826 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.483 ' CD2' ' CE1' ' A' ' 9' ' ' PHE . 29.5 m-70 -116.2 120.58 39.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.785 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.483 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.45 135.62 38.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.851 -179.913 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.562 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -122.76 140.74 45.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.349 -179.527 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.445 ' O ' HG12 ' A' ' 45' ' ' ILE . 21.4 t -103.98 95.45 3.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 177.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.674 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.7 OUTLIER -41.95 -23.76 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.882 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.45 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -76.97 -48.64 17.47 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.344 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.433 HG23 ' HB ' ' A' ' 41' ' ' VAL . 33.5 p -64.61 -26.82 68.56 Favored 'General case' 0 N--CA 1.441 -0.875 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 178.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.85 HD12 ' HB3' ' A' ' 62' ' ' LEU . 48.0 mm -56.57 108.66 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.602 178.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.426 ' N ' ' O ' ' A' ' 63' ' ' ILE . 3.7 t0 -53.32 -30.97 41.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.808 0.337 . . . . 0.0 111.011 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.423 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 5.1 ptpt -172.55 162.99 5.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.02 0.438 . . . . 0.0 110.878 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.911 HD11 HD13 ' A' ' 104' ' ' LEU . 12.0 tp -109.03 116.47 32.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.619 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.41 ' HB2' ' HB3' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -111.85 146.59 37.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.589 0.233 . . . . 0.0 110.627 -179.972 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.684 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.05 148.57 22.28 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.116 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.601 HG23 ' HB2' ' A' ' 59' ' ' MET . 37.2 p . . . . . 0 C--N 1.332 -0.18 0 CA-C-O 120.676 0.274 . . . . 0.0 111.117 -179.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.433 ' HB3' ' HG2' ' A' ' 97' ' ' MET . 2.4 mpp? . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.782 0.325 . . . . 0.0 111.175 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.601 ' HB2' HG23 ' A' ' 51' ' ' THR . 53.7 mtm -149.91 142.35 24.35 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.999 0.428 . . . . 0.0 111.716 -179.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.684 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 20.6 mt -122.07 143.46 49.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.155 178.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.426 ' HG3' ' O ' ' A' ' 87' ' ' HIS . 53.3 ttp180 -143.61 152.71 41.72 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 -178.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.85 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.3 mp -127.95 116.24 19.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.637 178.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.585 HG23 ' HG2' ' A' ' 86' ' ' ARG . 23.2 mm -76.54 156.68 5.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.701 0.286 . . . . 0.0 111.38 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.444 ' N ' HG22 ' A' ' 63' ' ' ILE . . . . . . . . 0 N--CA 1.452 -0.274 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.301 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.524 HG22 ' N ' ' A' ' 67' ' ' ASP . 13.5 p . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.824 0.345 . . . . 0.0 111.141 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.524 ' N ' HG22 ' A' ' 66' ' ' VAL . 0.4 OUTLIER -105.62 66.53 0.74 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.689 179.718 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -64.13 -16.2 61.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.416 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.2 m -101.03 29.53 4.59 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.767 0.318 . . . . 0.0 110.858 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.9 mmmt -115.21 -63.15 1.5 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.905 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.8 mttm 61.63 95.36 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.53 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.42 124.74 47.58 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.129 -179.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.1 mmtt -80.12 170.26 16.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.878 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -122.58 -172.16 2.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.879 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -68.01 -21.27 65.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.163 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -100.88 27.64 5.83 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.002 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.42 26.48 51.61 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.632 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 19.4 m-20 -93.59 115.16 27.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.815 0.341 . . . . 0.0 110.907 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -76.11 115.15 15.54 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.729 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.42 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 13.8 t -115.46 120.08 63.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.748 -179.571 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.703 ' O ' HG13 ' A' ' 81' ' ' VAL . 11.6 p -101.66 96.76 6.8 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.973 179.052 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.42 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 67.8 Cg_exo -36.26 151.34 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.068 2.512 . . . . 0.0 113.257 -178.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.0 mttp -104.36 169.63 7.01 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.131 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.485 ' HG3' HG11 ' A' ' 66' ' ' VAL . 2.8 Cg_exo . . . . . 0 N--CA 1.461 -0.408 0 C-N-CA 123.694 2.929 . . . . 0.0 112.259 -178.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.585 ' HG2' HG23 ' A' ' 63' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.637 0.256 . . . . 0.0 110.495 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.492 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 6.4 m-70 -95.39 111.0 22.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.798 0.332 . . . . 0.0 110.318 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -101.37 141.79 33.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.357 -179.369 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.913 ' CD2' HD11 ' A' ' 16' ' ' ILE . 5.1 m-85 -140.96 116.93 10.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.063 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.443 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -87.01 115.29 24.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.417 179.566 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.445 ' CE1' ' HB2' ' A' ' 7' ' ' ALA . 8.9 m-85 -89.12 134.67 33.92 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.398 -179.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 22.4 m-20 -98.75 28.87 4.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.467 179.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.429 ' CB ' HG23 ' A' ' 96' ' ' VAL . 7.4 m-20 -175.47 114.32 0.14 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.555 -179.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.49 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.1 OUTLIER -56.52 -17.63 9.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.997 179.767 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -72.3 -50.32 27.9 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 120.887 0.375 . . . . 0.0 110.43 179.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.429 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -65.88 -41.95 91.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.675 179.241 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.49 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -66.74 -37.82 85.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.927 179.317 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.463 ' N ' ' HG3' ' A' ' 97' ' ' MET . 29.2 t70 -62.61 -29.48 70.63 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.858 178.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.434 ' O ' ' OG1' ' A' ' 103' ' ' THR . 9.0 m-80 -81.9 -65.58 0.99 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.363 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.575 HG22 HD11 ' A' ' 104' ' ' LEU . 15.2 mm -46.53 -56.29 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 CA-C-O 121.148 0.499 . . . . 0.0 110.763 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.576 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 17.5 ttpp -48.07 -42.43 28.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.982 179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.492 ' HG2' ' N ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -75.18 -39.4 60.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.332 179.903 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.536 ' HB ' HD12 ' A' ' 18' ' ' ILE . 0.2 OUTLIER -60.0 -50.73 72.61 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.815 179.785 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.911 HD13 HD11 ' A' ' 48' ' ' LEU . 6.4 mt -53.36 -59.07 5.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.258 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.415 ' NE2' ' O ' ' A' ' 101' ' ' LYS . 0.7 OUTLIER -60.22 -33.66 72.57 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.654 179.524 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -56.4 -36.48 68.95 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 121.338 0.59 . . . . 0.0 109.44 178.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 1.022 HG22 ' HE1' ' A' ' 111' ' ' TYR . 6.9 mt -85.79 -51.65 13.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.002 178.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.667 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.38 -57.41 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.138 179.187 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 75.4 m -47.09 -26.03 0.99 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.162 179.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.449 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 71.0 mtt-85 -74.26 -25.05 59.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.146 179.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 1.022 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -75.85 -35.09 60.05 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.875 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.743 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.18 -43.69 18.96 Favored 'General case' 0 CA--C 1.506 -0.744 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 179.027 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -61.78 -31.33 71.52 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 113.862 -1.517 . . . . 0.0 109.064 178.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.449 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . . . . . . 0 N--CA 1.45 -0.457 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.64 178.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo . . . . . 0 N--CA 1.49 1.276 0 CA-C-O 121.17 0.404 . . . . 0.0 111.973 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.518 ' O ' HG21 ' A' ' 103' ' ' THR . 14.4 m -60.75 -31.36 70.7 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.901 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.518 ' HA ' HG21 ' A' ' 103' ' ' THR . 33.8 m80 -92.6 28.16 2.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.164 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.534 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 11.3 p -161.2 152.24 18.56 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.281 0.563 . . . . 0.0 111.111 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.432 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 173.95 137.76 2.51 Favored Glycine 0 N--CA 1.448 -0.509 0 N-CA-C 110.827 -0.909 . . . . 0.0 110.827 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.566 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -80.86 145.47 31.35 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -178.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.579 ' C ' HD13 ' A' ' 8' ' ' ILE . . . -151.98 171.18 18.23 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.358 -179.109 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.672 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -103.54 122.01 55.63 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.652 -179.668 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.472 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 4.6 t80 -120.75 106.98 12.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.877 0.37 . . . . 0.0 111.201 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.447 ' HG2' ' CD1' ' A' ' 9' ' ' PHE . 41.9 mm-40 67.98 49.09 0.92 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.864 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.4 mttp 72.25 -3.76 2.2 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.459 ' O ' HG23 ' A' ' 8' ' ' ILE . 19.9 t -101.21 150.3 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 CA-C-O 121.074 0.464 . . . . 0.0 110.458 179.563 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.427 ' HA ' HD12 ' A' ' 8' ' ' ILE . 95.8 p -107.12 114.86 29.18 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.877 -180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.517 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -134.0 -155.98 7.77 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.028 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.566 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 16.6 mm -122.83 131.96 72.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-O 120.872 0.367 . . . . 0.0 111.375 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.917 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.4 OUTLIER -100.94 113.67 37.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 177.752 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.534 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -122.18 116.61 24.48 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.553 0.692 . . . . 0.0 110.854 -179.177 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.477 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 17.5 mt -82.63 142.53 13.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 114.721 -1.127 . . . . 0.0 112.338 -178.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.594 ' O ' HG23 ' A' ' 22' ' ' VAL . 2.4 m120 -117.4 92.84 3.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.026 179.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.402 ' HB2' ' CD2' ' A' ' 3' ' ' HIS . 0.1 OUTLIER -82.64 -0.3 46.51 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.353 -179.733 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -83.38 1.3 42.02 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.442 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.594 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -100.87 -162.56 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.908 0.385 . . . . 0.0 110.988 -179.998 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 t -177.98 101.05 0.22 Allowed Pre-proline 0 C--N 1.327 -0.401 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.168 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.403 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 15.7 Cg_exo -66.34 161.62 73.7 Favored 'Cis proline' 0 C--N 1.346 0.408 0 C-N-CA 123.46 -1.475 . . . . 0.0 112.608 0.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.727 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -55.29 -172.38 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.872 179.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -163.27 142.15 8.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.486 0.66 . . . . 0.0 112.352 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.704 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 3.0 tt -108.37 149.13 29.12 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.829 -1.078 . . . . 0.0 108.744 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.57 HG23 HG23 ' A' ' 39' ' ' THR . 0.6 OUTLIER -146.35 104.11 3.76 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -178.798 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.489 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 83.3 t90 -92.06 110.54 21.91 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.777 178.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.474 ' O ' ' N ' ' A' ' 15' ' ' ILE . 42.8 ttt180 -109.66 131.18 55.3 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.777 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.3 t -49.85 155.99 0.79 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.688 0.28 . . . . 0.0 110.597 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.6 m -74.08 -34.63 64.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.317 0.579 . . . . 0.0 109.843 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -87.12 -16.58 35.07 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.054 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.78 33.75 10.86 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.333 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -86.9 -25.02 24.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.673 0.273 . . . . 0.0 111.476 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.17 164.22 2.7 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.285 0.564 . . . . 0.0 111.491 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.489 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.7 OUTLIER -145.64 147.93 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.508 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.961 -178.851 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.428 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 58.2 m80 -122.72 120.76 34.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.654 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.57 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.46 145.06 26.0 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.77 -179.884 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.704 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.1 t -128.49 139.03 52.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.624 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.438 ' O ' HG12 ' A' ' 45' ' ' ILE . 23.0 t -104.0 94.22 3.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 177.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.493 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.6 OUTLIER -42.22 -22.85 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.212 -0.449 . . . . 0.0 112.027 -178.783 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.403 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -76.79 -49.75 15.12 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 178.954 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.415 HG23 ' HB ' ' A' ' 41' ' ' VAL . 30.2 p -64.94 -28.22 69.38 Favored 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 178.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.895 HD12 ' HB3' ' A' ' 62' ' ' LEU . 31.3 mm -56.4 105.73 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.548 178.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -51.8 -31.72 28.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.188 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.451 ' HG3' HG12 ' A' ' 63' ' ' ILE . 3.2 pttt -172.61 166.94 5.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.574 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 1.069 HD23 HG21 ' B' ' 673' ' ' VAL . 11.9 tp -109.0 121.87 46.06 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.047 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.911 ' HG3' HD11 ' A' ' 63' ' ' ILE . 25.2 mm100 -110.41 138.34 46.93 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.289 179.495 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.716 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -156.85 140.27 15.75 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.61 0.243 . . . . 0.0 111.05 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.545 HG23 ' HB2' ' A' ' 59' ' ' MET . 33.5 p -50.16 140.36 17.05 Favored Pre-proline 0 CA--C 1.53 0.184 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.895 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -65.37 163.21 30.36 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.598 2.198 . . . . 0.0 112.53 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -71.63 -30.59 65.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.194 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.3 p -70.61 -21.86 62.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.913 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 70.0 m -97.03 119.17 35.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.868 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 21.0 mp0 -55.26 -18.99 7.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.499 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -55.17 125.51 20.91 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.894 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.4 ' HE3' ' HB2' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -109.51 93.3 4.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.732 -179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.545 ' HB2' HG23 ' A' ' 51' ' ' THR . 3.5 mpp? -149.64 138.65 21.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.656 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.716 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 39.0 mt -124.8 149.83 46.98 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.29 178.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.441 ' HD2' ' CE2' ' B' ' 670' ' ' PHE . 11.0 mtp180 -151.02 156.0 40.22 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.938 0.399 . . . . 0.0 111.604 -179.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.895 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -127.9 118.72 24.15 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.106 178.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.911 HD11 ' HG3' ' A' ' 49' ' ' GLN . 6.6 mm -77.29 153.93 5.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.775 0.321 . . . . 0.0 111.049 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -118.49 138.6 13.87 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.494 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.8 ptpm? -57.09 122.61 12.79 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.875 0.369 . . . . 0.0 110.903 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.489 HG22 ' N ' ' A' ' 67' ' ' ASP . 13.3 p -99.93 159.76 3.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.417 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.489 ' N ' HG22 ' A' ' 66' ' ' VAL . 4.2 m-20 -99.9 47.45 0.94 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.588 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.0 pt-20 -68.32 -11.39 59.43 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.478 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.3 m -53.98 -25.1 19.2 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.853 0.358 . . . . 0.0 111.087 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 42.3 mmtt -77.17 -70.18 0.48 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.668 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 3.9 ptmt 42.63 81.43 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.363 179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.403 ' CD ' ' N ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -145.47 -174.16 4.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.052 -179.945 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 78' ' ' ASN . 6.2 mptt -102.8 -171.29 1.93 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.959 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -113.94 -36.51 4.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.017 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 167.89 -30.3 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.149 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -97.02 29.21 3.19 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.238 -179.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 61.72 16.9 52.82 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.841 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.443 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 15.5 m-20 -67.2 -152.61 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.401 ' HG2' HG12 ' A' ' 81' ' ' VAL . 2.5 tt0 -153.28 118.97 5.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.769 0.319 . . . . 0.0 110.826 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.2 t -94.38 -66.9 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.439 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.455 ' O ' HG13 ' A' ' 81' ' ' VAL . 5.0 p 33.15 80.2 0.26 Allowed Pre-proline 0 CA--C 1.53 0.196 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.639 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -41.66 124.56 2.6 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 123.005 2.47 . . . . 0.0 112.844 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 31.4 mttt -73.21 159.9 83.94 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.908 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.422 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.3 Cg_exo -83.26 149.77 13.41 Favored 'Trans proline' 0 N--CA 1.46 -0.484 0 C-N-CA 123.52 2.814 . . . . 0.0 112.384 -179.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -112.83 115.93 29.25 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.916 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -123.11 137.53 54.89 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.768 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.497 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 7.5 m-70 -92.04 111.57 23.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.401 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 12.2 ttt -98.99 134.26 42.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.148 -179.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.917 ' CD2' HD11 ' A' ' 16' ' ' ILE . 2.7 m-85 -136.04 122.36 20.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.792 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -97.8 114.28 26.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.884 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.546 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 11.1 m-85 -91.35 145.18 24.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.88 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -99.24 34.83 2.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.605 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.674 ' HB3' HG23 ' A' ' 96' ' ' VAL . 1.1 m-20 -178.99 118.06 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.609 -179.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.423 ' HA ' ' CG ' ' A' ' 97' ' ' MET . 0.7 OUTLIER -60.06 -15.38 22.48 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.691 179.477 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.13 -43.07 58.88 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.066 0.46 . . . . 0.0 110.024 179.555 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.674 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -65.93 -51.76 57.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.295 179.061 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.423 ' CG ' ' HA ' ' A' ' 94' ' ' ARG . 0.5 OUTLIER -61.49 -36.32 80.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.285 179.372 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.406 ' HB2' ' O ' ' A' ' 94' ' ' ARG . 8.2 t70 -66.59 -34.23 77.43 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.112 0.482 . . . . 0.0 110.086 179.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.418 ' O ' ' OG1' ' A' ' 103' ' ' THR . 53.4 m-20 -81.82 -26.43 34.34 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.595 -0.729 . . . . 0.0 110.531 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.464 HD12 ' CG2' ' A' ' 16' ' ' ILE . 2.2 mm -86.15 -59.79 2.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.088 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.468 ' CG ' HG11 ' B' ' 673' ' ' VAL . 9.9 ttmt -44.51 -30.32 0.86 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.168 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.424 ' HG3' ' N ' ' A' ' 103' ' ' THR . 19.8 ptp -78.86 -39.29 35.68 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.326 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.518 HG21 ' O ' ' A' ' 2' ' ' SER . 0.3 OUTLIER -58.4 -60.07 4.36 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.846 179.737 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 1.06 HD13 HD11 ' A' ' 48' ' ' LEU . 2.7 mt -48.0 -57.43 5.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.912 179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.13 -41.43 79.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.969 179.523 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -54.67 -35.04 63.14 Favored 'General case' 0 C--O 1.231 0.132 0 CA-C-O 121.165 0.507 . . . . 0.0 110.337 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.04 HG22 ' HE1' ' A' ' 111' ' ' TYR . 11.9 mt -85.74 -51.03 13.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.468 179.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.656 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -42.45 -58.13 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.486 179.356 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -47.13 -27.52 1.44 Allowed 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.296 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.463 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 0.0 OUTLIER -73.38 -24.67 60.34 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.001 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 1.04 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -74.59 -34.96 62.98 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.425 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.765 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.63 -43.32 17.11 Favored 'General case' 0 CA--C 1.504 -0.804 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 179.38 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.404 ' HB2' ' HA ' ' A' ' 110' ' ' ARG . 1.2 m-20 -62.31 -32.06 72.75 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 113.973 -1.467 . . . . 0.0 108.99 178.193 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.463 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.69 -18.16 23.34 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.64 178.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 36.1 t0 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.236 -0.888 . . . . 0.0 111.127 179.914 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 36.2 t70 . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.858 0.361 . . . . 0.0 111.17 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -115.09 -38.38 3.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.906 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -177.36 95.67 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.929 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 664' ' ' VAL . . . . . 0.545 ' O ' HG13 ' B' ' 664' ' ' VAL . 11.0 p -142.64 59.89 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.045 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 665' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -132.26 -165.61 1.62 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.88 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 666' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -169.45 92.78 0.26 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.776 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 667' ' ' GLU . . . . . 0.445 ' HA ' ' CD1' ' B' ' 670' ' ' PHE . 0.3 OUTLIER -94.1 19.09 9.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.18 0.514 . . . . 0.0 111.641 -179.947 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -105.83 -19.96 13.59 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.248 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.583 ' O ' HD12 ' B' ' 669' ' ' LEU . 4.5 pp -100.28 19.9 15.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.311 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 670' ' ' PHE . . . . . 0.445 ' CD1' ' HA ' ' B' ' 667' ' ' GLU . 7.7 m-85 -78.75 140.63 38.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.861 0.362 . . . . 0.0 110.903 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -126.68 171.07 11.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.878 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 16.3 p-10 -104.14 131.93 50.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.918 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 673' ' ' VAL . . . . . 1.069 HG21 HD23 ' A' ' 48' ' ' LEU . 12.0 m -75.13 155.61 86.21 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.044 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -71.1 128.26 14.58 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.521 2.147 . . . . 0.0 112.605 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -139.06 126.25 21.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.566 179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 10.7 mttm -48.34 155.97 0.45 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.213 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 49.6 m 61.58 155.25 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.915 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 52.3 mm-40 -148.06 85.84 1.55 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.876 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 679' ' ' ILE . . . . . 0.579 HG22 ' O ' ' B' ' 679' ' ' ILE . 3.9 mt -95.75 43.28 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.051 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 1.8 t . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.926 179.97 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo . . . . . 0 N--CA 1.488 1.193 0 CA-C-O 120.794 0.247 . . . . 0.0 111.638 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.4 p -96.39 -37.55 10.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.88 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.5 m170 -92.97 12.81 22.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.221 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.575 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 49.7 p -156.3 152.85 28.18 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.193 0.52 . . . . 0.0 111.503 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.524 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . -174.91 179.93 45.9 Favored Glycine 0 N--CA 1.448 -0.562 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.521 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -120.6 129.27 53.68 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 117.738 0.769 . . . . 0.0 111.459 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.707 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -141.41 171.15 14.45 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.889 -178.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.652 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -100.61 121.92 51.98 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.018 179.853 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.47 ' HB2' ' CE2' ' A' ' 29' ' ' TRP . 0.7 OUTLIER -120.26 106.02 11.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.03 0.443 . . . . 0.0 111.86 179.531 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 68.16 52.71 0.65 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.562 178.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 71.19 -4.25 1.85 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.913 179.552 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.471 ' O ' HG23 ' A' ' 8' ' ' ILE . 25.2 t -103.52 148.56 8.34 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.566 0 CA-C-O 121.239 0.542 . . . . 0.0 110.527 179.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.481 ' HA ' HD12 ' A' ' 8' ' ' ILE . 1.0 OUTLIER -115.32 113.76 24.25 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.086 -179.962 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.855 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -133.63 -122.22 2.27 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.922 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.855 HD13 ' O ' ' A' ' 14' ' ' GLY . 18.7 mm -141.74 136.58 31.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.766 0.317 . . . . 0.0 111.146 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.913 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.82 141.76 16.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 106.301 -1.74 . . . . 0.0 106.301 176.543 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.575 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.32 115.73 5.09 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.393 -0.923 . . . . 0.0 111.55 -178.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.894 HD13 HG22 ' A' ' 103' ' ' THR . 5.0 mt -86.68 132.3 32.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.908 -178.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.595 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -110.72 92.82 4.2 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.265 179.45 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -81.39 0.51 37.06 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.517 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -82.55 0.69 41.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.259 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.595 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -101.9 -162.93 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.885 0.374 . . . . 0.0 110.88 -179.981 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.3 p -174.75 101.51 0.27 Allowed Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.333 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.463 ' HB3' ' HB3' ' A' ' 43' ' ' SER . 11.3 Cg_exo -69.52 166.34 73.67 Favored 'Cis proline' 0 C--N 1.347 0.474 0 C-N-CA 123.604 -1.415 . . . . 0.0 112.562 0.467 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.551 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -61.07 176.67 0.4 Allowed 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.143 179.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.476 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.78 135.07 4.65 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.24 179.326 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.791 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.96 129.43 55.11 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 178.88 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.791 HG22 ' CG2' ' A' ' 37' ' ' VAL . 0.3 OUTLIER -113.36 110.41 20.29 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -178.653 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.57 ' HD1' HG13 ' A' ' 16' ' ' ILE . 72.7 t90 -91.77 113.56 25.86 Favored 'General case' 0 N--CA 1.443 -0.788 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.505 ' O ' ' N ' ' A' ' 15' ' ' ILE . 2.6 ptm180 -114.21 134.61 54.8 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.914 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.461 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 0.2 OUTLIER -49.9 168.5 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.47 179.868 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 54.8 m -76.98 -39.08 51.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.347 0.594 . . . . 0.0 109.903 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -84.85 -14.91 46.49 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.178 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.81 33.89 12.09 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.383 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -83.19 -29.84 28.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.752 0.311 . . . . 0.0 111.332 -179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.0 157.54 18.56 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.344 0.592 . . . . 0.0 111.349 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.791 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.9 OUTLIER -145.73 130.34 12.03 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.718 -178.823 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.461 ' CB ' ' CE2' ' A' ' 9' ' ' PHE . 2.7 m80 -107.71 122.76 47.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.944 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.659 HG23 HG23 ' A' ' 28' ' ' THR . 0.3 OUTLIER -96.51 129.83 43.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.794 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.531 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -117.4 139.9 42.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.338 -179.649 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.749 HG12 ' OG ' ' A' ' 43' ' ' SER . 2.8 t -103.88 95.86 4.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 177.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.793 HD11 HD22 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -42.13 -24.8 0.05 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.062 -178.919 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.749 ' OG ' HG12 ' A' ' 41' ' ' VAL . 3.1 p -74.94 -48.75 22.87 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 179.236 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.474 HG23 ' HB ' ' A' ' 41' ' ' VAL . 44.9 p -64.71 -28.01 69.31 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.87 HD12 ' HB3' ' A' ' 62' ' ' LEU . 33.8 mm -57.15 105.69 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.533 178.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.474 ' N ' ' O ' ' A' ' 63' ' ' ILE . 2.6 t0 -47.87 -33.55 7.63 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.805 0.336 . . . . 0.0 111.071 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.415 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 0.2 OUTLIER -172.47 163.39 5.48 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.805 179.63 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.859 HD11 HD13 ' A' ' 104' ' ' LEU . 14.0 tp -109.11 124.85 51.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.01 -179.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.495 ' CD ' HD11 ' A' ' 63' ' ' ILE . 17.2 mt-30 -119.99 144.93 47.23 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.611 179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.666 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.06 147.88 21.63 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.7 -0.227 . . . . 0.0 110.793 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.409 HG23 ' HB2' ' A' ' 59' ' ' MET . 71.2 p -75.04 146.19 82.0 Favored Pre-proline 0 C--N 1.333 -0.135 0 CA-C-O 120.741 0.305 . . . . 0.0 111.144 -179.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -76.3 163.35 32.62 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.681 2.254 . . . . 0.0 112.446 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.518 ' HB1' ' NH1' ' A' ' 94' ' ' ARG . . . -54.47 -23.93 18.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.419 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.7 t -70.69 -16.17 62.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.416 -0.357 . . . . 0.0 111.214 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 11.7 m -73.86 121.44 20.92 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.902 0.382 . . . . 0.0 110.995 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -63.87 -11.29 26.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.696 179.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.682 ' HE2' HD11 ' B' ' 669' ' ' LEU . 0.0 OUTLIER -138.63 85.44 2.08 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.064 0.459 . . . . 0.0 111.174 179.825 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.423 ' HG2' ' HB2' ' A' ' 91' ' ' PHE . 1.0 OUTLIER -47.52 134.89 11.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.698 -179.812 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.426 ' HG3' ' O ' ' A' ' 57' ' ' LYS . 24.0 mtm -150.09 138.52 20.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.432 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.666 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 20.9 mt -117.8 142.19 47.57 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.225 178.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.443 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 13.8 ttm180 -142.51 150.01 39.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.984 0.421 . . . . 0.0 111.846 -179.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.87 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -128.4 117.32 21.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.949 178.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.861 HG23 ' HG2' ' A' ' 86' ' ' ARG . 10.3 mm -76.47 146.07 9.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.764 -179.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -108.7 148.59 16.86 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.386 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.5 mttt -58.01 114.74 2.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.873 0.368 . . . . 0.0 110.936 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.48 HG22 ' N ' ' A' ' 67' ' ' ASP . 13.2 p -102.41 159.93 4.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.258 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.48 ' N ' HG22 ' A' ' 66' ' ' VAL . 5.2 m-20 -101.13 39.39 1.41 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.772 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.41 -23.03 64.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.113 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.1 t -60.39 -20.41 59.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.105 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 mmtt -83.24 -67.32 0.8 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.867 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.437 ' HG3' HG23 ' A' ' 81' ' ' VAL . 28.3 mttt 60.17 92.35 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.764 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.74 -179.02 4.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.065 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 3.8 mttp -131.82 -167.2 1.83 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.708 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -136.86 -178.67 5.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.893 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -57.32 -22.09 39.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.408 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -108.73 34.8 3.48 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.855 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 55.22 25.22 39.23 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.558 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -67.42 -169.95 0.12 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.797 0.332 . . . . 0.0 110.903 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -136.62 122.01 19.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.637 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.6 t -91.1 -64.91 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.357 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.437 HG23 ' HG3' ' A' ' 71' ' ' LYS . 4.4 p 34.85 78.09 0.35 Allowed Pre-proline 0 CA--C 1.531 0.212 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.958 179.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -42.73 125.31 3.79 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 123.125 2.55 . . . . 0.0 112.648 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.402 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -60.59 161.42 14.53 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.076 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 5.0 Cg_exo -83.61 153.38 13.52 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 123.578 2.852 . . . . 0.0 112.363 -179.152 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -111.16 114.03 26.97 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.902 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.861 ' HG2' HG23 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -119.03 146.44 45.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.734 -179.951 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.47 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 31.4 m-70 -96.87 112.56 24.26 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.458 ' HE2' ' CZ ' ' B' ' 670' ' ' PHE . 0.0 OUTLIER -94.09 119.17 32.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.97 0.414 . . . . 0.0 111.391 -179.236 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.913 ' CD1' HD11 ' A' ' 16' ' ' ILE . 89.7 m-85 -122.94 116.75 24.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.58 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.416 ' HB3' ' HB ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.52 114.57 28.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.785 0.326 . . . . 0.0 110.628 179.936 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.707 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 30.7 m-85 -93.5 152.63 18.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.371 -179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.3 m-80 -110.39 28.47 8.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.603 179.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.458 ' CB ' HG23 ' A' ' 96' ' ' VAL . 9.0 m-20 -171.59 112.16 0.33 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.635 -179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.518 ' NH1' ' HB1' ' A' ' 53' ' ' ALA . 2.5 ttp85 -55.87 -19.48 11.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.911 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.22 -47.35 61.81 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.684 179.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.466 HG11 ' H ' ' A' ' 6' ' ' ALA . 0.2 OUTLIER -66.67 -46.1 86.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.451 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -63.27 -36.35 83.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.918 179.329 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.451 ' N ' ' HG3' ' A' ' 97' ' ' MET . 11.0 m-20 -62.6 -34.14 76.4 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.148 0.499 . . . . 0.0 110.047 179.19 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 45.1 m-20 -81.84 -35.06 29.8 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.527 179.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.612 HG23 HD11 ' A' ' 18' ' ' ILE . 9.4 mm -76.45 -59.83 2.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.717 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.536 ' HD3' HG11 ' B' ' 673' ' ' VAL . 5.8 ttmt -51.62 -29.69 18.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.148 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.42 ' HG3' ' N ' ' A' ' 103' ' ' THR . 9.4 ptp -82.49 -37.98 24.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.92 -179.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.894 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -70.29 -42.09 72.52 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.018 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.859 HD13 HD11 ' A' ' 48' ' ' LEU . 28.4 mt -55.14 -52.1 64.34 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.016 0.436 . . . . 0.0 110.017 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.445 ' NE2' HG21 ' B' ' 673' ' ' VAL . 0.0 OUTLIER -61.41 -46.22 91.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.26 179.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 -47.06 -34.14 5.55 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.12 0.485 . . . . 0.0 110.864 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.047 HG22 ' HE1' ' A' ' 111' ' ' TYR . 12.3 mt -85.62 -52.27 12.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.264 179.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.755 HG21 HG21 ' B' ' 675' ' ' THR . 0.9 OUTLIER -42.48 -57.65 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.497 179.323 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -47.55 -26.06 1.32 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.347 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.455 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 0.0 OUTLIER -75.69 -24.8 56.29 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.925 179.865 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 1.047 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -73.69 -34.35 64.83 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 179.233 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.757 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.53 -43.24 17.37 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 179.058 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -62.01 -32.16 72.62 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 113.898 -1.501 . . . . 0.0 109.022 178.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.455 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.72 -18.61 22.75 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.611 178.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 38.2 t70 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.198 -0.906 . . . . 0.0 111.106 179.928 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 661' ' ' ASP . . . . . 0.716 ' C ' HD22 ' B' ' 662' ' ' LEU . 4.2 p-10 . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.863 0.363 . . . . 0.0 111.173 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 662' ' ' LEU . . . . . 0.716 HD22 ' C ' ' B' ' 661' ' ' ASP . 3.8 mm? -129.73 37.67 3.93 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.917 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -176.36 79.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.933 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 10.6 t 66.09 95.72 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.026 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 665' ' ' LEU . . . . . 0.445 HD23 ' N ' ' B' ' 666' ' ' SER . 1.2 tt -61.93 115.58 4.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.191 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 666' ' ' SER . . . . . 0.445 ' N ' HD23 ' B' ' 665' ' ' LEU . 19.2 p 47.16 83.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.485 179.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 6.1 tm-20 -94.3 18.93 10.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.081 0.467 . . . . 0.0 111.398 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -106.03 -15.68 14.83 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.473 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.682 HD11 ' HE2' ' A' ' 57' ' ' LYS . 2.7 pp -120.28 19.83 12.07 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.637 0.256 . . . . 0.0 111.253 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 670' ' ' PHE . . . . . 0.458 ' CZ ' ' HE2' ' A' ' 88' ' ' MET . 1.1 m-85 -84.32 122.12 28.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.931 0.396 . . . . 0.0 110.967 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -94.02 159.56 15.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.853 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -113.67 101.52 9.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.859 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 673' ' ' VAL . . . . . 0.551 HG21 HD23 ' A' ' 48' ' ' LEU . 27.0 m -57.34 132.37 81.29 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.907 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.86 153.66 77.21 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.554 2.169 . . . . 0.0 112.681 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 675' ' ' THR . . . . . 0.755 HG21 HG21 ' A' ' 108' ' ' ILE . 12.5 p -139.01 116.89 11.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.834 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -179.35 165.98 1.45 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.967 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -94.36 179.91 5.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.903 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -177.96 89.83 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.884 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 679' ' ' ILE . . . . . 0.589 HG22 ' O ' ' B' ' 679' ' ' ILE . 2.7 mt 63.71 36.22 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.031 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.843 -179.948 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo . . . . . 0 N--CA 1.488 1.165 0 CA-C-O 120.843 0.268 . . . . 0.0 111.814 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.687 ' O ' HG21 ' A' ' 103' ' ' THR . 0.3 OUTLIER -102.88 -37.51 7.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.915 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.414 ' O ' ' N ' ' A' ' 18' ' ' ILE . 34.6 m170 -81.49 17.91 1.29 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.529 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.566 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 4.0 p -152.67 153.89 34.2 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.125 0.488 . . . . 0.0 111.333 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.502 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 172.07 138.93 2.67 Favored Glycine 0 C--O 1.225 -0.421 0 N-CA-C 110.731 -0.948 . . . . 0.0 110.731 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.565 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -83.13 145.98 28.91 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -178.5 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.58 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -157.5 171.27 20.67 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.162 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.68 HD12 ' HA ' ' A' ' 13' ' ' SER . 5.2 mm -101.24 127.58 54.37 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.477 ' CZ ' ' CD2' ' A' ' 38' ' ' HIS . 5.9 t80 -124.39 108.23 11.95 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.996 0.427 . . . . 0.0 111.041 178.046 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 6.8 mm-40 68.67 49.2 0.74 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.829 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp 72.82 -6.25 1.7 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.175 -0.466 . . . . 0.0 112.135 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.529 ' O ' HG23 ' A' ' 8' ' ' ILE . 14.3 t -101.04 144.91 12.21 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.497 0 CA-C-O 121.219 0.533 . . . . 0.0 110.562 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.68 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -99.16 114.18 26.81 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.938 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -136.46 -170.42 11.98 Favored Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.886 -0.673 . . . . 0.0 111.846 179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.565 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 14.5 mm -105.76 136.11 41.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 120.788 0.327 . . . . 0.0 111.186 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.826 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.51 140.62 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 176.962 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.566 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.3 117.9 5.74 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.716 -0.794 . . . . 0.0 111.554 -178.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.632 HD12 ' HB ' ' A' ' 103' ' ' THR . 22.5 mt -82.02 142.81 13.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 114.461 -1.245 . . . . 0.0 112.184 -178.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.67 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.6 t30 -118.2 92.82 3.92 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.972 179.14 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.29 -0.82 42.61 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.314 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -82.45 0.62 41.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.661 0.267 . . . . 0.0 111.184 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.67 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.46 -162.34 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-O 120.824 0.345 . . . . 0.0 110.654 179.994 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.1 t -176.29 101.6 0.24 Allowed Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.4 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.45 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 9.7 Cg_exo -70.98 161.37 89.87 Favored 'Cis proline' 0 C--N 1.347 0.492 0 C-N-CA 123.682 -1.382 . . . . 0.0 112.673 0.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.456 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -54.64 178.23 0.03 OUTLIER 'General case' 0 CA--C 1.518 -0.25 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.498 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.525 ' HG2' HG21 ' A' ' 22' ' ' VAL . 7.9 pt-20 -163.63 135.18 4.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.135 179.015 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.802 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.9 130.44 55.02 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.123 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.471 HG22 ' CG2' ' A' ' 37' ' ' VAL . 10.4 m -113.46 113.06 24.63 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.496 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 73.2 t90 -91.92 110.38 21.73 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 178.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 13.8 ttt180 -106.25 131.0 54.0 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.838 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 45.7 m -49.96 153.89 1.24 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.706 0.289 . . . . 0.0 110.562 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 18.8 m -72.97 -33.69 66.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.281 0.563 . . . . 0.0 109.7 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -87.96 -17.16 31.9 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.002 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.89 33.61 10.88 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.31 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -88.48 -24.39 22.98 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.645 0.259 . . . . 0.0 111.485 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.04 166.61 2.98 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.383 0.611 . . . . 0.0 111.465 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.496 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.6 OUTLIER -143.66 155.48 16.2 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.919 -178.865 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.477 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 37.8 m80 -130.15 119.39 22.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.695 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.43 129.05 43.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.763 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.577 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -116.78 139.72 42.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.379 -179.543 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.429 ' HB ' HG23 ' A' ' 44' ' ' THR . 25.3 t -103.97 95.37 3.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 177.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.72 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -42.59 -23.95 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.953 -178.849 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.45 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.8 OUTLIER -76.42 -48.15 20.71 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 179.257 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.429 HG23 ' HB ' ' A' ' 41' ' ' VAL . 34.8 p -64.53 -27.84 69.24 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.823 HD12 ' HB3' ' A' ' 62' ' ' LEU . 48.0 mm -56.46 110.56 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.548 178.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 63' ' ' ILE . 9.0 t0 -54.34 -31.65 54.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.794 0.33 . . . . 0.0 110.935 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.424 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 10.8 pttt -172.66 164.34 5.36 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.827 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 1.049 HD11 HD13 ' A' ' 104' ' ' LEU . 18.8 tp -109.02 117.35 33.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.409 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -113.2 147.45 37.43 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.551 0.215 . . . . 0.0 110.691 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.652 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.2 152.01 25.68 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.662 -0.244 . . . . 0.0 111.162 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.515 HG23 ' HB2' ' A' ' 59' ' ' MET . 17.7 p -70.89 154.81 94.07 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-O 120.796 0.331 . . . . 0.0 111.168 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.32 163.31 34.88 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.731 2.287 . . . . 0.0 112.514 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.08 -24.86 60.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.431 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.1 t -92.33 18.17 8.73 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.239 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.9 t -80.06 124.18 28.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.946 0.403 . . . . 0.0 111.177 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -61.66 -14.97 35.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.383 179.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.829 ' HE2' HD11 ' B' ' 669' ' ' LEU . 0.0 OUTLIER -145.47 104.98 3.96 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 121.109 0.48 . . . . 0.0 111.131 179.597 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.405 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 1.8 mpt? -56.19 127.94 33.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.153 -179.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.515 ' HB2' HG23 ' A' ' 51' ' ' THR . 37.9 mtm -149.81 138.3 20.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.033 0.444 . . . . 0.0 111.73 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.652 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 17.2 mt -122.11 141.96 50.87 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.572 178.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 87' ' ' HIS . 42.1 ttp180 -142.48 150.74 40.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.104 0.478 . . . . 0.0 112.284 -178.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.823 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.6 mp -128.15 115.51 18.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.565 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.424 ' HB ' ' HG2' ' A' ' 47' ' ' LYS . 7.8 mm -76.42 156.5 5.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.623 0.249 . . . . 0.0 111.046 -179.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -109.38 138.54 14.85 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.498 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.4 mttm -68.52 115.79 8.33 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.88 0.371 . . . . 0.0 110.94 -179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.537 HG22 ' N ' ' A' ' 67' ' ' ASP . 13.1 p -87.21 162.44 2.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.994 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.537 ' N ' HG22 ' A' ' 66' ' ' VAL . 11.6 p30 -130.31 51.55 2.1 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.697 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.793 ' HA ' HG13 ' A' ' 81' ' ' VAL . 6.1 pt-20 -64.63 -16.44 62.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.401 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.1 m -105.81 33.61 3.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.904 0.383 . . . . 0.0 110.793 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.76 -40.78 0.69 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.967 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.3 mttp 63.45 95.44 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.955 0.407 . . . . 0.0 110.771 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.39 133.84 40.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.984 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.415 ' CG ' ' HA2' ' A' ' 77' ' ' GLY . 0.0 OUTLIER -68.28 149.21 49.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.131 -179.856 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.403 ' O ' ' CB ' ' A' ' 75' ' ' ASN . 0.6 OUTLIER -94.37 -36.19 12.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.834 179.793 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . 0.403 ' CB ' ' O ' ' A' ' 74' ' ' ASP . 0.7 OUTLIER 165.41 -28.42 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.115 179.798 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -116.55 30.78 7.13 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.385 -179.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.415 ' HA2' ' CG ' ' A' ' 73' ' ' LYS . . . 54.93 29.4 51.03 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.569 -0.824 . . . . 0.0 112.576 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -78.48 -0.86 31.06 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 55.64 108.81 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.821 0.343 . . . . 0.0 111.625 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 7.6 t -115.24 142.38 28.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.386 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.793 HG13 ' HA ' ' A' ' 68' ' ' GLU . 96.3 t -112.41 83.96 5.79 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.467 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -44.36 142.62 4.24 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.714 2.276 . . . . 0.0 112.489 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.5 mttt -89.32 164.96 28.22 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.018 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_exo -79.85 80.31 3.1 Favored 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 123.624 2.882 . . . . 0.0 112.019 -179.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -57.49 172.57 0.33 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.376 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.67 134.97 2.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.476 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.485 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 7.1 m-70 -95.9 111.65 23.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.783 0.325 . . . . 0.0 110.501 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.435 ' CE ' ' CZ ' ' B' ' 670' ' ' PHE . 3.8 ttt -93.95 137.85 32.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.98 -179.546 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.826 ' CD1' HD11 ' A' ' 16' ' ' ILE . 87.9 m-85 -136.26 116.88 13.89 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.938 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.551 ' HB2' HG12 ' A' ' 8' ' ' ILE . 1.1 m -91.0 114.74 27.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.827 0.346 . . . . 0.0 110.64 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.47 ' CE2' HG13 ' A' ' 100' ' ' ILE . 9.3 m-85 -92.62 135.78 33.79 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.569 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -101.75 31.03 4.02 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.475 179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.454 ' CB ' HG23 ' A' ' 96' ' ' VAL . 4.6 m-20 -176.42 120.68 0.15 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.757 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.485 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -59.89 -16.66 31.06 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.67 179.544 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -74.37 -50.75 17.38 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 120.95 0.405 . . . . 0.0 110.402 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.454 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -66.22 -40.13 86.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.687 179.323 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.485 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -68.41 -37.97 80.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.038 179.531 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.427 ' N ' ' HG3' ' A' ' 97' ' ' MET . 17.8 t0 -65.9 -26.67 67.72 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.238 -0.437 . . . . 0.0 109.998 178.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.425 ' O ' ' OG1' ' A' ' 103' ' ' THR . 79.7 m-20 -81.66 -65.71 0.98 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.412 179.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.715 HG22 HD11 ' A' ' 104' ' ' LEU . 15.1 mm -48.28 -57.87 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.17 0 CA-C-O 121.115 0.483 . . . . 0.0 110.623 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.63 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 17.2 ttpp -46.77 -39.18 11.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.983 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 30.3 mtm -78.01 -43.75 28.58 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.497 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.687 HG21 ' O ' ' A' ' 2' ' ' SER . 0.2 OUTLIER -56.96 -53.61 56.03 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.084 -179.991 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 1.049 HD13 HD11 ' A' ' 48' ' ' LEU . 3.4 mt -49.99 -53.27 27.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.993 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -56.87 -46.28 81.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.007 179.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -49.9 -35.04 22.22 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 121.176 0.512 . . . . 0.0 110.3 179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.036 HG22 ' HE1' ' A' ' 111' ' ' TYR . 10.2 mt -85.66 -51.83 12.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.379 179.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.686 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.28 -57.2 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.37 179.338 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -46.95 -28.22 1.54 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.253 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.538 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.0 OUTLIER -72.89 -24.89 60.91 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.28 179.896 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 1.036 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -75.08 -34.79 61.82 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.665 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.76 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.47 -43.68 16.94 Favored 'General case' 0 CA--C 1.505 -0.752 0 N-CA-C 107.918 -1.142 . . . . 0.0 107.918 179.114 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -61.39 -31.36 71.27 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 113.883 -1.508 . . . . 0.0 109.027 178.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.456 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.6 -21.26 20.16 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.56 178.707 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.891 179.866 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.787 0.327 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 1.7 tp -173.99 87.53 0.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.87 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -176.89 95.49 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.963 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 664' ' ' VAL . . . . . 0.532 HG12 ' O ' ' B' ' 664' ' ' VAL . 16.6 t -150.88 40.59 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.071 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 665' ' ' LEU . . . . . 0.421 HD22 ' HA ' ' B' ' 665' ' ' LEU . 0.3 OUTLIER -131.25 175.84 8.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.845 -179.986 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 666' ' ' SER . . . . . . . . . . . . . 1.4 t -177.61 96.6 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.721 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -94.09 19.16 9.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.179 0.514 . . . . 0.0 111.541 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -97.38 -4.81 37.7 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.318 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.829 HD11 ' HE2' ' A' ' 57' ' ' LYS . 0.8 OUTLIER -120.28 20.0 12.04 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.136 179.912 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 670' ' ' PHE . . . . . 0.435 ' CZ ' ' CE ' ' A' ' 88' ' ' MET . 4.0 m-85 -81.45 122.13 27.13 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.802 0.334 . . . . 0.0 110.914 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -100.95 140.95 34.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.868 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -82.43 113.08 19.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.887 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 673' ' ' VAL . . . . . 0.85 HG22 ' O ' ' A' ' 48' ' ' LEU . 34.2 m -57.53 153.93 26.83 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.086 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -72.44 128.2 13.36 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.581 2.187 . . . . 0.0 112.316 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 1.5 p -139.09 139.5 37.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.854 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 5.6 mmtt -55.5 166.12 0.69 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.149 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 8.7 t -170.26 -39.36 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.019 0.438 . . . . 0.0 111.021 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 63.38 127.53 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.956 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 679' ' ' ILE . . . . . 0.56 HG22 ' O ' ' B' ' 679' ' ' ILE . 4.3 mt -116.36 45.33 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.982 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 20.9 t . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.902 -179.985 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo . . . . . 0 N--CA 1.489 1.217 0 CA-C-O 120.881 0.284 . . . . 0.0 111.781 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -88.74 -30.23 19.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.944 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.2 m170 -94.62 24.7 4.44 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.156 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.535 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 8.1 p -161.52 159.76 28.27 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.199 0.523 . . . . 0.0 111.37 179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 16' ' ' ILE . . . 168.32 136.84 2.12 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.109 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.567 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -80.83 142.48 33.64 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -178.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.656 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -148.08 171.31 16.05 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.402 -179.145 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.678 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -104.1 122.64 57.17 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.439 -179.766 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.469 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 5.1 t80 -122.77 107.64 12.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.942 0.401 . . . . 0.0 111.153 178.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 8.0 mt-10 68.34 48.4 0.88 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.92 179.11 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.9 mttm 73.15 -4.73 2.11 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.451 ' O ' HG23 ' A' ' 8' ' ' ILE . 18.9 t -100.91 149.45 6.25 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.444 0 CA-C-O 121.094 0.473 . . . . 0.0 110.54 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.402 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -110.42 114.03 27.14 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.553 -0.748 . . . . 0.0 110.8 179.834 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.862 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -130.91 -138.19 4.23 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.206 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.862 HD13 ' O ' ' A' ' 14' ' ' GLY . 15.4 mm -135.64 131.87 51.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.725 0.298 . . . . 0.0 111.551 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.865 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -101.33 115.54 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 177.524 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.535 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -125.36 116.1 21.36 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.589 0.709 . . . . 0.0 110.936 -179.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.881 HD13 HG22 ' A' ' 103' ' ' THR . 7.2 mt -82.25 142.74 13.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.824 -178.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.596 ' O ' HG23 ' A' ' 22' ' ' VAL . 2.4 m120 -117.66 93.92 4.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.368 179.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.403 ' CG ' HG12 ' A' ' 107' ' ' ILE . 1.2 tm-20 -81.61 -0.16 41.13 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.397 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -83.64 1.36 42.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.561 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.596 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -100.55 -162.48 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.959 0.409 . . . . 0.0 111.045 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.6 t -176.86 101.04 0.23 Allowed Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.32 179.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.427 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 38.1 Cg_endo -67.98 161.87 79.35 Favored 'Cis proline' 0 C--N 1.347 0.457 0 C-N-CA 123.349 -1.521 . . . . 0.0 112.422 0.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.562 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -53.48 -174.71 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.868 179.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -161.23 144.09 12.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.564 0.697 . . . . 0.0 112.312 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.707 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 3.0 tt -108.25 149.14 29.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.753 -1.112 . . . . 0.0 108.541 178.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.1 m -147.42 104.65 3.66 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.168 -0.613 . . . . 0.0 112.557 -178.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.499 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 84.9 t90 -92.02 110.44 21.81 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.727 178.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.479 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.5 ttm180 -110.69 130.59 55.53 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.925 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.3 t -49.86 156.81 0.67 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.66 0.267 . . . . 0.0 110.533 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.416 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 28.4 m -74.52 -35.71 63.18 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.438 0.637 . . . . 0.0 109.817 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -85.6 -16.01 40.69 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.119 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.62 34.22 12.03 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.358 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -87.37 -24.37 24.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.706 0.289 . . . . 0.0 111.54 -179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.27 163.01 2.5 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.293 0.568 . . . . 0.0 111.521 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.499 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.7 148.58 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.033 -178.864 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 76.6 m-70 -123.58 120.08 31.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.61 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.49 146.42 24.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.856 0.36 . . . . 0.0 110.934 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.707 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.2 t -131.17 139.13 51.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.494 -179.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.416 HG12 ' HB3' ' A' ' 43' ' ' SER . 46.4 t -103.95 95.91 4.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 177.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.909 HD11 ' CD2' ' A' ' 104' ' ' LEU . 1.1 mm? -42.46 -22.2 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -178.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.427 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 2.1 t -77.21 -48.26 18.05 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 43.2 p -64.95 -28.11 69.3 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.85 HD12 ' HB3' ' A' ' 62' ' ' LEU . 46.1 mm -56.6 108.63 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.648 178.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.428 ' N ' ' O ' ' A' ' 63' ' ' ILE . 1.6 t0 -54.15 -31.81 53.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.886 0.374 . . . . 0.0 110.971 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.427 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 0.7 OUTLIER -171.67 164.59 6.69 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.75 179.814 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.862 HD11 HD13 ' A' ' 104' ' ' LEU . 11.4 tp -109.05 118.22 36.22 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.874 -179.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.482 ' O ' ' N ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -108.75 139.12 44.01 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.299 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.716 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -156.86 143.92 18.7 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.759 0.314 . . . . 0.0 111.291 -179.551 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.419 ' CG2' ' HB2' ' A' ' 59' ' ' MET . 7.0 p -58.97 144.11 82.7 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.414 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -80.52 163.51 21.61 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.888 2.392 . . . . 0.0 112.433 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -54.98 -23.14 17.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.529 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 14.9 t -93.15 18.16 9.83 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.395 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.408 ' CB ' ' HB ' ' A' ' 51' ' ' THR . 2.0 t -84.04 125.42 32.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.867 0.365 . . . . 0.0 111.277 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -57.3 -18.73 18.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.077 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.466 ' HE2' HD11 ' B' ' 669' ' ' LEU . 0.0 OUTLIER -142.44 166.08 25.65 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.758 179.3 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.467 ' HG2' ' CA ' ' A' ' 94' ' ' ARG . 2.2 mpt? -100.4 126.74 46.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.898 0.38 . . . . 0.0 111.235 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.624 ' HG3' ' HA ' ' A' ' 90' ' ' SER . 0.0 OUTLIER -149.95 137.88 20.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.572 -179.859 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.716 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 29.6 mt -127.8 148.89 50.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.971 178.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.482 ' N ' ' O ' ' A' ' 49' ' ' GLN . 12.6 ttt180 -153.17 152.4 31.2 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -179.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.85 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.4 mp -128.21 116.73 20.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.717 178.224 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.625 HG23 ' HG2' ' A' ' 86' ' ' ARG . 19.0 mm -76.59 156.72 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.723 0.297 . . . . 0.0 111.257 -179.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.435 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -123.38 127.72 6.71 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.31 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.29 125.77 24.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.91 0.386 . . . . 0.0 111.053 -179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.492 HG22 ' N ' ' A' ' 67' ' ' ASP . 12.2 p -102.52 161.29 4.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.319 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.492 ' N ' HG22 ' A' ' 66' ' ' VAL . 11.6 p-10 -122.29 53.2 1.25 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.661 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -62.95 -15.14 54.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.464 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.0 t -53.38 -25.04 13.93 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.948 0.404 . . . . 0.0 111.24 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.7 mmtm -74.12 -69.1 0.47 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.693 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.1 ptpt 42.57 81.13 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.419 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.429 ' NH1' HG11 ' A' ' 80' ' ' VAL . 0.0 OUTLIER -148.76 -175.94 5.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.16 179.944 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.41 ' HG3' ' O ' ' A' ' 78' ' ' ASN . 0.0 OUTLIER -108.44 -173.14 2.2 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.898 -179.736 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -105.79 -41.19 5.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.987 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 168.17 -31.32 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.05 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -98.5 39.3 1.26 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.003 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 59.5 18.8 45.55 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.64 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.41 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 16.5 m-80 -61.58 -156.45 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 110.46 -0.2 . . . . 0.0 110.46 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -162.22 114.43 1.69 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.803 0.335 . . . . 0.0 110.767 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.799 HG12 ' HD3' ' A' ' 82' ' ' PRO . 42.8 t -96.3 -69.94 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.494 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.5 HG22 ' O ' ' A' ' 81' ' ' VAL . 4.1 p 35.46 70.55 0.97 Allowed Pre-proline 0 CA--C 1.53 0.203 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.584 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.799 ' HD3' HG12 ' A' ' 80' ' ' VAL . 4.7 Cg_exo -40.18 128.79 2.25 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 123.435 2.757 . . . . 0.0 112.76 -179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.9 pttm -94.98 164.7 18.71 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.946 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.455 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 4.3 Cg_exo -81.07 111.54 2.45 Favored 'Trans proline' 0 N--CA 1.461 -0.389 0 C-N-CA 123.603 2.869 . . . . 0.0 112.255 -179.117 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 14.8 mt-30 -85.4 114.71 22.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.092 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.625 ' HG2' HG23 ' A' ' 63' ' ' ILE . 0.3 OUTLIER -115.96 130.41 56.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.528 179.733 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.462 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 6.8 m-70 -93.7 111.21 22.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.343 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.406 ' HE2' ' HE2' ' A' ' 59' ' ' MET . 0.1 OUTLIER -107.07 137.36 45.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.971 0.415 . . . . 0.0 111.149 -179.637 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.865 ' CD2' HD11 ' A' ' 16' ' ' ILE . 1.1 m-85 -137.0 128.84 29.05 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.775 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.624 ' HA ' ' HG3' ' A' ' 59' ' ' MET . 0.9 OUTLIER -97.22 114.42 26.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.727 179.718 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.656 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 33.1 m-85 -91.12 145.58 24.56 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.109 0.48 . . . . 0.0 111.496 -179.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -108.31 27.65 9.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.487 179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -165.67 111.02 0.88 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.851 -179.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.467 ' CA ' ' HG2' ' A' ' 58' ' ' MET . 0.0 OUTLIER -58.71 -23.62 59.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.429 179.696 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -72.95 -44.07 61.57 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.8 179.152 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.41 HG13 ' CA ' ' A' ' 5' ' ' GLY . 37.7 t -65.43 -51.96 57.49 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.445 178.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.419 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -60.67 -36.0 77.63 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.853 179.209 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.408 ' N ' ' HG3' ' A' ' 97' ' ' MET . 4.0 m-20 -61.05 -33.75 73.8 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.089 179.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -81.64 -25.23 35.8 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.578 179.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.581 HG22 HD12 ' A' ' 104' ' ' LEU . 9.1 mm -84.87 -60.14 2.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.002 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.69 ' HD3' HG11 ' B' ' 673' ' ' VAL . 2.7 ttmm -53.31 -27.48 23.32 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.766 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.457 ' HG3' ' N ' ' A' ' 103' ' ' THR . 9.5 ptp -81.57 -39.96 23.79 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.75 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.881 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -74.95 -32.91 61.86 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-O 120.984 0.421 . . . . 0.0 110.023 179.897 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.909 ' CD2' HD11 ' A' ' 42' ' ' LEU . 11.2 mt -60.71 -58.6 7.77 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.458 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.445 ' HA ' HG13 ' A' ' 108' ' ' ILE . 0.4 OUTLIER -68.34 -33.19 73.85 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.892 179.721 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -52.8 -34.72 54.93 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.273 0.559 . . . . 0.0 109.993 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.964 HG22 ' HE1' ' A' ' 111' ' ' TYR . 6.1 mt -84.95 -52.14 12.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.141 179.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.604 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.75 -57.81 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.334 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.091 178.961 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.403 ' HA ' ' HG2' ' A' ' 112' ' ' LYS . 0.1 OUTLIER -47.04 -26.29 1.02 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.131 179.757 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 6.0 mtt-85 -73.05 -25.04 60.78 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.35 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.964 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -76.59 -36.15 57.7 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.522 -0.547 . . . . 0.0 109.522 179.855 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.727 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -79.68 -43.75 22.13 Favored 'General case' 0 CA--C 1.504 -0.82 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.903 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -61.73 -31.01 71.15 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 113.913 -1.494 . . . . 0.0 108.99 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.453 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.61 -19.04 22.3 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.373 -0.83 . . . . 0.0 110.698 178.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 37.1 t70 . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.972 179.996 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.826 0.346 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 13.5 mt -153.24 84.41 1.2 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.91 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -176.54 70.94 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.894 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 664' ' ' VAL . . . . . 0.528 HG12 ' O ' ' B' ' 664' ' ' VAL . 17.5 t 59.16 42.64 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.128 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 665' ' ' LEU . . . . . 0.452 HD12 ' H ' ' B' ' 666' ' ' SER . 0.2 OUTLIER 61.71 -161.48 0.29 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.801 179.969 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 666' ' ' SER . . . . . 0.452 ' H ' HD12 ' B' ' 665' ' ' LEU . 34.3 m -166.94 94.08 0.47 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.254 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 667' ' ' GLU . . . . . 0.441 ' O ' ' CE1' ' B' ' 670' ' ' PHE . 0.7 OUTLIER -83.78 18.86 1.83 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.072 -179.562 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -106.07 11.51 31.38 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.981 179.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.466 HD11 ' HE2' ' A' ' 57' ' ' LYS . 4.4 pp -120.34 -26.25 5.47 Favored 'General case' 0 C--O 1.232 0.142 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -179.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 670' ' ' PHE . . . . . 0.441 ' CE1' ' O ' ' B' ' 667' ' ' GLU . 0.0 OUTLIER -76.51 164.38 26.01 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.985 0.422 . . . . 0.0 111.381 -179.28 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -109.89 171.1 7.65 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.078 -179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 672' ' ' ASP . . . . . 0.414 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 18.4 t70 -107.24 120.38 41.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.075 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 673' ' ' VAL . . . . . 0.729 ' CG2' HD23 ' A' ' 48' ' ' LEU . 36.0 m -65.37 125.24 89.1 Favored Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.705 179.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.73 156.28 64.81 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.491 2.127 . . . . 0.0 112.671 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 52.7 p -136.81 116.63 13.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.763 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.88 130.21 0.09 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.916 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 2.3 m 62.09 148.29 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.06 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -168.6 128.81 1.2 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.911 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 679' ' ' ILE . . . . . 0.66 HG23 ' O ' ' B' ' 679' ' ' ILE . 0.0 OUTLIER -177.21 96.16 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.958 179.956 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 2.5 m . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.905 -179.93 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo . . . . . 0 N--CA 1.487 1.123 0 CA-C-O 120.844 0.268 . . . . 0.0 111.865 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.682 ' O ' HG21 ' A' ' 103' ' ' THR . 0.4 OUTLIER -101.55 -37.57 8.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.88 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.418 ' O ' ' N ' ' A' ' 18' ' ' ILE . 37.1 m80 -82.0 17.9 1.47 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.49 179.777 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.57 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 4.9 p -152.26 153.07 33.02 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-O 121.205 0.526 . . . . 0.0 111.262 179.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.489 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 173.03 139.07 2.75 Favored Glycine 0 N--CA 1.448 -0.513 0 N-CA-C 110.707 -0.957 . . . . 0.0 110.707 -179.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.552 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.84 142.51 31.46 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -178.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.569 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -151.81 171.1 18.26 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.179 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.653 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.77 127.05 55.58 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.266 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.554 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.493 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 7.2 t80 -128.08 110.53 12.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.957 0.408 . . . . 0.0 111.093 178.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 3.7 mm-40 67.46 50.09 0.96 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.892 179.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 69.83 -4.42 1.46 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.187 179.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.478 ' O ' HG23 ' A' ' 8' ' ' ILE . 17.9 t -101.38 149.05 6.66 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 CA-C-O 121.122 0.487 . . . . 0.0 110.561 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.454 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -111.85 113.49 25.86 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.033 179.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.879 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.98 -133.05 3.4 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.952 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.879 HD13 ' O ' ' A' ' 14' ' ' GLY . 18.7 mm -135.89 136.11 50.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-O 120.688 0.28 . . . . 0.0 111.255 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.864 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.68 140.52 19.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 106.425 -1.695 . . . . 0.0 106.425 176.7 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.57 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.54 118.01 5.68 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 119.629 -0.829 . . . . 0.0 111.591 -178.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.64 HD12 ' HB ' ' A' ' 103' ' ' THR . 20.9 mt -81.52 142.88 13.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 114.501 -1.227 . . . . 0.0 112.164 -178.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.618 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -119.5 92.7 3.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.914 179.034 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.68 -0.2 41.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.319 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -82.49 0.37 42.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.647 -0.251 . . . . 0.0 111.096 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.618 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.31 -163.01 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.823 0.344 . . . . 0.0 110.775 179.92 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.6 p -175.1 101.48 0.26 Allowed Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.369 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.441 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 12.4 Cg_exo -69.48 166.34 73.54 Favored 'Cis proline' 0 C--N 1.346 0.445 0 C-N-CA 123.612 -1.411 . . . . 0.0 112.704 0.348 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.484 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -59.53 178.57 0.15 Allowed 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.342 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.522 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.73 134.52 4.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.209 179.042 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.797 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.93 129.12 55.12 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 178.904 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.54 HG22 ' CG2' ' A' ' 37' ' ' VAL . 6.8 m -112.33 113.41 25.61 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -178.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.533 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 76.3 t90 -91.79 110.36 21.7 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.261 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.492 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.5 ttt180 -109.41 130.33 55.5 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.727 0.298 . . . . 0.0 111.204 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.401 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 31.1 m -49.9 159.83 0.37 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.508 179.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.422 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 48.3 m -75.98 -37.58 58.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.333 0.587 . . . . 0.0 109.845 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -85.56 -12.91 50.46 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.155 -0.929 . . . . 0.0 111.233 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 83.73 35.4 16.41 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.361 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -87.56 -24.87 23.89 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.709 0.29 . . . . 0.0 111.383 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.75 163.94 2.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.321 0.581 . . . . 0.0 111.427 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.54 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.6 OUTLIER -143.77 155.45 16.01 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.981 -178.903 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.478 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 27.3 m80 -130.69 119.56 22.58 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.795 179.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.56 128.54 43.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.739 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.592 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -114.94 141.55 31.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.46 -179.629 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.434 ' HB ' HG23 ' A' ' 44' ' ' THR . 21.5 t -104.07 95.92 4.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 177.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.794 HD11 HD22 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -44.18 -21.94 0.05 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.835 -179.114 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.441 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER -76.92 -47.14 21.89 Favored 'General case' 0 CA--C 1.52 -0.211 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.083 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.434 HG23 ' HB ' ' A' ' 41' ' ' VAL . 51.5 p -64.52 -28.08 69.41 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.869 HD12 ' HB3' ' A' ' 62' ' ' LEU . 49.9 mm -56.68 103.57 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.411 178.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.416 ' N ' ' O ' ' A' ' 63' ' ' ILE . 24.2 t70 -58.26 -20.26 40.74 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.807 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.471 ' HG2' HG12 ' A' ' 63' ' ' ILE . 0.0 OUTLIER -172.6 160.18 4.59 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.105 0.478 . . . . 0.0 111.453 -179.877 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.799 HD21 ' HB2' ' A' ' 104' ' ' LEU . 12.2 tp -109.03 120.33 42.23 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.334 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.41 ' O ' ' N ' ' A' ' 61' ' ' ARG . 0.4 OUTLIER -122.52 145.59 48.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.63 0.252 . . . . 0.0 111.295 -179.641 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.618 ' CB ' HD22 ' A' ' 60' ' ' LEU . . . -157.3 149.86 23.1 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.667 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.585 HG23 ' HB2' ' A' ' 59' ' ' MET . 43.3 p -56.53 138.66 75.92 Favored Pre-proline 0 CA--C 1.53 0.179 0 C-N-CA 121.045 -0.262 . . . . 0.0 110.87 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -68.34 163.19 37.38 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.598 2.199 . . . . 0.0 112.391 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.27 -32.21 73.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.059 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.4 p -70.74 -20.87 62.59 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.079 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.431 ' CB ' HD22 ' B' ' 669' ' ' LEU . 79.1 p -91.57 116.51 28.93 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.894 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -56.51 -18.25 10.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.697 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.5 mmmt -73.16 126.84 30.98 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.851 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.54 97.58 7.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.585 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.585 ' HB2' HG23 ' A' ' 51' ' ' THR . 23.8 mtm -143.97 142.93 30.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.861 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.618 HD22 ' CB ' ' A' ' 50' ' ' ALA . 17.9 mt -118.17 146.25 44.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.044 178.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.41 ' N ' ' O ' ' A' ' 49' ' ' GLN . 18.6 ttp180 -143.12 145.59 32.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.972 0.415 . . . . 0.0 112.119 -178.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.869 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -128.19 109.07 11.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.923 -0.58 . . . . 0.0 109.889 178.231 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.471 HG12 ' HG2' ' A' ' 47' ' ' LYS . 7.8 mm -76.64 156.41 5.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 C-N-CA 120.994 -0.282 . . . . 0.0 110.891 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -111.18 -170.39 19.12 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.417 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.0 mttm -116.07 136.48 52.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.72 0.295 . . . . 0.0 111.034 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.446 HG22 ' N ' ' A' ' 67' ' ' ASP . 9.3 p -102.14 160.41 4.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.994 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.446 ' N ' HG22 ' A' ' 66' ' ' VAL . 6.5 t70 -136.99 38.36 2.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.197 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 44.67 30.16 0.49 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.312 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 64.6 m -102.1 -22.76 14.17 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.215 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 30.7 mmtm -56.4 -82.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.971 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.7 mttm 55.09 89.81 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.865 0.364 . . . . 0.0 111.129 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.41 ' HG2' ' CG ' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -124.57 134.42 52.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.863 179.95 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.7 mmtt -73.51 148.52 43.02 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.776 -179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -103.93 -31.74 9.6 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.037 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 168.57 -31.38 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.101 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -105.11 20.46 18.82 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.327 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 53.84 36.93 56.49 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.532 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -83.6 2.97 34.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.701 0.286 . . . . 0.0 111.646 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 79' ' ' GLU . 9.5 pt-20 42.39 74.38 0.11 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.223 -0.444 . . . . 0.0 112.008 179.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.448 HG12 ' N ' ' A' ' 81' ' ' VAL . 40.5 t -76.87 155.41 5.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.32 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.448 ' N ' HG12 ' A' ' 80' ' ' VAL . 52.3 t -110.9 78.96 1.73 Allowed Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.341 179.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.41 ' CG ' ' HG2' ' A' ' 72' ' ' ARG . 93.9 Cg_exo -41.24 156.02 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.907 2.405 . . . . 0.0 112.795 -179.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.9 ptpp? -44.69 164.94 0.16 Allowed Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.217 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.438 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.8 Cg_exo -82.4 46.29 2.15 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 123.543 2.828 . . . . 0.0 112.771 -178.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 59.68 149.45 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.009 0.433 . . . . 0.0 111.081 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -166.99 128.39 1.63 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.6 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.525 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 10.8 m-70 -93.13 111.18 22.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.73 0.3 . . . . 0.0 110.303 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 16.6 ttt -94.18 118.26 31.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.283 -179.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.864 ' CD1' HD11 ' A' ' 16' ' ' ILE . 92.8 m-85 -116.98 116.63 27.76 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.654 179.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.439 ' HB3' ' HB ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -94.57 114.58 26.58 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.972 0.415 . . . . 0.0 110.545 179.931 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.518 ' CE1' ' HB2' ' A' ' 7' ' ' ALA . 5.8 m-85 -89.63 147.32 23.97 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.394 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -109.47 29.14 7.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.0 179.133 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.428 ' CB ' HG23 ' A' ' 96' ' ' VAL . 7.5 m-20 -174.97 117.69 0.18 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.585 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.481 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -59.47 -14.93 14.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.778 179.614 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.02 -50.83 18.02 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 121.025 0.44 . . . . 0.0 110.267 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.428 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -64.43 -43.71 97.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.658 179.247 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.481 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -64.38 -36.94 85.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.931 179.381 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -62.88 -28.73 70.24 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.817 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.455 ' O ' ' HG2' ' A' ' 102' ' ' MET . 5.4 m120 -81.69 -65.41 1.02 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.276 179.265 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.642 HG22 HD11 ' A' ' 104' ' ' LEU . 22.6 mm -47.32 -57.64 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.212 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.432 ' HA ' HD12 ' A' ' 104' ' ' LEU . 0.1 OUTLIER -50.03 -35.46 24.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.733 -179.416 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.531 ' HG3' ' N ' ' A' ' 103' ' ' THR . 9.0 ptp -83.04 -41.49 18.6 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.647 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.682 HG21 ' O ' ' A' ' 2' ' ' SER . 0.2 OUTLIER -56.85 -50.76 71.47 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 120.822 0.344 . . . . 0.0 110.564 179.505 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.799 ' HB2' HD21 ' A' ' 48' ' ' LEU . 5.5 mt -52.73 -52.5 55.99 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 179.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.729 HE22 HG23 ' B' ' 675' ' ' THR . 58.6 mm-40 -55.46 -47.76 75.55 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.017 179.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -49.62 -34.8 19.06 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-O 121.134 0.492 . . . . 0.0 110.607 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.012 HG22 ' HE1' ' A' ' 111' ' ' TYR . 9.2 mt -85.69 -52.07 12.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.49 179.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.667 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -42.52 -57.06 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.622 179.484 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.449 ' HA ' ' HG2' ' A' ' 112' ' ' LYS . 10.1 t -47.98 -26.95 1.96 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.942 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.452 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 11.7 mtp-105 -72.36 -25.03 61.37 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.022 179.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 1.012 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -75.54 -34.95 60.79 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.599 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.767 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.73 -43.17 17.12 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.987 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -61.3 -32.36 72.21 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 113.815 -1.539 . . . . 0.0 108.99 178.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.452 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.59 -18.91 22.48 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.238 -0.892 . . . . 0.0 110.727 178.628 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 33.5 t70 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.092 179.898 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.806 0.336 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 662' ' ' LEU . . . . . 0.706 ' N ' HD13 ' B' ' 662' ' ' LEU . 0.0 OUTLIER -117.74 -21.12 8.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.35 179.985 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 663' ' ' GLU . . . . . 0.625 ' N ' HD22 ' B' ' 662' ' ' LEU . 0.2 OUTLIER 56.67 85.88 0.07 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.725 0.298 . . . . 0.0 111.079 179.966 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 664' ' ' VAL . . . . . 0.588 ' O ' HG22 ' B' ' 664' ' ' VAL . 14.2 p 43.1 44.86 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.177 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.677 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 665' ' ' LEU . . . . . 0.796 HD13 ' N ' ' B' ' 666' ' ' SER . 0.7 OUTLIER 63.46 142.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.869 179.937 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 666' ' ' SER . . . . . 0.796 ' N ' HD13 ' B' ' 665' ' ' LEU . 1.8 t -111.06 64.01 0.61 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.836 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 667' ' ' GLU . . . . . 0.674 ' HG2' HD12 ' B' ' 665' ' ' LEU . 0.8 OUTLIER -94.14 19.15 9.63 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.59 -179.943 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -86.96 5.3 37.87 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.394 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.431 HD22 ' CB ' ' A' ' 55' ' ' SER . 0.4 OUTLIER -120.31 19.89 12.04 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.726 0.298 . . . . 0.0 111.168 179.924 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 670' ' ' PHE . . . . . 0.426 ' CZ ' ' HB2' ' A' ' 59' ' ' MET . 5.4 m-85 -63.37 122.81 17.12 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.856 0.36 . . . . 0.0 110.927 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -100.2 145.29 28.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.845 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -84.17 115.36 22.38 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.048 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 673' ' ' VAL . . . . . 0.413 ' CG1' ' NE2' ' A' ' 105' ' ' GLN . 25.5 t -60.47 136.39 92.08 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.892 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 674' ' ' PRO . . . . . 0.409 ' HD2' HG13 ' B' ' 673' ' ' VAL . 36.6 Cg_endo -65.45 128.33 20.01 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.429 2.086 . . . . 0.0 112.284 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 675' ' ' THR . . . . . 0.729 HG23 HE22 ' A' ' 105' ' ' GLN . 0.7 OUTLIER -122.13 159.58 26.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.873 -179.989 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 33.7 tttt -81.0 162.79 23.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.879 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 1.6 t -176.66 -170.37 0.33 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.942 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -82.17 -172.94 4.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.908 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 679' ' ' ILE . . . . . 0.589 HG22 ' O ' ' B' ' 679' ' ' ILE . 3.5 mp -114.14 31.81 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.111 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 3.2 m . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.875 -179.974 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo . . . . . 0 N--CA 1.488 1.164 0 CA-C-O 120.89 0.287 . . . . 0.0 111.822 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.657 ' O ' HG21 ' A' ' 103' ' ' THR . 1.4 m -106.39 -37.55 6.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.849 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.415 ' CD2' ' HG2' ' A' ' 20' ' ' GLU . 16.4 m80 -87.45 20.43 2.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.249 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.546 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 6.5 p -156.54 136.96 13.03 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-O 121.196 0.522 . . . . 0.0 111.145 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.517 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -171.73 138.54 4.89 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 110.751 -0.939 . . . . 0.0 110.751 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.565 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -81.29 142.75 32.81 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.516 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -155.74 170.98 20.79 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.364 -179.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.607 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -100.85 126.17 54.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.239 -179.826 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.537 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 58.4 t80 -117.25 108.6 15.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.047 0.451 . . . . 0.0 111.569 178.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 67.1 mt-10 58.49 55.55 4.82 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.84 178.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.4 mtmm 71.99 -6.66 1.44 Allowed 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.802 0.668 . . . . 0.0 112.802 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.46 ' O ' HG23 ' A' ' 8' ' ' ILE . 34.0 t -101.73 150.16 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.549 0 CA-C-O 121.235 0.54 . . . . 0.0 110.545 179.383 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.438 ' HA ' HD12 ' A' ' 8' ' ' ILE . 90.4 p -106.1 144.76 32.35 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.003 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.908 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -171.67 -141.86 3.51 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.034 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.908 HD13 ' O ' ' A' ' 14' ' ' GLY . 13.8 mm -132.38 136.19 56.66 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.475 0 CA-C-O 120.938 0.399 . . . . 0.0 111.465 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.8 HD11 ' CG ' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.76 141.37 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 N-CA-C 106.332 -1.729 . . . . 0.0 106.332 176.759 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.546 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.61 118.59 5.85 Favored 'General case' 0 C--N 1.313 -1.002 0 C-N-CA 119.663 -0.815 . . . . 0.0 111.478 -178.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.626 HD12 ' HB ' ' A' ' 103' ' ' THR . 20.1 mt -82.0 142.99 12.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.255 -178.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.643 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -119.8 92.51 3.8 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.872 178.871 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.415 ' HG2' ' CD2' ' A' ' 3' ' ' HIS . 0.7 OUTLIER -82.85 0.92 41.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.376 -179.651 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -82.79 0.81 42.06 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.06 179.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.643 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.39 -162.07 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.852 0.358 . . . . 0.0 110.709 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.407 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 11.6 p -175.01 101.23 0.26 Allowed Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.541 179.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.434 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 9.8 Cg_exo -70.98 165.94 78.69 Favored 'Cis proline' 0 C--N 1.348 0.504 0 C-N-CA 123.617 -1.41 . . . . 0.0 112.634 0.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.44 ' CB ' HG21 ' A' ' 107' ' ' ILE . . . -59.66 177.92 0.19 Allowed 'General case' 0 CA--C 1.517 -0.293 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.406 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.561 ' HG2' HG21 ' A' ' 22' ' ' VAL . 6.7 pt-20 -163.68 137.15 5.55 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.003 179.077 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.775 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.86 127.67 53.93 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 178.99 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.617 HG22 ' CG2' ' A' ' 37' ' ' VAL . 3.1 m -109.67 111.15 22.44 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.292 0.478 . . . . 0.0 112.292 -178.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.537 ' CE2' ' HB3' ' A' ' 9' ' ' PHE . 65.6 t90 -91.95 113.68 26.02 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 116.233 -0.439 . . . . 0.0 109.868 178.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.433 ' O ' ' N ' ' A' ' 15' ' ' ILE . 2.5 ttt180 -106.91 133.52 51.43 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.658 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 27.3 m -49.72 166.49 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 110.251 -0.277 . . . . 0.0 110.251 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 89.0 m -76.8 -43.23 37.51 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.479 0.657 . . . . 0.0 109.894 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -83.96 -13.78 52.51 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.185 179.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.22 34.22 10.93 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.276 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -84.79 -23.08 29.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.684 0.278 . . . . 0.0 111.574 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.9 163.59 2.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.32 0.581 . . . . 0.0 111.422 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.617 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.6 146.03 19.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.985 -178.747 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.448 ' ND1' ' CZ ' ' A' ' 9' ' ' PHE . 1.4 m-70 -122.04 123.53 41.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.828 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.51 126.32 41.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.814 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.568 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -112.47 140.16 33.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.265 -179.839 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.43 ' HB ' HG23 ' A' ' 44' ' ' THR . 23.3 t -104.01 96.49 4.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 177.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.73 HD11 HD22 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -43.05 -24.28 0.07 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.774 -179.019 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.434 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.8 OUTLIER -74.95 -47.95 26.89 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.281 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.43 HG23 ' HB ' ' A' ' 41' ' ' VAL . 48.7 p -64.64 -28.11 69.39 Favored 'General case' 0 N--CA 1.44 -0.971 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 178.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.875 HD12 ' HB3' ' A' ' 62' ' ' LEU . 41.8 mm -57.59 99.83 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.526 178.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.453 ' N ' ' O ' ' A' ' 63' ' ' ILE . 16.5 t70 -47.48 -28.72 2.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.7 0.286 . . . . 0.0 111.31 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.45 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 1.4 pttt -172.72 156.97 3.65 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.894 0.378 . . . . 0.0 110.741 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.959 HD11 HD13 ' A' ' 104' ' ' LEU . 3.6 tp -109.1 122.47 47.36 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.714 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.616 ' OE1' HD11 ' A' ' 63' ' ' ILE . 17.9 mt-30 -118.75 151.99 37.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.793 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.661 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.16 150.47 23.97 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.78 179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.594 HG23 ' HB2' ' A' ' 59' ' ' MET . 25.9 p -57.12 142.2 75.21 Favored Pre-proline 0 C--N 1.332 -0.156 0 CA-C-O 120.63 0.252 . . . . 0.0 110.84 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.73 163.27 39.64 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.522 2.148 . . . . 0.0 112.553 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.41 -30.6 68.59 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.223 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.65 -21.79 62.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.935 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 57.8 m -94.03 117.08 29.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.834 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -54.78 -19.85 7.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.53 179.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -70.25 121.71 18.13 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.758 179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.442 ' HA ' ' HG1' ' A' ' 51' ' ' THR . 1.6 mpp? -106.1 104.06 13.68 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.833 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.594 ' HB2' HG23 ' A' ' 51' ' ' THR . 14.2 mtm -149.69 143.6 25.57 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.648 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.661 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 24.0 mt -120.27 140.15 51.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.084 178.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.401 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 0.6 OUTLIER -135.42 148.84 49.45 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 120.917 0.389 . . . . 0.0 111.842 -179.169 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.875 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.4 mp -127.87 113.14 15.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.08 -0.509 . . . . 0.0 109.876 178.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.832 HG23 ' HG2' ' A' ' 86' ' ' ARG . 8.8 mm -76.66 145.53 10.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.649 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -104.72 144.87 15.86 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.558 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -56.92 118.24 4.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.816 0.341 . . . . 0.0 110.901 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.467 HG22 ' N ' ' A' ' 67' ' ' ASP . 11.5 p -101.21 159.75 3.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.318 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.467 ' N ' HG22 ' A' ' 66' ' ' VAL . 4.8 m-20 -123.01 43.49 2.92 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.762 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.1 -20.87 57.35 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.17 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -58.32 -21.98 51.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.073 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.1 mmtm -67.11 -65.82 0.63 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.881 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 13.1 ptmt 43.15 80.78 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.453 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.16 164.41 17.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.942 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.3 mttp -116.68 154.93 29.71 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.921 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -86.96 170.72 11.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.933 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -59.88 -20.4 56.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.244 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -98.15 31.8 2.64 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.938 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 59.35 24.63 59.34 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.488 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 12.7 m-20 -78.88 -167.62 1.18 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.727 0.298 . . . . 0.0 110.779 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -147.0 126.82 13.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.867 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 59.6 t -95.07 -65.54 1.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.373 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.435 ' O ' HG13 ' A' ' 81' ' ' VAL . 4.5 p 34.11 78.26 0.33 Allowed Pre-proline 0 CA--C 1.53 0.188 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.855 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -44.02 124.14 4.58 Favored 'Trans proline' 0 C--N 1.346 0.398 0 C-N-CA 122.891 2.394 . . . . 0.0 112.676 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.404 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 3.6 mtpt -84.59 159.57 58.08 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.965 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 4.1 Cg_exo -83.84 127.86 4.32 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 123.533 2.822 . . . . 0.0 112.402 -179.101 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -97.95 154.87 17.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.822 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.832 ' HG2' HG23 ' A' ' 63' ' ' ILE . 37.4 mtt180 -153.12 142.0 21.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.541 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.478 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 20.7 m-70 -97.32 111.32 23.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.69 0.281 . . . . 0.0 110.349 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.465 ' HE1' ' HB3' ' B' ' 667' ' ' GLU . 7.5 ttt -94.08 112.97 24.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.997 0.427 . . . . 0.0 111.175 -179.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.8 ' CG ' HD11 ' A' ' 16' ' ' ILE . 90.8 m-85 -116.04 116.63 28.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.628 179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -99.2 114.5 27.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.973 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.516 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 5.4 m-85 -95.04 133.66 38.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.149 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 37.5 m-20 -93.64 43.67 1.12 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.685 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.521 ' CB ' HG23 ' A' ' 96' ' ' VAL . 4.5 m-20 176.8 109.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.409 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.459 ' O ' ' HG3' ' A' ' 97' ' ' MET . 0.0 OUTLIER -52.96 -21.06 3.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.959 -179.995 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -69.34 -44.97 70.55 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 120.831 0.348 . . . . 0.0 110.633 179.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.521 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -66.17 -49.84 73.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 178.882 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.459 ' HG3' ' O ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -62.73 -36.57 83.43 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.351 179.5 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.453 ' O ' ' HG2' ' A' ' 102' ' ' MET . 8.6 t70 -67.6 -35.1 78.33 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.047 0.451 . . . . 0.0 110.053 179.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 68.6 m-20 -82.23 -29.58 31.25 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.712 179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.517 HD11 ' N ' ' A' ' 5' ' ' GLY . 1.2 mm -83.19 -59.91 2.53 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.471 -179.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 6.6 ttmt -44.41 -28.69 0.58 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.328 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.453 ' HG2' ' O ' ' A' ' 98' ' ' ASP . 6.3 ptm -79.85 -40.29 28.75 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.424 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.657 HG21 ' O ' ' A' ' 2' ' ' SER . 0.2 OUTLIER -57.79 -58.89 6.38 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.715 179.563 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.959 HD13 HD11 ' A' ' 48' ' ' LEU . 4.7 mt -47.16 -50.48 20.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.76 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.869 HE21 HD23 ' A' ' 48' ' ' LEU . 49.9 mm-40 -56.65 -50.59 71.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.316 179.645 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.432 ' HG2' HG13 ' A' ' 107' ' ' ILE . 1.2 pt20 -50.88 -31.3 17.02 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 121.022 0.439 . . . . 0.0 110.921 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.038 HG22 ' HE1' ' A' ' 111' ' ' TYR . 8.4 mt -85.61 -52.94 11.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.652 179.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.732 HG21 HG21 ' B' ' 675' ' ' THR . 0.9 OUTLIER -42.51 -56.78 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.808 179.614 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.427 ' HA ' ' HG2' ' A' ' 112' ' ' LYS . 41.2 t -47.83 -26.57 1.7 Allowed 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.264 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 0.0 OUTLIER -74.75 -24.84 58.77 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.715 179.816 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 1.038 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -74.08 -34.2 63.91 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 179.154 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.765 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.76 -43.22 17.01 Favored 'General case' 0 CA--C 1.505 -0.753 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 179.059 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -61.67 -32.2 72.37 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 113.901 -1.5 . . . . 0.0 108.992 178.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.453 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.68 -18.73 22.63 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.556 178.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 27.2 t0 . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.209 -0.9 . . . . 0.0 111.131 179.97 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.836 0.351 . . . . 0.0 111.161 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -92.01 -31.48 15.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.906 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -176.95 95.64 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.862 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 21.6 t 62.93 83.01 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.072 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 665' ' ' LEU . . . . . 0.404 HD13 ' H ' ' B' ' 666' ' ' SER . 0.1 OUTLIER -143.82 147.09 33.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.858 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 666' ' ' SER . . . . . 0.41 ' HB3' HD11 ' B' ' 669' ' ' LEU . 1.0 OUTLIER -167.42 91.46 0.37 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.854 -179.987 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 667' ' ' GLU . . . . . 0.465 ' HB3' ' HE1' ' A' ' 88' ' ' MET . 3.9 pm0 -94.18 19.14 9.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.134 0.492 . . . . 0.0 111.568 -179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -102.7 -20.88 14.21 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.103 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.41 HD11 ' HB3' ' B' ' 666' ' ' SER . 0.5 OUTLIER -108.93 19.86 19.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.129 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 670' ' ' PHE . . . . . 0.435 ' CD1' ' HA ' ' B' ' 667' ' ' GLU . 2.2 m-85 -68.46 126.39 29.48 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.877 0.37 . . . . 0.0 110.83 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -100.97 171.08 7.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.876 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -110.94 118.57 36.45 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.946 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 673' ' ' VAL . . . . . 0.407 ' CG1' ' NE2' ' A' ' 105' ' ' GLN . 4.1 t -66.24 135.23 94.89 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.843 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -70.71 128.36 15.06 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.443 2.095 . . . . 0.0 112.406 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 675' ' ' THR . . . . . 0.732 HG21 HG21 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -125.04 153.7 42.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.724 179.848 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -58.73 146.16 37.69 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.967 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 3.9 m -173.81 103.09 0.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.896 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -99.7 172.28 7.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.892 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 679' ' ' ILE . . . . . 0.646 ' N ' HD13 ' B' ' 679' ' ' ILE . 0.2 OUTLIER -151.02 30.98 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.15 -179.963 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 1.7 m . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.228 -0.892 . . . . 0.0 110.884 -179.986 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo . . . . . 0 N--CA 1.487 1.109 0 CA-C-O 121.01 0.337 . . . . 0.0 111.894 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -79.32 -34.56 42.2 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.912 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.411 ' NE2' ' HB2' ' A' ' 20' ' ' GLU . 26.1 m170 -97.32 26.26 4.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.055 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.553 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 50.7 p -160.99 155.18 22.9 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.081 0.467 . . . . 0.0 111.087 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.439 ' O ' ' HB ' ' A' ' 16' ' ' ILE . . . 172.67 136.36 2.14 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.284 -179.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.576 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -79.79 138.08 37.16 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.102 0.477 . . . . 0.0 112.086 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.67 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -147.11 171.6 15.06 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.535 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.651 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.15 129.95 51.35 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.254 -179.884 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.538 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 62.2 t80 -124.34 109.81 13.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.979 0.418 . . . . 0.0 111.418 178.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 61.59 45.35 8.23 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.643 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 2.7 mtpp 78.19 -4.48 2.2 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 179.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.467 ' O ' HG23 ' A' ' 8' ' ' ILE . 28.2 t -99.94 150.82 5.19 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.466 0 CA-C-O 121.119 0.485 . . . . 0.0 110.369 179.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.403 ' HA ' HD12 ' A' ' 8' ' ' ILE . 90.5 p -105.69 116.0 31.19 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.127 -179.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.425 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -138.54 -158.55 7.77 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.13 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.576 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 18.7 mm -119.8 131.82 71.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.765 0.317 . . . . 0.0 111.325 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.861 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.4 OUTLIER -101.19 114.02 39.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -123.1 115.89 22.57 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.582 0.706 . . . . 0.0 110.831 -179.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.766 HD13 HG22 ' A' ' 103' ' ' THR . 15.7 mt -85.25 142.9 12.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 114.749 -1.114 . . . . 0.0 111.891 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.602 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.7 m120 -117.77 97.44 5.85 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.279 179.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.411 ' HB2' ' NE2' ' A' ' 3' ' ' HIS . 0.0 OUTLIER -84.1 -1.81 55.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.299 -179.757 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -82.92 1.37 39.94 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.486 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -98.35 -162.41 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.846 0.355 . . . . 0.0 110.943 180.0 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.0 p -173.97 99.98 0.3 Allowed Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.345 179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.476 ' CG ' ' HB2' ' A' ' 43' ' ' SER . 56.6 Cg_endo -71.09 164.29 83.34 Favored 'Cis proline' 0 C--N 1.346 0.427 0 C-N-CA 123.605 -1.415 . . . . 0.0 112.867 0.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.582 ' CB ' HG21 ' A' ' 107' ' ' ILE . . . -54.99 -175.84 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.978 179.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -163.53 147.11 10.35 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.629 0.728 . . . . 0.0 112.482 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.693 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 2.8 tt -108.2 149.01 29.12 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.646 -1.161 . . . . 0.0 108.466 178.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.755 HG23 HG23 ' A' ' 39' ' ' THR . 0.2 OUTLIER -145.42 102.6 3.73 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -178.676 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.538 ' CE2' ' HB3' ' A' ' 9' ' ' PHE . 78.4 t90 -92.13 114.04 26.48 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.735 178.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.457 ' O ' ' N ' ' A' ' 15' ' ' ILE . 12.6 ptp180 -114.83 135.13 54.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.639 0.256 . . . . 0.0 110.534 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.5 m -49.81 158.24 0.5 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.717 0.294 . . . . 0.0 110.499 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 32.4 m -72.49 -36.0 68.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.416 0.627 . . . . 0.0 109.707 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -86.13 -18.26 32.78 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.024 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 89.76 32.56 9.94 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.439 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -85.79 -21.58 28.09 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.592 0.234 . . . . 0.0 111.52 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.1 158.71 2.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.356 0.598 . . . . 0.0 111.422 -179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.488 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.68 140.39 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.494 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.945 -178.72 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.496 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 0.6 OUTLIER -115.86 125.51 52.75 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.587 179.539 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.755 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -98.07 146.19 25.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.054 -179.677 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.693 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.2 t -129.91 136.7 58.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.144 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.422 ' O ' HG12 ' A' ' 45' ' ' ILE . 47.8 t -104.04 95.86 4.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.427 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.678 HD11 HD22 ' A' ' 104' ' ' LEU . 0.9 OUTLIER -41.93 -24.97 0.05 Allowed 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.642 -178.81 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.476 ' HB2' ' CG ' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -72.99 -51.27 18.91 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.125 -0.694 . . . . 0.0 109.125 178.621 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 30.8 p -64.93 -28.41 69.51 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 178.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.849 HD12 ' HB3' ' A' ' 62' ' ' LEU . 42.1 mm -56.39 103.31 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.22 178.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 63' ' ' ILE . 16.9 t70 -54.53 -31.93 57.24 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.154 -0.476 . . . . 0.0 112.048 -179.19 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.427 ' O ' ' CG2' ' A' ' 45' ' ' ILE . 53.2 mtmt -157.6 162.97 38.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.539 0.685 . . . . 0.0 112.285 -179.463 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.675 HD13 HD11 ' A' ' 108' ' ' ILE . 9.0 tp -111.52 121.68 45.82 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.118 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.615 ' NE2' HD11 ' A' ' 63' ' ' ILE . 12.0 mt-30 -125.01 136.44 53.72 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.62 0.247 . . . . 0.0 111.181 -179.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.671 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.07 141.23 16.37 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.041 179.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.851 HG22 ' HB3' ' B' ' 670' ' ' PHE . 37.4 p -60.34 149.42 76.65 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.241 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -78.27 163.31 27.72 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.707 2.271 . . . . 0.0 112.361 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.11 -28.82 70.04 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.287 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.84 -17.07 62.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.194 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.511 ' CB ' HD21 ' B' ' 669' ' ' LEU . 47.3 t -71.14 122.05 19.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.033 179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -57.02 -17.45 10.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.369 179.009 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.926 ' HE3' ' HE2' ' A' ' 59' ' ' MET . 0.0 OUTLIER -118.97 167.62 11.57 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.235 179.523 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.429 ' HB2' ' HG2' ' A' ' 97' ' ' MET . 0.9 OUTLIER -127.33 129.36 47.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.177 0.513 . . . . 0.0 111.351 -179.8 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.926 ' HE2' ' HE3' ' A' ' 57' ' ' LYS . 7.8 ttp -149.95 138.03 20.34 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.845 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.671 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 26.7 mt -119.51 150.18 40.68 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.117 178.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.561 ' N ' ' O ' ' A' ' 49' ' ' GLN . 2.3 ttt180 -150.91 148.18 28.11 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -178.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.849 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.3 mp -128.6 118.78 23.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.896 178.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.615 HD11 ' NE2' ' A' ' 49' ' ' GLN . 25.0 mm -76.53 156.45 5.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.649 0.262 . . . . 0.0 111.033 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.445 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -117.36 146.09 18.7 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.524 -179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 32.2 mttt -65.0 119.96 11.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.802 0.334 . . . . 0.0 110.829 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.48 HG22 ' N ' ' A' ' 67' ' ' ASP . 12.9 p -98.2 160.5 3.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.081 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.48 ' N ' HG22 ' A' ' 66' ' ' VAL . 16.6 m-20 -115.66 40.24 2.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.009 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.506 ' HA ' HG13 ' A' ' 81' ' ' VAL . 20.8 pt-20 -64.6 -21.06 66.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.058 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 41.5 t -88.69 -22.81 23.2 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.106 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.6 mmmt -83.97 -41.01 17.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.865 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.609 ' HG2' HG22 ' A' ' 81' ' ' VAL . 16.1 mtmt 61.98 93.23 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.028 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.408 ' N ' ' O ' ' A' ' 80' ' ' VAL . 0.0 OUTLIER -61.83 -176.46 0.09 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.708 179.862 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -141.75 -170.54 3.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.795 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -125.21 -68.08 0.86 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.12 0.486 . . . . 0.0 111.043 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 179.24 -33.36 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.105 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -95.95 38.47 1.18 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.931 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 72.13 8.24 69.17 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.768 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -60.02 -173.74 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.809 0.338 . . . . 0.0 110.924 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -154.11 137.12 15.48 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.864 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.408 ' O ' ' N ' ' A' ' 72' ' ' ARG . 2.1 t -128.35 145.13 35.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.35 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.609 HG22 ' HG2' ' A' ' 71' ' ' LYS . 81.5 t -123.46 69.96 43.89 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.129 179.231 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_exo -43.1 124.7 3.87 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.789 2.326 . . . . 0.0 112.724 -179.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.3 mmtt -59.56 164.32 5.56 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.094 0.473 . . . . 0.0 110.978 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.439 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 4.6 Cg_exo -81.21 105.63 1.65 Allowed 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 123.601 2.867 . . . . 0.0 112.284 -179.141 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -64.06 152.52 40.12 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.119 -179.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.477 ' NE ' HD12 ' A' ' 63' ' ' ILE . 30.2 mtt180 -155.45 137.23 14.38 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.286 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.479 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 15.2 m-70 -97.82 111.52 23.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.637 0.256 . . . . 0.0 110.558 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.494 ' HE1' ' HB3' ' B' ' 667' ' ' GLU . 0.0 OUTLIER -99.85 122.45 42.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.941 0.401 . . . . 0.0 110.899 -179.925 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.861 ' CD1' HD11 ' A' ' 16' ' ' ILE . 79.5 m-85 -125.58 116.87 22.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.775 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.437 ' HA ' ' HG3' ' A' ' 59' ' ' MET . 0.8 OUTLIER -95.83 114.55 26.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.145 -179.788 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.67 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 23.6 m-85 -91.42 158.63 16.4 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.169 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 -115.61 29.94 7.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.552 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.5 ' CB ' HG23 ' A' ' 96' ' ' VAL . 4.2 m-20 -173.43 115.84 0.25 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.532 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.449 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 10.4 ttp85 -58.95 -15.92 15.31 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.017 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.45 -43.7 54.99 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-O 121.03 0.443 . . . . 0.0 110.174 179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.5 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -67.75 -48.48 75.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.437 179.102 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.449 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -62.05 -36.08 80.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.998 179.153 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.424 ' N ' ' HG3' ' A' ' 97' ' ' MET . 2.0 m-20 -62.57 -33.87 75.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.255 179.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 16.6 m-20 -81.87 -30.44 32.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.613 179.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.529 HG23 HD11 ' A' ' 18' ' ' ILE . 3.7 mm -79.53 -60.28 2.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.982 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.411 ' HG3' ' CB ' ' A' ' 50' ' ' ALA . 12.0 ttmt -51.85 -28.19 15.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.537 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 12.4 mtm -81.88 -29.39 32.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.941 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.766 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -82.42 -41.44 19.88 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.123 179.894 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.678 HD22 HD11 ' A' ' 42' ' ' LEU . 32.6 mt -56.81 -52.5 64.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.017 0.437 . . . . 0.0 109.855 179.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.662 ' HG2' HD23 ' A' ' 48' ' ' LEU . 5.3 mm-40 -61.98 -48.05 82.07 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.012 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -47.24 -33.06 5.07 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.985 0.422 . . . . 0.0 111.014 -179.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.043 HG22 ' HE1' ' A' ' 111' ' ' TYR . 3.5 mt -85.77 -52.14 12.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.68 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.716 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.14 -59.34 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.63 179.758 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -47.08 -24.89 0.73 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.228 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.447 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 49.8 mtp85 -74.69 -25.31 59.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.385 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 1.043 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -76.18 -34.19 59.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.184 0.516 . . . . 0.0 109.611 179.656 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.739 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.21 -43.61 19.0 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 178.98 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -62.29 -31.67 72.3 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 113.737 -1.574 . . . . 0.0 109.07 178.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.447 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.68 -18.4 23.05 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.676 178.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 24.1 t70 . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.257 -0.878 . . . . 0.0 111.073 179.896 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.887 0.375 . . . . 0.0 111.17 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -104.42 -39.8 6.31 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.883 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 60.84 92.46 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.941 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 664' ' ' VAL . . . . . 0.57 HG23 ' O ' ' B' ' 664' ' ' VAL . 19.6 m -144.48 80.03 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.083 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 665' ' ' LEU . . . . . 0.829 HD11 ' SD ' ' A' ' 59' ' ' MET . 0.2 OUTLIER 61.77 152.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.886 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 666' ' ' SER . . . . . 0.731 ' H ' HD13 ' B' ' 665' ' ' LEU . 1.2 t -153.42 87.17 1.23 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.434 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 667' ' ' GLU . . . . . 0.494 ' HB3' ' HE1' ' A' ' 88' ' ' MET . 0.6 OUTLIER -88.32 18.82 4.14 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.901 -179.542 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -105.96 8.3 32.42 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.913 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.912 HD13 ' N ' ' B' ' 670' ' ' PHE . 0.0 OUTLIER -120.4 -17.81 8.08 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.557 -179.618 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 670' ' ' PHE . . . . . 0.912 ' N ' HD13 ' B' ' 669' ' ' LEU . 0.0 OUTLIER -82.46 153.47 25.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.873 0.368 . . . . 0.0 111.207 -179.634 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -126.22 171.25 11.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.172 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -71.48 148.72 46.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.173 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 673' ' ' VAL . . . . . 0.56 HG22 ' HB3' ' A' ' 50' ' ' ALA . 10.8 t -80.61 143.77 55.42 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.961 179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 674' ' ' PRO . . . . . 0.425 ' HD2' HG12 ' B' ' 673' ' ' VAL . 14.3 Cg_exo -69.24 128.22 16.18 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.615 2.21 . . . . 0.0 112.949 -179.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 675' ' ' THR . . . . . 0.581 HG23 HE22 ' A' ' 105' ' ' GLN . 0.0 OUTLIER -122.93 -159.39 0.84 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.666 179.149 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 676' ' ' LYS . . . . . 0.465 ' HB3' ' HG3' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -45.91 155.48 0.18 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.802 0.335 . . . . 0.0 111.29 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 6.7 t -162.52 140.76 8.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.844 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.78 121.92 10.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.903 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 26.3 mt 63.25 84.71 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.059 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 30.3 t . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.165 -0.922 . . . . 0.0 110.909 179.942 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_endo . . . . . 0 N--CA 1.488 1.168 0 CA-C-O 120.816 0.257 . . . . 0.0 111.81 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.75 -37.48 10.27 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.822 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.407 ' NE2' ' HB2' ' A' ' 20' ' ' GLU . 29.8 m170 -89.95 16.12 8.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.359 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.57 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 3.5 p -152.65 155.28 37.0 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.046 0.451 . . . . 0.0 111.051 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.499 ' O ' ' HB ' ' A' ' 16' ' ' ILE . . . 174.29 139.97 3.13 Favored Glycine 0 N--CA 1.448 -0.512 0 N-CA-C 111.101 -0.799 . . . . 0.0 111.101 -179.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.555 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -84.04 143.99 29.38 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.206 0.527 . . . . 0.0 112.333 -178.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.55 ' C ' HD13 ' A' ' 8' ' ' ILE . . . -153.48 171.26 18.96 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.19 -179.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.668 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.99 123.49 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.563 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.468 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.6 t80 -123.85 109.55 13.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.978 0.418 . . . . 0.0 111.082 178.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 30.6 mt-10 67.84 51.27 0.79 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.735 179.087 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 3.8 mmtp 69.07 -2.74 1.69 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.264 -0.425 . . . . 0.0 112.12 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.476 ' O ' HG23 ' A' ' 8' ' ' ILE . 20.1 t -102.81 148.79 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.47 0 CA-C-O 121.096 0.474 . . . . 0.0 110.625 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.459 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -111.22 112.47 24.27 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.941 179.835 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.89 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.42 -134.62 3.63 Favored Glycine 0 N--CA 1.445 -0.701 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.829 179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.89 HD13 ' O ' ' A' ' 14' ' ' GLY . 18.0 mm -135.85 135.62 50.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.721 0.296 . . . . 0.0 111.332 179.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.94 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.57 141.23 17.77 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.66 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 176.476 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.57 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -150.93 117.44 5.73 Favored 'General case' 0 C--N 1.312 -1.044 0 C-N-CA 119.574 -0.851 . . . . 0.0 111.489 -178.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.958 HD13 HG22 ' A' ' 103' ' ' THR . 6.2 mt -87.12 142.28 13.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 114.565 -1.198 . . . . 0.0 111.703 -178.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.633 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -120.13 92.99 3.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.467 179.758 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.407 ' HB2' ' NE2' ' A' ' 3' ' ' HIS . 0.1 OUTLIER -80.69 -0.05 36.54 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.411 -179.862 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 79.6 m-20 -82.93 0.53 43.97 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.289 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.633 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -101.59 -162.5 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.844 0.354 . . . . 0.0 110.853 179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.5 t -174.06 101.33 0.3 Allowed Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.504 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.439 ' HB3' ' OG ' ' A' ' 43' ' ' SER . 61.1 Cg_endo -73.15 160.3 95.95 Favored 'Cis proline' 0 C--N 1.347 0.486 0 C-N-CA 123.455 -1.477 . . . . 0.0 112.758 0.367 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.412 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -52.15 175.39 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.52 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.466 ' CG ' HG21 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -163.65 136.31 5.24 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.14 179.343 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.815 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.99 149.15 28.74 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.787 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.709 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.5 m -135.15 112.97 10.92 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -178.368 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.556 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 79.4 t90 -92.04 110.64 22.02 Favored 'General case' 0 N--CA 1.445 -0.695 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 178.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.409 ' O ' ' N ' ' A' ' 15' ' ' ILE . 4.2 ttt180 -110.4 131.23 55.24 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.972 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.7 t -49.83 158.86 0.44 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.475 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.416 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 46.1 m -74.74 -37.18 62.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.459 0.647 . . . . 0.0 109.773 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -84.37 -15.96 44.53 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.124 179.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.59 34.55 11.55 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.322 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -85.37 -26.8 26.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.742 0.306 . . . . 0.0 111.309 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.31 164.24 3.18 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.319 0.58 . . . . 0.0 111.441 -179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.709 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.64 147.0 18.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.041 -178.769 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.411 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 38.9 m80 -121.01 119.86 33.74 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.587 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.43 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.43 142.85 28.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.803 -179.905 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.524 ' CG2' ' CD2' ' A' ' 87' ' ' HIS . 1.1 t -131.54 140.22 48.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.49 -179.437 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.416 ' O ' HG12 ' A' ' 45' ' ' ILE . 49.9 t -103.79 96.43 4.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 177.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.782 HD11 HD22 ' A' ' 104' ' ' LEU . 0.8 OUTLIER -41.94 -24.77 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.931 -178.819 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.439 ' OG ' ' HB3' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -74.54 -49.09 23.3 Favored 'General case' 0 CA--C 1.517 -0.293 0 N-CA-C 109.535 -0.542 . . . . 0.0 109.535 179.218 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 46.6 p -64.64 -27.82 69.19 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 178.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.878 HD12 ' HB3' ' A' ' 62' ' ' LEU . 43.2 mm -56.66 106.92 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.27 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.623 178.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.424 ' N ' ' O ' ' A' ' 63' ' ' ILE . 19.5 t70 -52.56 -30.88 33.1 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.119 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.436 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 11.0 pttt -172.49 163.8 5.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.97 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.993 HD11 HD13 ' A' ' 104' ' ' LEU . 21.2 tp -108.95 116.68 32.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.56 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -110.92 144.14 40.46 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.61 0.243 . . . . 0.0 110.439 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.642 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.09 148.9 22.53 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.619 0.247 . . . . 0.0 111.277 -179.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.623 HG23 ' HB2' ' A' ' 59' ' ' MET . 19.6 p -58.82 134.15 86.73 Favored Pre-proline 0 C--N 1.331 -0.216 0 CA-C-N 116.567 -0.288 . . . . 0.0 110.888 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.68 163.27 38.96 Favored 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.568 2.178 . . . . 0.0 112.288 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.58 -31.82 64.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.133 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.5 m -70.84 -15.92 62.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.2 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.788 ' OG ' HD13 ' B' ' 669' ' ' LEU . 8.6 t -75.31 119.91 20.06 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.955 0.407 . . . . 0.0 110.954 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -60.68 -14.1 18.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.683 179.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.404 ' HE3' HD11 ' B' ' 665' ' ' LEU . 0.0 OUTLIER -112.81 174.13 6.05 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.937 179.884 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.402 ' HG2' ' CA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -131.55 114.35 14.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.875 -179.933 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.623 ' HB2' HG23 ' A' ' 51' ' ' THR . 1.8 mpp? -144.58 138.49 27.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.286 -179.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.642 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 15.2 mt -118.71 140.37 50.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.313 178.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.403 ' HD3' ' CB ' ' A' ' 88' ' ' MET . 25.5 ttp180 -141.33 150.42 42.45 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.076 0.465 . . . . 0.0 112.017 -179.106 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.878 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -128.41 114.13 16.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.836 178.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.488 ' HA ' ' HB3' ' A' ' 86' ' ' ARG . 6.7 mm -76.77 156.52 5.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.659 0.266 . . . . 0.0 111.043 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -118.71 159.56 14.35 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.509 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.3 mtpt -59.05 115.1 2.93 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.809 0.337 . . . . 0.0 110.837 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.482 HG22 ' N ' ' A' ' 67' ' ' ASP . 13.3 p -100.98 159.79 3.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.312 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.482 ' N ' HG22 ' A' ' 66' ' ' VAL . 19.7 p-10 -100.39 43.94 1.04 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.798 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.95 -12.07 61.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.308 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -55.0 -24.36 23.88 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.937 0.399 . . . . 0.0 111.115 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.6 mmmt -74.98 -69.36 0.47 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.687 179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 42.97 82.31 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.241 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.402 ' HD3' ' C ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -129.33 168.01 16.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.277 -179.925 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 18.0 mmtp -80.45 -166.91 1.17 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.699 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -109.42 -48.65 3.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.057 0.456 . . . . 0.0 110.931 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 168.87 -31.46 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.089 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -100.13 -16.57 17.78 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.324 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 135.54 -7.05 4.25 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.95 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -57.61 -166.11 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.734 0.302 . . . . 0.0 110.904 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -146.39 131.11 17.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.743 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 48.4 t -95.08 -66.51 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.5 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.444 ' O ' HG13 ' A' ' 81' ' ' VAL . 4.4 p 34.53 81.24 0.24 Allowed Pre-proline 0 CA--C 1.53 0.199 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.684 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_exo -42.11 128.25 4.16 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.954 2.436 . . . . 0.0 112.823 -179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.0 159.07 85.68 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.949 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -84.78 151.39 11.36 Favored 'Trans proline' 0 N--CA 1.461 -0.44 0 C-N-CA 123.492 2.795 . . . . 0.0 112.488 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -104.71 114.26 28.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.776 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.488 ' HB3' ' HA ' ' A' ' 63' ' ' ILE . 23.2 ptt-85 -123.5 146.22 48.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.798 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.524 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 5.1 m-70 -99.74 111.01 23.37 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.403 ' CB ' ' HD3' ' A' ' 61' ' ' ARG . 15.4 ttt -94.19 136.31 34.62 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.071 0.462 . . . . 0.0 111.818 -179.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.94 ' CD2' HD11 ' A' ' 16' ' ' ILE . 19.3 m-85 -133.51 116.69 16.27 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.365 179.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.422 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.8 OUTLIER -87.1 115.94 24.83 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.968 0.413 . . . . 0.0 110.793 -179.959 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.47 ' CE2' HG13 ' A' ' 100' ' ' ILE . 8.6 m-85 -91.1 137.54 32.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.592 -179.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -101.62 29.4 4.9 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.532 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.463 ' CB ' HG23 ' A' ' 96' ' ' VAL . 4.9 m-20 -175.97 119.95 0.16 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.432 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.474 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 10.7 ttp85 -60.98 -15.06 27.26 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.718 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -75.67 -47.57 25.71 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 120.954 0.407 . . . . 0.0 110.387 179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.463 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -66.91 -42.86 89.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.722 179.286 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.474 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -65.76 -36.95 85.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.953 179.415 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.412 ' N ' ' HG3' ' A' ' 97' ' ' MET . 6.4 m-20 -65.25 -27.24 68.51 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.269 179.047 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.452 ' O ' ' HG2' ' A' ' 102' ' ' MET . 66.9 m-20 -81.74 -52.49 7.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.599 179.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.835 HG22 HD11 ' A' ' 104' ' ' LEU . 12.6 mm -63.16 -59.3 4.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 121.094 0.473 . . . . 0.0 110.488 179.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.52 ' HA ' HD12 ' A' ' 104' ' ' LEU . 6.4 ttmt -47.33 -36.31 9.24 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.415 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.452 ' HG2' ' O ' ' A' ' 99' ' ' ASN . 7.7 ptp -83.47 -37.78 22.69 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.726 -179.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.958 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -70.9 -27.68 63.97 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.181 -178.954 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.993 HD13 HD11 ' A' ' 48' ' ' LEU . 5.4 mt -71.22 -43.34 67.53 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.41 ' HA ' HG13 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -62.97 -50.39 70.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.243 -0.889 . . . . 0.0 112.449 -179.448 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.49 ' HG3' ' O ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -49.29 -30.29 7.17 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.072 0.463 . . . . 0.0 110.656 -179.295 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.02 HG22 ' HE1' ' A' ' 111' ' ' TYR . 9.0 mt -85.03 -52.72 12.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.412 179.314 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.674 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.39 -56.75 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.298 179.396 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -46.88 -28.15 1.49 Allowed 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.295 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.542 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.0 OUTLIER -73.46 -25.01 60.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.177 179.73 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 1.02 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -74.04 -35.22 64.32 Favored 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 179.576 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.751 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.28 -42.89 18.23 Favored 'General case' 0 CA--C 1.505 -0.754 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 179.019 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -61.54 -32.03 72.08 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.014 -1.448 . . . . 0.0 108.957 178.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.444 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.58 -18.95 22.44 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.752 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.8 t0 . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.235 -0.888 . . . . 0.0 111.045 179.998 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 17.4 p-10 . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.859 0.361 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 662' ' ' LEU . . . . . 0.645 HD23 ' HB2' ' B' ' 663' ' ' GLU . 8.7 tt -60.43 -48.25 82.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.852 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 663' ' ' GLU . . . . . 0.645 ' HB2' HD23 ' B' ' 662' ' ' LEU . 13.0 tt0 -176.86 80.02 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.989 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 21.5 t 64.35 94.41 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.1 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 665' ' ' LEU . . . . . 0.735 ' CD1' HD21 ' B' ' 669' ' ' LEU . 1.9 pt? -95.07 167.18 11.54 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.905 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 666' ' ' SER . . . . . 0.481 ' O ' ' CD1' ' B' ' 670' ' ' PHE . 0.1 OUTLIER -179.53 -73.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.036 0.446 . . . . 0.0 111.13 179.9 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -94.02 19.44 9.11 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.614 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -92.64 -46.26 7.68 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.537 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.788 HD13 ' OG ' ' A' ' 55' ' ' SER . 4.6 pp -120.53 20.01 11.88 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.472 -179.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 670' ' ' PHE . . . . . 0.481 ' CD1' ' O ' ' B' ' 666' ' ' SER . 1.5 m-85 -88.5 141.68 28.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.904 0.383 . . . . 0.0 111.275 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -128.66 126.91 41.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.622 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -67.78 108.85 3.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.121 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 673' ' ' VAL . . . . . 0.771 HG21 HD23 ' A' ' 48' ' ' LEU . 33.8 m -58.22 138.37 84.47 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.727 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -54.6 127.98 28.33 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.276 1.984 . . . . 0.0 112.427 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -139.47 116.94 11.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.684 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 11.4 pttt -179.52 161.71 1.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.944 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 94.5 p -111.14 -22.64 11.33 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.223 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 59.5 95.28 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.888 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 679' ' ' ILE . . . . . 0.679 HD13 ' H ' ' B' ' 679' ' ' ILE . 0.2 OUTLIER -139.34 31.28 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.164 179.956 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.934 179.991 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo . . . . . 0 N--CA 1.489 1.248 0 CA-C-O 120.838 0.266 . . . . 0.0 111.827 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.4 ' HA ' ' HB3' ' A' ' 99' ' ' ASN . 0.1 OUTLIER -104.34 -37.54 7.19 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.824 -179.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.662 ' HA ' HG21 ' A' ' 103' ' ' THR . 1.6 t-160 -61.39 -13.07 17.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.826 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.462 ' C ' HD11 ' A' ' 100' ' ' ILE . 0.5 OUTLIER -137.99 161.7 36.03 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.023 0.44 . . . . 0.0 110.875 179.881 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.531 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 171.54 138.76 2.61 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 111.168 -0.773 . . . . 0.0 111.168 -179.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.556 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -84.13 140.95 31.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.075 0.464 . . . . 0.0 112.228 -178.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.563 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -149.65 171.25 16.97 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.254 -179.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.661 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.93 125.12 56.12 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.707 -179.667 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.476 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.5 t80 -125.28 109.49 12.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.912 0.387 . . . . 0.0 111.12 178.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 47.1 mt-10 67.51 49.15 1.03 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.9 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 4.4 mmmt 71.76 -4.88 1.8 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.225 -0.443 . . . . 0.0 112.17 179.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.462 ' O ' HG23 ' A' ' 8' ' ' ILE . 17.1 t -100.91 148.72 6.75 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.458 0 CA-C-O 121.087 0.47 . . . . 0.0 110.526 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.459 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -111.6 113.09 25.27 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.898 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.877 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.4 -133.29 3.47 Favored Glycine 0 N--CA 1.445 -0.713 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.03 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.877 HD13 ' O ' ' A' ' 14' ' ' GLY . 19.4 mm -136.31 135.9 49.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 120.648 0.261 . . . . 0.0 111.297 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.879 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.81 140.8 18.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 106.452 -1.684 . . . . 0.0 106.452 176.637 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.447 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.32 117.17 5.49 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 121.687 0.756 . . . . 0.0 111.244 -178.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.825 HD13 ' HB ' ' A' ' 103' ' ' THR . 7.5 mt -81.73 143.22 12.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 114.481 -1.236 . . . . 0.0 112.578 -178.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -126.17 111.71 14.94 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.245 179.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.451 ' HG2' ' NE2' ' A' ' 3' ' ' HIS . 0.0 OUTLIER -100.41 -2.58 33.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.261 -179.541 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -74.87 -4.87 40.48 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.985 0.421 . . . . 0.0 110.241 178.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.437 HG21 ' CG ' ' A' ' 26' ' ' GLU . 0.0 OUTLIER -92.29 -159.7 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.176 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.427 179.784 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.428 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 33.4 p -179.27 99.29 0.2 Allowed Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.545 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.451 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 10.6 Cg_exo -71.04 164.97 81.54 Favored 'Cis proline' 0 C--N 1.347 0.471 0 C-N-CA 123.697 -1.376 . . . . 0.0 112.625 0.322 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.439 ' CB ' HG21 ' A' ' 107' ' ' ILE . . . -56.14 176.15 0.08 Allowed 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.562 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.518 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.84 139.6 6.41 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.017 178.97 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.777 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.4 OUTLIER -107.71 146.37 32.19 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 178.722 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.69 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.0 OUTLIER -128.49 112.93 14.87 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -178.201 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.535 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 78.5 t90 -92.13 110.63 22.01 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.488 ' O ' ' N ' ' A' ' 15' ' ' ILE . 18.9 ttm180 -110.6 131.55 54.95 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.67 0.271 . . . . 0.0 110.934 -179.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 21.3 m -49.97 159.33 0.42 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.489 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.415 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 42.5 m -74.91 -37.1 62.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.358 0.599 . . . . 0.0 109.737 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -84.91 -15.96 42.76 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.184 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.94 34.28 11.23 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.311 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -85.26 -26.22 26.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.722 0.296 . . . . 0.0 111.386 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.43 164.79 3.18 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.24 0.543 . . . . 0.0 111.546 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.69 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.35 146.89 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.051 -178.822 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.419 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 35.3 m80 -121.04 120.33 35.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.614 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.62 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.42 138.8 33.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.691 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.572 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -125.32 140.43 48.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.458 -179.623 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.538 ' CG1' HG23 ' A' ' 44' ' ' THR . 44.1 t -104.08 94.42 3.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 177.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.665 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.6 OUTLIER -42.1 -24.8 0.05 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.088 -0.506 . . . . 0.0 112.031 -178.864 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.451 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 1.2 t -76.02 -48.62 20.28 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.538 HG23 ' CG1' ' A' ' 41' ' ' VAL . 30.0 p -64.58 -27.88 69.25 Favored 'General case' 0 N--CA 1.441 -0.891 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 178.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.86 HD12 ' HB3' ' A' ' 62' ' ' LEU . 44.8 mm -56.54 109.12 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.536 178.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 63' ' ' ILE . 24.3 t0 -53.22 -31.84 45.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.829 0.347 . . . . 0.0 110.933 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.414 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 11.2 pttt -172.66 164.65 5.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.836 179.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 1.054 HD11 HD13 ' A' ' 104' ' ' LEU . 8.2 tp -108.88 116.36 31.84 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.611 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -110.04 144.86 38.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.638 0.256 . . . . 0.0 110.542 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.656 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -156.98 145.74 19.91 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.634 0.254 . . . . 0.0 111.082 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.57 HG21 ' O ' ' A' ' 57' ' ' LYS . 54.5 p -60.11 143.14 88.83 Favored Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.724 0.297 . . . . 0.0 110.978 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.85 163.25 33.77 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.652 2.234 . . . . 0.0 112.436 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.98 -29.36 70.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.121 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.9 m -70.85 -18.12 62.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.131 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.3 t -97.28 115.51 27.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.945 0.402 . . . . 0.0 110.791 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -57.99 -17.59 18.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.753 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.687 ' HG3' HD22 ' B' ' 669' ' ' LEU . 10.3 mmmt -82.21 98.92 8.98 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.735 179.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.2 mpp? -83.11 111.07 18.56 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.771 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.533 ' HB2' HG23 ' A' ' 51' ' ' THR . 29.8 mtm -149.5 142.31 24.67 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.637 -179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.656 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 18.7 mt -119.47 143.37 47.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.065 178.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.421 ' HG3' ' O ' ' A' ' 87' ' ' HIS . 24.3 ttp180 -143.59 150.58 39.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.968 0.413 . . . . 0.0 111.699 -179.049 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.86 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.7 mp -128.02 115.18 18.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.776 178.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.458 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 6.4 mm -76.53 156.44 5.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.661 0.267 . . . . 0.0 110.89 -179.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -120.4 144.36 17.07 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.484 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -58.85 122.3 13.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.801 0.334 . . . . 0.0 110.852 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.509 HG22 ' N ' ' A' ' 67' ' ' ASP . 14.6 p -95.38 159.53 2.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.313 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.509 ' N ' HG22 ' A' ' 66' ' ' VAL . 21.0 p-10 -108.01 55.62 0.64 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.877 -0.602 . . . . 0.0 109.857 179.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.95 41.45 1.0 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.371 -179.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 32.8 t -110.52 -19.68 12.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.082 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 8.9 mmtp -81.54 -55.43 4.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.857 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.477 ' HA ' HG23 ' A' ' 81' ' ' VAL . 0.6 OUTLIER 61.34 93.07 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.899 179.974 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -95.37 -173.71 2.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.918 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.432 ' CA ' HG23 ' A' ' 80' ' ' VAL . 0.0 OUTLIER -128.0 -176.63 3.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.712 179.779 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -106.09 -39.58 5.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.988 0.423 . . . . 0.0 110.81 179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 165.14 -30.14 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.597 -0.728 . . . . 0.0 110.821 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -108.56 40.11 1.85 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.032 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 69.35 11.4 64.53 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.517 -0.849 . . . . 0.0 112.47 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.408 ' O ' ' HG3' ' A' ' 73' ' ' LYS . 0.6 OUTLIER -56.6 -165.69 0.0 OUTLIER 'General case' 0 C--N 1.334 -0.108 0 CA-C-O 120.692 0.282 . . . . 0.0 110.84 179.893 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -135.54 120.88 19.11 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.858 0.361 . . . . 0.0 111.016 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.432 HG23 ' CA ' ' A' ' 73' ' ' LYS . 63.0 t -91.99 -63.52 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.494 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.661 ' O ' HG12 ' A' ' 81' ' ' VAL . 0.9 OUTLIER 40.7 94.21 0.05 OUTLIER Pre-proline 0 CA--C 1.535 0.38 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.093 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -50.66 134.11 39.8 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.515 2.144 . . . . 0.0 112.478 -179.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.73 161.53 73.93 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.915 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -82.44 145.58 13.37 Favored 'Trans proline' 0 N--CA 1.461 -0.426 0 C-N-CA 123.563 2.842 . . . . 0.0 112.278 -179.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -94.87 157.97 15.69 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.0 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.87 138.54 3.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.761 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.506 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 4.3 m-70 -100.73 111.34 23.56 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.834 0.349 . . . . 0.0 110.262 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.3 142.14 27.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.149 0.5 . . . . 0.0 111.406 -179.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.879 ' CD2' HD11 ' A' ' 16' ' ' ILE . 61.0 m-85 -139.86 116.83 11.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.574 179.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -91.22 115.16 27.8 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.926 0.393 . . . . 0.0 110.596 179.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.458 ' CE2' HG13 ' A' ' 100' ' ' ILE . 8.7 m-85 -91.05 136.85 32.8 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.533 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 20.2 m-20 -100.24 29.52 4.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.424 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.46 ' CB ' HG23 ' A' ' 96' ' ' VAL . 5.2 m-20 -175.58 116.74 0.15 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.541 -179.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.481 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -57.2 -16.48 8.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.957 179.803 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.43 -49.75 21.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.852 0.358 . . . . 0.0 110.265 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.46 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -65.82 -41.52 90.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.637 179.26 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.481 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -66.67 -37.94 85.8 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.955 179.472 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.429 ' N ' ' HG3' ' A' ' 97' ' ' MET . 20.1 m-20 -66.67 -24.64 66.3 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.112 0.482 . . . . 0.0 109.921 178.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.4 ' HB3' ' HA ' ' A' ' 2' ' ' SER . 2.9 m-80 -81.71 -63.24 1.43 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.358 179.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.761 HG22 HD11 ' A' ' 104' ' ' LEU . 14.3 mm -53.48 -53.85 22.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.579 179.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.454 ' HA ' HD12 ' A' ' 104' ' ' LEU . 0.2 OUTLIER -51.4 -29.55 16.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.924 179.908 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 5.1 mtm -83.08 -48.11 10.94 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.132 179.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.825 ' HB ' HD13 ' A' ' 18' ' ' ILE . 0.2 OUTLIER -53.38 -58.11 8.27 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.109 179.554 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 1.054 HD13 HD11 ' A' ' 48' ' ' LEU . 3.9 mt -46.34 -53.34 11.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.192 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -58.33 -45.58 87.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.167 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.438 ' HG2' HG13 ' A' ' 107' ' ' ILE . 0.5 OUTLIER -51.34 -32.95 27.4 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.048 0.452 . . . . 0.0 110.287 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.029 HG22 ' HE1' ' A' ' 111' ' ' TYR . 10.3 mt -85.82 -52.11 12.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.51 179.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.695 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.14 -57.22 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.56 179.623 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -47.25 -27.05 1.37 Allowed 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.597 -0.728 . . . . 0.0 111.067 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.439 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 27.1 mtt180 -73.25 -25.08 60.57 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.359 179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 1.029 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -75.68 -34.15 60.42 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.734 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.762 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.66 -43.35 17.02 Favored 'General case' 0 CA--C 1.507 -0.7 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 178.945 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -61.44 -32.07 72.03 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 113.858 -1.519 . . . . 0.0 108.987 178.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.439 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.64 -18.88 22.48 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.666 178.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 37.6 t70 . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.301 -0.857 . . . . 0.0 111.092 179.9 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 661' ' ' ASP . . . . . 0.504 ' O ' HD22 ' B' ' 662' ' ' LEU . 1.1 m-20 . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.808 0.337 . . . . 0.0 111.213 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 662' ' ' LEU . . . . . 0.504 HD22 ' O ' ' B' ' 661' ' ' ASP . 4.4 mm? -122.84 -50.37 1.95 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.845 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 60.91 92.63 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.837 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 664' ' ' VAL . . . . . 0.416 HG23 ' OE1' ' B' ' 668' ' ' GLU . 6.2 m -139.23 77.22 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.144 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 665' ' ' LEU . . . . . 0.938 HD21 HD21 ' B' ' 669' ' ' LEU . 0.3 OUTLIER -97.5 109.95 22.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.891 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 666' ' ' SER . . . . . 0.434 ' O ' ' CD1' ' B' ' 670' ' ' PHE . 26.3 p -177.68 -80.37 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.992 0.425 . . . . 0.0 111.04 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -94.17 19.31 9.47 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.585 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 668' ' ' GLU . . . . . 0.416 ' OE1' HG23 ' B' ' 664' ' ' VAL . 0.5 OUTLIER -93.87 -39.31 10.77 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.117 -179.909 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.938 HD21 HD21 ' B' ' 665' ' ' LEU . 0.8 OUTLIER -120.58 19.89 11.87 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.215 179.939 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 670' ' ' PHE . . . . . 0.45 ' CE1' ' HB2' ' A' ' 59' ' ' MET . 1.5 m-85 -98.83 158.25 15.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.881 0.372 . . . . 0.0 111.06 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -149.87 126.99 11.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.829 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -60.62 123.71 18.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.049 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 673' ' ' VAL . . . . . 0.992 HG21 HD23 ' A' ' 48' ' ' LEU . 25.9 m -74.35 146.38 84.02 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.973 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -56.32 128.33 29.69 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.476 2.117 . . . . 0.0 112.288 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -139.15 116.96 11.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.802 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -178.75 166.0 1.67 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.92 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 54.0 p -126.03 38.87 4.06 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.939 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 -176.59 134.59 0.23 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.947 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 679' ' ' ILE . . . . . 0.466 HG23 ' O ' ' B' ' 679' ' ' ILE . 3.3 tt -149.48 53.59 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.998 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.911 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo . . . . . 0 N--CA 1.488 1.164 0 CA-C-O 120.87 0.279 . . . . 0.0 111.845 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.567 ' O ' HG21 ' A' ' 103' ' ' THR . 18.4 m -106.82 -31.56 8.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.888 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -84.76 13.91 5.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.456 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.558 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 2.6 p -154.0 150.41 28.24 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.303 0.573 . . . . 0.0 111.335 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.471 ' O ' ' HB ' ' A' ' 16' ' ' ILE . . . 178.64 138.68 3.25 Favored Glycine 0 N--CA 1.448 -0.511 0 N-CA-C 110.843 -0.903 . . . . 0.0 110.843 -179.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.58 145.74 29.55 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.556 ' C ' HD13 ' A' ' 8' ' ' ILE . . . -154.41 171.38 19.43 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.337 -179.11 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.666 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.63 122.58 55.15 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.82 -179.466 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.454 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.6 t80 -123.1 109.35 13.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.949 0.404 . . . . 0.0 111.237 178.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.426 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 24.8 mt-10 68.11 49.07 0.89 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.812 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 13.1 mttm 71.5 -3.82 2.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.237 -0.438 . . . . 0.0 112.137 179.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.436 ' O ' HG23 ' A' ' 8' ' ' ILE . 18.2 t -101.68 148.5 7.37 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.55 0 CA-C-O 121.123 0.487 . . . . 0.0 110.587 179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.456 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -110.7 112.89 25.08 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.806 179.865 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.888 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.5 -135.12 3.69 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.006 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.888 HD13 ' O ' ' A' ' 14' ' ' GLY . 18.2 mm -135.87 134.93 51.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.543 0 CA-C-O 120.608 0.242 . . . . 0.0 111.435 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.897 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.43 141.71 16.85 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.649 0 N-CA-C 106.305 -1.739 . . . . 0.0 106.305 176.388 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.558 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -150.87 118.62 6.15 Favored 'General case' 0 C--N 1.31 -1.117 0 C-N-CA 119.64 -0.824 . . . . 0.0 111.542 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.764 HD13 ' HB ' ' A' ' 103' ' ' THR . 11.0 mt -86.71 142.02 13.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 114.697 -1.138 . . . . 0.0 111.887 -178.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.626 ' O ' HG23 ' A' ' 22' ' ' VAL . 1.8 t30 -118.97 93.1 3.98 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.316 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -80.79 0.02 36.64 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.33 -179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -82.66 0.6 42.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.624 0.249 . . . . 0.0 111.304 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.626 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.04 -162.76 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.807 0.337 . . . . 0.0 110.832 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.4 t -175.97 101.75 0.25 Allowed Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.339 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.446 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 11.0 Cg_exo -69.95 161.46 86.7 Favored 'Cis proline' 0 C--N 1.347 0.483 0 C-N-CA 123.597 -1.418 . . . . 0.0 112.619 0.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.647 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -54.76 178.49 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.3 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.457 ' CG ' HG21 ' A' ' 22' ' ' VAL . 2.5 pp20? -163.67 133.92 4.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.331 179.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.853 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.92 144.5 35.09 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 178.706 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.722 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.3 m -131.48 113.64 13.93 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.702 0.631 . . . . 0.0 112.702 -178.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.553 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 78.8 t90 -92.06 110.43 21.8 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 178.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.462 ' O ' ' N ' ' A' ' 15' ' ' ILE . 22.4 ttt-85 -110.2 131.11 55.35 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.674 0.274 . . . . 0.0 110.822 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.1 m -49.91 158.22 0.53 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.626 0.25 . . . . 0.0 110.493 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.416 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 44.7 m -74.1 -37.0 64.29 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.421 0.629 . . . . 0.0 109.751 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -84.48 -16.25 43.14 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.021 -0.991 . . . . 0.0 111.087 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.66 34.42 11.59 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.302 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -85.88 -25.76 26.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.688 0.28 . . . . 0.0 111.425 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.68 164.18 2.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.314 0.578 . . . . 0.0 111.35 -179.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.722 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.65 147.91 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.048 -178.767 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 50.0 m-70 -122.09 119.19 30.61 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.734 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.428 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.49 141.2 30.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.831 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.552 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -127.5 141.01 47.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.449 -179.511 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.449 ' O ' HG12 ' A' ' 45' ' ' ILE . 21.1 t -103.89 93.54 2.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 178.138 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.713 HD11 HD22 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -41.23 -25.12 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 116.09 -0.504 . . . . 0.0 112.11 -178.827 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.446 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.3 OUTLIER -74.66 -49.79 20.11 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 179.175 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.408 HG23 ' HB ' ' A' ' 41' ' ' VAL . 30.0 p -64.66 -27.51 68.98 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 178.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.9 HD12 ' HB3' ' A' ' 62' ' ' LEU . 34.5 mm -56.6 109.24 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.204 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.661 179.044 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.414 ' N ' ' O ' ' A' ' 63' ' ' ILE . 12.6 t70 -51.76 -34.01 37.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.137 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.43 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 0.7 OUTLIER -169.64 165.41 10.15 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.089 179.856 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.763 HD11 HD13 ' A' ' 104' ' ' LEU . 45.1 tp -108.77 118.3 36.44 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.499 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.412 ' HB3' ' HB3' ' A' ' 61' ' ' ARG . 4.4 tt0 -115.76 147.22 41.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.602 0.239 . . . . 0.0 110.512 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.664 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.14 137.2 12.62 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.148 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.517 HG21 ' O ' ' A' ' 57' ' ' LYS . 42.8 p -55.33 121.19 35.85 Favored Pre-proline 0 CA--C 1.53 0.207 0 CA-C-O 120.58 0.229 . . . . 0.0 110.865 -179.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -68.23 163.4 36.36 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.45 2.1 . . . . 0.0 112.347 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -51.52 -31.0 22.36 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.338 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.7 t -70.85 -17.6 62.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.068 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.7 t -82.0 119.8 24.45 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.873 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -64.29 -11.45 32.02 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.866 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.517 ' O ' HG21 ' A' ' 51' ' ' THR . 0.0 OUTLIER -111.7 108.7 18.24 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.941 0.401 . . . . 0.0 111.134 -179.994 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.427 ' HB2' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -76.72 106.69 8.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.632 179.815 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.441 ' HB2' ' CZ ' ' B' ' 670' ' ' PHE . 35.2 mtm -149.65 155.51 40.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.132 0.491 . . . . 0.0 111.983 -179.365 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.664 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 28.6 mt -123.38 149.76 44.55 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.165 178.419 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.447 ' HB2' ' CE2' ' B' ' 670' ' ' PHE . 28.4 ttp180 -146.18 150.87 36.67 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.916 0.389 . . . . 0.0 112.029 -179.131 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.9 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.3 mp -128.34 116.87 20.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.175 178.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.8 HD12 ' HD3' ' A' ' 86' ' ' ARG . 22.6 mm -76.64 156.47 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.683 0.277 . . . . 0.0 111.011 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.425 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -122.41 169.2 14.94 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.352 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.95 118.18 31.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.768 0.318 . . . . 0.0 110.935 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.435 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 10.2 p -72.61 160.34 5.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.613 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.432 ' N ' HG22 ' A' ' 66' ' ' VAL . 10.9 t0 -128.02 35.75 4.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.757 0.313 . . . . 0.0 111.411 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 17.7 pt-20 40.31 31.87 0.11 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.522 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.8 m -95.32 -26.61 15.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.877 0.37 . . . . 0.0 110.986 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.09 -77.74 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.751 179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.6 mtpm? 56.15 89.95 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.002 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.99 123.15 48.34 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.823 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -75.38 159.93 30.85 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.851 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -97.32 -64.04 1.08 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.085 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -178.05 -34.71 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.172 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -92.0 40.8 1.05 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.115 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 59.43 18.01 42.02 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.777 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -90.97 118.21 30.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.746 0.307 . . . . 0.0 110.836 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -87.57 115.8 25.25 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.822 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 17.4 t -111.79 139.25 37.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.638 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.419 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 35.9 t -96.34 90.12 0.68 Allowed Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.462 179.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 81' ' ' VAL . 1.4 Cg_endo -45.44 151.0 1.12 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.861 2.374 . . . . 0.0 112.759 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 18.1 mttt -46.47 166.34 0.17 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.543 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.435 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 7.8 Cg_exo -77.17 148.33 27.16 Favored 'Trans proline' 0 N--CA 1.464 -0.22 0 C-N-CA 123.72 2.947 . . . . 0.0 112.294 -179.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -50.33 156.56 0.83 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.953 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.8 ' HD3' HD12 ' A' ' 63' ' ' ILE . 0.3 OUTLIER -154.61 138.79 16.55 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.776 -179.86 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.47 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 5.6 m-70 -102.84 111.26 23.5 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 179.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.43 ' CE ' ' CE1' ' B' ' 670' ' ' PHE . 2.8 ttt -109.34 131.5 55.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.269 -179.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.897 ' CD2' HD11 ' A' ' 16' ' ' ILE . 0.3 OUTLIER -131.05 117.18 18.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.376 179.684 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -84.13 114.32 21.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.231 -179.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.508 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 7.8 m-85 -91.17 136.36 33.14 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.945 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 59.3 m-20 -93.52 43.46 1.12 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.789 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.602 ' HB3' HG23 ' A' ' 96' ' ' VAL . 1.8 m-20 175.2 113.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.229 -179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.438 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -56.16 -17.41 7.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.079 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.95 -45.66 56.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.1 0.476 . . . . 0.0 110.171 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.602 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -65.32 -49.57 77.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.396 179.087 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.448 ' O ' HD11 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -62.62 -37.09 84.92 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.727 179.731 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.408 ' HA ' ' HG2' ' A' ' 101' ' ' LYS . 69.1 m-20 -73.35 -31.08 63.75 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.029 0.442 . . . . 0.0 110.445 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -80.25 -27.92 38.57 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.291 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.536 HG23 HD11 ' A' ' 18' ' ' ILE . 1.6 mm -85.13 -52.82 11.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.699 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.408 ' HG2' ' HA ' ' A' ' 98' ' ' ASP . 8.6 ptpt -48.59 -28.97 3.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.796 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.415 ' HG2' ' N ' ' A' ' 103' ' ' THR . 0.8 OUTLIER -78.11 -39.81 40.19 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.081 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.764 ' HB ' HD13 ' A' ' 18' ' ' ILE . 0.2 OUTLIER -59.05 -61.03 2.94 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.501 179.551 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.763 HD13 HD11 ' A' ' 48' ' ' LEU . 7.3 mt -46.76 -56.09 6.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.715 179.397 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.405 ' OE1' ' HB ' ' B' ' 673' ' ' VAL . 0.0 OUTLIER -55.67 -45.51 77.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.054 179.378 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -51.92 -35.36 45.42 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-O 121.168 0.508 . . . . 0.0 110.57 -179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.042 HG22 ' HE1' ' A' ' 111' ' ' TYR . 11.3 mt -85.75 -51.08 13.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.669 179.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.678 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -42.25 -57.03 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.585 179.654 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -47.15 -28.47 1.83 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.261 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.521 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 3.1 mtt180 -72.44 -24.89 61.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.28 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 1.042 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -74.57 -36.11 63.05 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 179.77 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.752 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.46 -43.45 17.24 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 107.875 -1.158 . . . . 0.0 107.875 179.039 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -60.96 -30.35 70.19 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 113.93 -1.486 . . . . 0.0 108.922 178.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.456 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -91.33 -20.89 21.37 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.594 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 25.7 m-20 . . . . . 0 C--O 1.248 1.008 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.865 179.742 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 120.843 0.354 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 3.4 mp -97.81 -44.02 6.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.927 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 663' ' ' GLU . . . . . 0.447 ' O ' HG12 ' B' ' 664' ' ' VAL . 4.5 mt-10 60.62 49.27 6.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.889 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 664' ' ' VAL . . . . . 0.603 ' O ' HG22 ' B' ' 664' ' ' VAL . 14.6 p 43.74 39.83 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.157 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.506 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 665' ' ' LEU . . . . . 0.884 HD21 HD11 ' B' ' 669' ' ' LEU . 1.5 tm? -76.5 108.75 9.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.852 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 666' ' ' SER . . . . . 0.439 ' O ' ' CD1' ' B' ' 670' ' ' PHE . 12.6 p -179.04 -39.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.004 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -94.3 19.33 9.61 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.681 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -101.97 -35.74 8.86 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.557 -179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.884 HD11 HD21 ' B' ' 665' ' ' LEU . 0.0 OUTLIER -120.61 20.02 11.83 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.534 -179.868 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 670' ' ' PHE . . . . . 0.447 ' CE2' ' HB2' ' A' ' 61' ' ' ARG . 1.6 m-85 -101.41 148.42 25.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.891 0.377 . . . . 0.0 111.073 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -140.64 126.9 19.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.77 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -59.84 108.01 0.69 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.91 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 673' ' ' VAL . . . . . 0.576 HG22 ' O ' ' A' ' 48' ' ' LEU . 2.6 m -56.04 157.25 8.8 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.014 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.21 131.4 40.96 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.707 2.271 . . . . 0.0 112.555 -179.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.11 136.27 35.0 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.703 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.46 165.67 2.04 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.939 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 1.5 m -176.62 121.87 0.15 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.898 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -135.37 151.61 50.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.871 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 679' ' ' ILE . . . . . 0.609 ' O ' HD12 ' B' ' 679' ' ' ILE . 2.7 pp -138.09 31.16 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.12 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 2.9 m . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.953 179.964 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo . . . . . 0 N--CA 1.487 1.14 0 CA-C-O 120.865 0.277 . . . . 0.0 111.633 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.83 -32.42 67.52 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.983 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.427 ' CE1' ' HB2' ' A' ' 20' ' ' GLU . 30.5 m170 -90.38 14.36 13.09 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.5 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.56 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 2.7 p -151.85 154.69 36.66 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.222 0.534 . . . . 0.0 111.242 179.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.515 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 172.37 137.98 2.47 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 -179.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.571 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.94 144.34 30.08 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -178.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.673 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . . . -155.38 171.38 19.97 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.062 -179.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.711 HD12 ' HA ' ' A' ' 13' ' ' SER . 4.8 mm -102.16 128.82 54.41 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 N-CA-C 112.141 0.423 . . . . 0.0 112.141 -179.646 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.459 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.8 t80 -127.29 109.38 11.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.0 0.429 . . . . 0.0 110.889 177.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 22.4 mt-10 69.0 50.38 0.59 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.747 179.242 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.6 mttt 69.77 -4.76 1.36 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.134 -0.484 . . . . 0.0 112.084 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.531 ' O ' HG23 ' A' ' 8' ' ' ILE . 13.8 t -101.55 144.24 13.39 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.476 0 CA-C-O 121.201 0.524 . . . . 0.0 110.745 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.711 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -99.25 113.83 26.31 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.898 179.957 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -136.04 -168.1 11.42 Favored Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.84 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.571 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 14.0 mm -107.59 136.21 43.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 120.76 0.314 . . . . 0.0 111.285 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.912 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.73 141.37 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 176.808 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.56 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.52 117.25 5.44 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 119.634 -0.827 . . . . 0.0 111.469 -178.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.878 HD11 HG23 ' A' ' 100' ' ' ILE . 5.3 mt -85.63 142.75 12.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.629 -178.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.64 ' O ' HG23 ' A' ' 22' ' ' VAL . 2.6 t30 -119.45 96.37 5.18 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.609 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.558 ' HG3' HD11 ' A' ' 107' ' ' ILE . 1.5 mt-10 -79.86 -0.86 36.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.261 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -81.86 -0.06 41.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.612 0.244 . . . . 0.0 111.387 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.64 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -100.97 -162.45 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-O 120.82 0.343 . . . . 0.0 110.74 179.883 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 53.8 p -176.51 100.23 0.24 Allowed Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.37 179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.435 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 13.4 Cg_exo -68.91 165.82 73.18 Favored 'Cis proline' 0 C--N 1.346 0.409 0 C-N-CA 123.626 -1.406 . . . . 0.0 112.723 0.36 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.686 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -56.79 178.03 0.07 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.153 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.431 ' HG2' ' HA ' ' A' ' 41' ' ' VAL . 9.1 mt-10 -163.4 133.49 4.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.429 179.458 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.808 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -108.11 140.78 40.8 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.58 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.511 HG22 ' CG2' ' A' ' 37' ' ' VAL . 8.2 m -126.08 112.86 16.34 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -178.314 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.511 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 73.8 t90 -91.98 110.4 21.76 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 178.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.401 ' O ' ' N ' ' A' ' 15' ' ' ILE . 15.3 ttt180 -107.35 131.03 54.69 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.668 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 27.1 t -49.88 156.21 0.77 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.718 0.294 . . . . 0.0 110.654 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 21.4 m -73.77 -34.35 64.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.223 0.535 . . . . 0.0 109.832 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -87.36 -16.58 34.58 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.187 179.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.35 33.72 11.39 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.306 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -87.61 -25.83 23.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.694 0.283 . . . . 0.0 111.451 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.53 165.1 3.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.308 0.575 . . . . 0.0 111.537 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.511 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.5 OUTLIER -142.42 155.43 18.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.934 -178.853 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -130.03 119.33 22.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.709 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.48 138.9 33.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.599 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.553 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -126.16 141.12 46.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.5 -179.5 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.527 ' CG1' HG23 ' A' ' 44' ' ' THR . 41.7 t -103.87 94.39 3.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 178.057 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.749 HD11 HD22 ' A' ' 104' ' ' LEU . 0.5 OUTLIER -41.94 -25.49 0.06 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.836 -179.085 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.435 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -74.88 -49.2 21.24 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 179.236 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.527 HG23 ' CG1' ' A' ' 41' ' ' VAL . 30.3 p -64.7 -27.54 68.98 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 178.451 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.861 HD12 ' HB3' ' A' ' 62' ' ' LEU . 39.9 mm -56.32 104.44 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.357 178.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' A' ' 63' ' ' ILE . 31.5 t70 -47.98 -31.73 5.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.841 0.353 . . . . 0.0 111.297 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.426 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 1.1 pttt -172.54 162.13 5.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.792 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.979 HD11 HD13 ' A' ' 104' ' ' LEU . 10.6 tp -108.91 122.42 47.18 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.757 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.476 ' OE1' HD11 ' A' ' 63' ' ' ILE . 11.6 mt-30 -119.65 146.31 45.68 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.567 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.683 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.08 138.86 14.21 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.673 -0.239 . . . . 0.0 111.101 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.463 ' CG2' ' CE1' ' B' ' 670' ' ' PHE . 37.1 p -60.16 142.42 89.72 Favored Pre-proline 0 C--N 1.332 -0.167 0 CA-C-O 120.643 0.259 . . . . 0.0 110.894 -179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.87 163.28 39.35 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 122.584 2.19 . . . . 0.0 112.551 -179.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.685 ' HB2' HH21 ' A' ' 94' ' ' ARG . . . -65.38 -25.25 67.48 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.276 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 22.3 p -70.57 -18.38 62.91 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.046 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 74.6 m -103.07 113.24 26.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.769 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -57.09 -17.97 12.65 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.879 179.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.493 ' HE2' HD13 ' B' ' 665' ' ' LEU . 27.0 mmmt -71.96 72.3 0.84 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.892 179.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.419 ' HG2' ' N ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -58.11 106.71 0.4 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.75 179.926 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.462 ' H ' ' HG1' ' A' ' 51' ' ' THR . 25.1 mtm -149.79 138.38 20.79 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.073 0.463 . . . . 0.0 112.012 -179.48 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.683 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 22.3 mt -118.06 145.01 45.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.712 178.272 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.44 ' HG3' ' HA ' ' A' ' 88' ' ' MET . 10.5 ttm-85 -143.43 147.38 34.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.005 0.431 . . . . 0.0 112.131 -179.004 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.861 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.6 mp -128.3 115.05 17.7 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.662 178.436 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.476 HD11 ' OE1' ' A' ' 49' ' ' GLN . 6.8 mm -76.76 156.19 5.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 C-N-CA 121.02 -0.272 . . . . 0.0 111.016 -179.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -117.79 149.14 18.58 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.551 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 66.8 mttt -60.1 116.08 3.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.87 0.367 . . . . 0.0 110.768 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.508 HG22 ' N ' ' A' ' 67' ' ' ASP . 15.0 p -98.91 159.6 3.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.431 -179.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.508 ' N ' HG22 ' A' ' 66' ' ' VAL . 0.5 OUTLIER -109.19 57.22 0.61 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.82 179.076 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -88.25 33.67 0.74 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.555 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 67.8 p -81.88 -19.1 41.58 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.793 0.33 . . . . 0.0 111.067 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 12.3 mmtp -79.82 -78.33 0.16 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.855 179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.697 ' HG2' HG23 ' A' ' 81' ' ' VAL . 6.2 mttt 58.89 91.84 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.765 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.21 -178.32 7.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.197 -179.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.6 mmtt -82.43 -178.93 7.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.762 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -113.38 -37.34 4.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.032 0.444 . . . . 0.0 111.039 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 168.88 -32.3 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.019 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -105.68 38.56 1.96 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.926 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 63.26 16.31 57.84 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.651 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 36.2 m-20 -72.9 -166.19 0.28 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.705 0.288 . . . . 0.0 110.742 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -139.19 108.03 5.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.876 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.401 ' O ' ' C ' ' A' ' 81' ' ' VAL . 59.2 t -77.88 -66.05 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.283 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.697 HG23 ' HG2' ' A' ' 71' ' ' LYS . 4.7 p 33.22 83.58 0.2 Allowed Pre-proline 0 CA--C 1.531 0.24 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.674 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -41.32 124.79 2.4 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.947 2.431 . . . . 0.0 112.869 -179.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 10.3 mtmt -78.05 162.33 67.58 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.051 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -83.64 171.03 11.16 Favored 'Trans proline' 0 N--CA 1.46 -0.476 0 C-N-CA 123.629 2.886 . . . . 0.0 112.388 -179.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -127.05 114.57 17.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.893 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.47 ' HB3' ' HA ' ' A' ' 63' ' ' ILE . 0.0 OUTLIER -121.44 145.12 48.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.747 -179.886 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.507 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 10.5 m-70 -96.72 111.66 23.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.335 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.44 ' HA ' ' HG3' ' A' ' 61' ' ' ARG . 6.6 ttt -94.13 124.63 38.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.095 0.474 . . . . 0.0 111.282 -179.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.912 ' CD1' HD11 ' A' ' 16' ' ' ILE . 89.8 m-85 -122.93 116.85 24.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.551 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.523 ' HB3' HG12 ' A' ' 8' ' ' ILE . 0.3 OUTLIER -92.2 114.66 27.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.837 0.351 . . . . 0.0 110.849 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.673 ' CE1' ' HB2' ' A' ' 7' ' ' ALA . 31.1 m-85 -97.34 143.54 27.99 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.111 0.481 . . . . 0.0 111.399 -179.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 20.1 m-20 -106.57 38.29 2.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.777 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.521 ' CB ' HG23 ' A' ' 96' ' ' VAL . 5.3 m-20 -179.87 122.92 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.991 -179.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.685 HH21 ' HB2' ' A' ' 53' ' ' ALA . 20.0 tpt85 -65.83 -14.41 61.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.474 179.384 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.91 -43.07 56.28 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 121.211 0.529 . . . . 0.0 110.023 179.452 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.521 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -62.6 -51.74 68.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.145 179.059 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.459 ' HG3' ' HA ' ' A' ' 94' ' ' ARG . 0.9 OUTLIER -51.87 -44.87 63.87 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.392 178.656 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.446 ' O ' ' HB2' ' A' ' 102' ' ' MET . 1.2 m-20 -53.41 -29.44 35.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.975 179.03 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.5 m-20 -82.48 -53.83 5.67 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.125 179.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.878 HG23 HD11 ' A' ' 18' ' ' ILE . 11.0 mm -70.88 -60.46 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.195 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.963 -179.318 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.484 ' CG ' HG11 ' B' ' 673' ' ' VAL . 10.6 ttmt -48.6 -35.38 13.45 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.516 -179.152 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.446 ' HB2' ' O ' ' A' ' 98' ' ' ASP . 33.3 mtm -83.45 -29.62 27.91 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.715 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.865 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -76.36 -45.35 32.41 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.485 -179.648 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.979 HD13 HD11 ' A' ' 48' ' ' LEU . 5.4 mt -53.53 -53.86 45.56 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.038 0.447 . . . . 0.0 109.923 179.32 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.541 ' NE2' HG21 ' B' ' 673' ' ' VAL . 0.3 OUTLIER -56.7 -47.43 79.95 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.146 179.901 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -47.28 -36.01 8.59 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 121.26 0.552 . . . . 0.0 110.37 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.039 HG22 ' HE1' ' A' ' 111' ' ' TYR . 12.3 mt -85.75 -51.81 12.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.143 179.094 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.683 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.4 -59.19 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.657 -0.702 . . . . 0.0 111.34 179.129 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -46.76 -27.38 1.18 Allowed 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.228 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.459 ' HB3' ' O ' ' A' ' 107' ' ' ILE . 0.0 OUTLIER -73.97 -24.79 59.67 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.88 179.964 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 1.039 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -73.98 -37.08 64.57 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.265 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.726 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -80.23 -43.62 21.12 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 179.14 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -61.4 -30.78 70.77 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 113.886 -1.507 . . . . 0.0 109.051 178.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.452 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.73 -19.65 21.58 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.631 178.745 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.2 t70 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.236 -0.887 . . . . 0.0 110.969 179.914 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 8.8 t70 . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.839 0.352 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -176.89 87.96 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.897 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 60.09 81.63 0.17 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.884 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 664' ' ' VAL . . . . . 0.965 HG12 HD23 ' B' ' 665' ' ' LEU . 13.0 t -151.37 83.65 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.012 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 665' ' ' LEU . . . . . 0.965 HD23 HG12 ' B' ' 664' ' ' VAL . 0.7 OUTLIER 46.51 38.61 5.66 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.283 -179.943 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 666' ' ' SER . . . . . 0.445 ' O ' ' CG ' ' B' ' 670' ' ' PHE . 0.3 OUTLIER -82.71 -80.13 0.17 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.166 -179.749 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -93.99 19.38 9.16 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.76 -179.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -89.94 -47.77 7.65 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.342 -179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.63 HD21 ' HB2' ' B' ' 665' ' ' LEU . 2.2 pp -120.52 20.01 11.89 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.666 -179.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 670' ' ' PHE . . . . . 0.463 ' CE1' ' CG2' ' A' ' 51' ' ' THR . 2.3 m-85 -91.68 127.83 37.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.828 0.347 . . . . 0.0 111.08 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.22 133.88 54.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.744 179.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 672' ' ' ASP . . . . . 0.42 ' HA ' ' HA ' ' A' ' 49' ' ' GLN . 4.9 p-10 -77.53 111.86 13.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.15 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 673' ' ' VAL . . . . . 0.613 ' CG2' HD23 ' A' ' 48' ' ' LEU . 19.5 m -58.69 128.09 83.32 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.769 179.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -51.08 134.48 43.28 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.502 2.135 . . . . 0.0 112.78 -179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 675' ' ' THR . . . . . 0.431 HG21 HG21 ' A' ' 108' ' ' ILE . 0.8 OUTLIER -115.28 116.76 28.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.582 179.686 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.15 124.32 20.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.02 -179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 16.0 t -142.84 -80.59 0.21 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.965 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -90.92 167.78 12.17 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.92 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 679' ' ' ILE . . . . . 0.526 ' O ' HD12 ' B' ' 679' ' ' ILE . 2.6 pp -138.46 30.93 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.14 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 5.6 p . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.86 -179.99 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo . . . . . 0 N--CA 1.488 1.188 0 CA-C-O 120.94 0.308 . . . . 0.0 111.715 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.4 m -107.0 -31.36 8.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.919 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 25.6 m170 -95.27 23.32 5.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.11 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.533 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 0.5 OUTLIER -160.09 160.57 33.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.206 0.526 . . . . 0.0 111.282 179.747 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.535 ' HA3' HG12 ' A' ' 96' ' ' VAL . . . 166.73 135.73 1.91 Allowed Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -179.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.577 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -80.32 148.46 30.68 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.568 ' C ' HD13 ' A' ' 8' ' ' ILE . . . -154.52 171.23 19.75 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.462 -179.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.673 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -103.0 120.67 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.582 -179.644 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.477 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 4.5 t80 -119.6 106.67 12.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.899 0.38 . . . . 0.0 111.361 178.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 16.6 mt-10 67.71 49.42 0.96 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.928 179.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 16.3 mtmt 72.64 -3.56 2.33 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 179.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.451 ' O ' HG23 ' A' ' 8' ' ' ILE . 22.5 t -102.08 151.17 5.88 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.485 0 CA-C-O 121.066 0.46 . . . . 0.0 110.483 179.61 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.425 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.8 OUTLIER -107.16 114.08 27.92 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.843 179.982 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.458 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -133.55 -158.55 8.72 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.061 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.577 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 17.0 mm -120.21 132.23 70.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.77 0.319 . . . . 0.0 111.38 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.88 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -101.19 114.87 41.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 107.945 -1.131 . . . . 0.0 107.945 177.843 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.533 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -124.03 115.79 21.76 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.539 0.685 . . . . 0.0 110.784 -179.248 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.919 HD13 HG22 ' A' ' 103' ' ' THR . 7.8 mt -82.47 142.75 13.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 114.709 -1.132 . . . . 0.0 112.031 -178.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.578 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.4 OUTLIER -118.45 93.12 4.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.201 179.294 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.07 0.5 44.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.414 -179.689 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -83.36 1.46 41.18 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.35 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.578 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -100.86 -162.46 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.864 0.364 . . . . 0.0 110.972 -179.828 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 94.1 p -176.15 100.36 0.25 Allowed Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.324 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.411 ' HG2' ' CB ' ' A' ' 43' ' ' SER . 14.6 Cg_exo -66.81 165.06 67.43 Favored 'Cis proline' 0 C--N 1.347 0.475 0 C-N-CA 123.644 -1.398 . . . . 0.0 112.474 0.473 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.54 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -57.34 -171.83 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.663 179.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -163.36 141.75 7.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.443 0.64 . . . . 0.0 112.249 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.707 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 3.1 tt -108.17 149.05 29.04 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.984 -1.007 . . . . 0.0 108.574 178.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.47 HG23 HG23 ' A' ' 39' ' ' THR . 1.3 m -146.9 104.19 3.69 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 -178.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.495 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 82.2 t90 -92.13 110.59 21.97 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.683 178.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.469 ' O ' ' N ' ' A' ' 15' ' ' ILE . 2.3 ttt180 -108.75 130.33 55.37 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.852 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.8 m -49.96 154.44 1.11 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.696 0.284 . . . . 0.0 110.607 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 21.6 m -72.94 -34.42 66.54 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.354 0.597 . . . . 0.0 109.703 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -87.03 -16.9 34.27 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.123 179.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.01 34.08 11.34 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.338 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 57.7 m-20 -89.54 -22.63 22.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.644 0.259 . . . . 0.0 111.542 -179.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.96 162.66 2.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.38 0.61 . . . . 0.0 111.434 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.495 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.61 144.95 20.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.025 -178.871 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.473 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 21.9 m80 -118.92 120.2 36.58 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.613 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.47 HG23 HG23 ' A' ' 28' ' ' THR . 0.3 OUTLIER -96.51 144.43 26.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.724 -179.934 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.707 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.2 t -128.75 138.76 53.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.559 -179.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.428 ' HB ' HG23 ' A' ' 44' ' ' THR . 21.7 t -103.86 94.3 3.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 177.568 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.852 HD11 HD23 ' A' ' 104' ' ' LEU . 0.9 OUTLIER -42.29 -22.88 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.226 -0.443 . . . . 0.0 112.171 -178.744 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.411 ' CB ' ' HG2' ' A' ' 24' ' ' PRO . 0.4 OUTLIER -76.03 -49.93 16.2 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.858 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.428 HG23 ' HB ' ' A' ' 41' ' ' VAL . 29.6 p -65.15 -28.01 69.12 Favored 'General case' 0 N--CA 1.443 -0.804 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.369 178.576 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.847 HD12 ' HB3' ' A' ' 62' ' ' LEU . 44.5 mm -56.46 109.92 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.591 179.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.413 ' HB2' ' N ' ' A' ' 65' ' ' LYS . 35.2 t70 -53.76 -37.33 63.29 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.847 0.356 . . . . 0.0 110.835 179.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.417 ' HG3' HG12 ' A' ' 63' ' ' ILE . 1.3 pttt -167.37 168.57 13.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.834 179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.96 HD23 HG21 ' B' ' 673' ' ' VAL . 11.6 tp -109.01 115.62 30.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.706 -179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.481 ' O ' ' N ' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -106.7 141.93 37.16 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 179.728 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.678 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.01 139.2 14.61 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.664 0.269 . . . . 0.0 111.308 -179.712 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.564 HG21 ' O ' ' A' ' 57' ' ' LYS . 71.6 p -56.92 141.29 75.69 Favored Pre-proline 0 C--N 1.331 -0.203 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.102 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -76.12 163.29 33.09 Favored 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.595 2.197 . . . . 0.0 112.407 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.95 -30.09 71.3 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.104 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 13.0 t -70.81 -18.31 62.74 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.186 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 59.7 p -94.45 115.64 27.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.897 0.379 . . . . 0.0 110.845 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.02 -18.14 12.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.688 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.564 ' O ' HG21 ' A' ' 51' ' ' THR . 0.1 OUTLIER -84.9 94.78 8.84 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.818 179.841 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.422 ' HE2' ' CB ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -80.23 107.95 13.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.85 -179.846 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.461 ' HB2' HG23 ' A' ' 51' ' ' THR . 35.2 mtm -149.78 151.66 33.94 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.005 0.431 . . . . 0.0 111.868 -179.446 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.678 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 33.6 mt -123.95 152.46 42.46 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.3 178.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.481 ' N ' ' O ' ' A' ' 49' ' ' GLN . 24.0 ttm180 -151.9 151.56 31.42 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 -179.357 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.861 HD21 HD22 ' A' ' 104' ' ' LEU . 1.4 mp -126.65 117.84 23.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.856 178.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.871 HD12 ' HD3' ' A' ' 86' ' ' ARG . 10.6 mm -76.62 156.52 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.765 0.317 . . . . 0.0 111.055 -179.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -121.28 126.39 6.53 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.434 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.413 ' N ' ' HB2' ' A' ' 46' ' ' ASP . 0.7 OUTLIER -62.55 128.55 36.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.929 0.395 . . . . 0.0 110.897 -179.825 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.514 HG22 ' N ' ' A' ' 67' ' ' ASP . 13.9 p -97.43 161.4 2.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.097 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.514 ' N ' HG22 ' A' ' 66' ' ' VAL . 9.6 m-20 -114.14 63.44 0.66 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.799 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -63.22 -17.73 62.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.294 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.9 t -58.4 -21.9 52.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.198 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.7 mmmp? -75.46 -68.44 0.56 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.907 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.4 mttt 55.89 89.59 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.966 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.01 -179.93 4.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.908 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 10.7 mttt -133.76 -168.44 2.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.779 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -135.04 -175.39 3.9 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.858 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -57.58 -22.09 42.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.316 -179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 -110.0 33.72 4.27 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.953 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.14 24.52 44.12 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.474 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -62.46 -169.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.848 0.356 . . . . 0.0 110.899 -179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -135.65 114.99 12.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.638 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 96.3 t -86.89 -60.6 2.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.39 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.446 ' O ' HG13 ' A' ' 81' ' ' VAL . 4.2 p 34.98 88.29 0.1 OUTLIER Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.854 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.42 ' O ' HG21 ' A' ' 66' ' ' VAL . 92.6 Cg_exo -42.12 140.35 2.3 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.94 2.427 . . . . 0.0 112.775 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 46.4 mmtt -93.56 163.87 22.99 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.036 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.449 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.7 Cg_exo -82.11 112.84 2.34 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 123.602 2.868 . . . . 0.0 112.311 -179.05 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -77.28 158.91 29.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.871 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.871 ' HD3' HD12 ' A' ' 63' ' ' ILE . 55.9 mtt180 -151.45 129.88 12.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.721 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.468 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 7.1 m-70 -95.39 111.53 23.4 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.568 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.524 ' HE3' ' CE1' ' B' ' 670' ' ' PHE . 4.5 ttt -109.19 134.56 51.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.066 -179.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.88 ' CD2' HD11 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -135.08 116.81 15.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.77 179.821 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.69 114.42 23.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.871 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.499 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 7.9 m-85 -91.17 140.92 29.35 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.12 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -97.2 38.54 1.24 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.775 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.655 ' HB3' HG23 ' A' ' 96' ' ' VAL . 1.3 m-20 178.41 116.08 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.553 -179.719 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.427 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -57.49 -18.14 17.18 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.674 179.584 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.17 -42.22 66.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.177 0.513 . . . . 0.0 110.122 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.655 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -66.26 -53.01 40.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.287 179.012 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.427 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -61.2 -36.8 80.88 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.335 179.309 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.452 ' O ' ' HE2' ' A' ' 102' ' ' MET . 26.8 t70 -67.81 -32.56 73.2 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.097 0.475 . . . . 0.0 110.181 179.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 68.1 m-20 -81.63 -33.25 31.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.237 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.69 HG22 HD12 ' A' ' 104' ' ' LEU . 3.2 mm -79.39 -60.09 2.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.616 179.568 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.457 ' HD3' HG11 ' B' ' 673' ' ' VAL . 5.9 ttmt -49.0 -29.58 5.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.508 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.452 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 31.5 mtm -79.13 -32.02 44.32 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.701 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.919 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -86.51 -22.98 26.08 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 120.983 0.42 . . . . 0.0 110.235 179.623 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.861 HD22 HD21 ' A' ' 62' ' ' LEU . 9.5 mt -73.26 -44.73 58.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.803 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.533 ' HA ' HG13 ' A' ' 108' ' ' ILE . 0.7 OUTLIER -80.63 -33.1 35.99 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -179.431 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.542 ' HG2' ' HA ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -55.71 -36.34 67.09 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 121.309 0.576 . . . . 0.0 110.122 179.832 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.953 HG22 ' HE1' ' A' ' 111' ' ' TYR . 17.7 mt -75.96 -52.05 18.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.441 179.164 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.549 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -43.86 -55.61 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.267 0.556 . . . . 0.0 111.142 179.09 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -46.85 -28.07 1.44 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.243 -0.889 . . . . 0.0 111.237 179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.516 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.3 OUTLIER -73.19 -24.76 60.58 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.146 179.751 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.953 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -74.47 -36.53 63.32 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 179.68 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.743 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -80.6 -43.62 20.25 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 179.211 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -61.45 -31.25 71.19 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 113.887 -1.506 . . . . 0.0 108.955 178.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.452 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.67 -19.44 21.84 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.638 178.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 9.7 t70 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.251 -0.881 . . . . 0.0 111.034 179.893 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 . . . . . 0 N--CA 1.488 1.429 0 CA-C-O 120.773 0.32 . . . . 0.0 111.126 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -155.5 33.56 0.37 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.887 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 60.86 92.6 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.918 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 664' ' ' VAL . . . . . 0.596 HG11 ' HG2' ' B' ' 667' ' ' GLU . 21.4 t 65.3 94.84 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.134 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 665' ' ' LEU . . . . . . . . . . . . . 1.1 tt -70.59 65.91 0.32 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.997 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 666' ' ' SER . . . . . 0.407 ' OG ' HD23 ' B' ' 669' ' ' LEU . 0.9 OUTLIER 58.72 85.07 0.1 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.029 179.963 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 667' ' ' GLU . . . . . 0.596 ' HG2' HG11 ' B' ' 664' ' ' VAL . 0.0 OUTLIER -94.2 19.17 9.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.079 0.466 . . . . 0.0 111.519 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -105.79 -17.26 14.43 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.238 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.698 ' O ' HD12 ' B' ' 669' ' ' LEU . 4.1 pp -100.07 19.94 15.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.144 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 670' ' ' PHE . . . . . 0.524 ' CE1' ' HE3' ' A' ' 88' ' ' MET . 2.1 m-85 -80.56 140.34 35.86 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.974 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -111.16 126.95 55.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.905 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -76.22 106.7 7.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.968 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 673' ' ' VAL . . . . . 0.96 HG21 HD23 ' A' ' 48' ' ' LEU . 33.5 m -59.58 143.88 85.61 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.995 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.69 139.53 25.27 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.503 2.135 . . . . 0.0 112.438 -179.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 675' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -136.8 116.65 13.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.891 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 179.72 109.76 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.801 179.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 8.7 t 54.28 -89.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.226 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 42.97 87.88 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.582 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 46.4 pt 42.42 33.16 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.744 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.944 179.986 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo . . . . . 0 N--CA 1.488 1.17 0 CA-C-O 120.811 0.255 . . . . 0.0 111.816 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.642 ' O ' HG21 ' A' ' 103' ' ' THR . 16.6 p -81.81 -37.37 27.18 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.901 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.404 ' O ' ' N ' ' A' ' 18' ' ' ILE . 18.8 m80 -85.59 25.05 1.11 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.45 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.586 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 7.5 p -156.48 151.06 25.7 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.222 0.534 . . . . 0.0 111.209 179.449 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.495 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 175.2 140.04 3.24 Favored Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 -179.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.547 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -83.03 136.09 34.62 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -178.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.736 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -144.79 171.24 14.69 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.011 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.656 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.84 127.81 56.28 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 CA-C-O 120.696 0.284 . . . . 0.0 111.664 -179.672 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.496 ' CZ ' ' CD2' ' A' ' 38' ' ' HIS . 6.8 t80 -127.81 110.08 12.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.986 0.422 . . . . 0.0 111.288 178.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 59.7 mt-10 67.75 47.77 1.12 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.988 179.104 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp 72.29 -5.41 1.78 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.152 179.333 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.478 ' O ' HG23 ' A' ' 8' ' ' ILE . 14.3 t -99.75 148.14 6.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.45 0 CA-C-O 121.028 0.442 . . . . 0.0 110.424 179.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.442 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -110.47 113.1 25.47 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.023 179.975 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.876 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.67 -134.29 3.57 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.613 -0.722 . . . . 0.0 111.905 179.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.876 HD13 ' O ' ' A' ' 14' ' ' GLY . 17.3 mm -135.82 135.86 50.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.584 0.23 . . . . 0.0 111.405 179.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.937 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.41 140.52 19.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 N-CA-C 106.295 -1.742 . . . . 0.0 106.295 176.61 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.586 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.33 119.07 6.12 Favored 'General case' 0 C--N 1.313 -0.997 0 C-N-CA 119.591 -0.844 . . . . 0.0 111.915 -178.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.715 HD12 ' HB ' ' A' ' 103' ' ' THR . 7.1 mt -82.59 142.82 13.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 114.57 -1.196 . . . . 0.0 112.142 -178.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.616 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -117.32 92.78 3.94 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.822 178.883 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.31 -0.85 42.89 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.348 -179.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -82.7 0.56 42.81 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.132 179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.616 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -103.87 -163.6 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.908 0.385 . . . . 0.0 110.694 179.939 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.426 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 1.8 t -175.08 102.29 0.26 Allowed Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.274 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.426 ' HA ' ' HA ' ' A' ' 23' ' ' SER . 8.5 Cg_exo -70.48 162.41 86.21 Favored 'Cis proline' 0 C--N 1.345 0.38 0 C-N-CA 123.49 -1.462 . . . . 0.0 112.674 0.45 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.549 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -54.3 178.47 0.03 OUTLIER 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.376 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.559 ' OE1' HG22 ' A' ' 41' ' ' VAL . 20.4 mt-10 -163.12 135.41 5.3 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.011 179.195 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.824 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.79 139.54 42.23 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 178.813 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.706 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.4 m -124.82 113.12 17.5 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -178.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.538 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 78.5 t90 -91.97 110.5 21.86 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 178.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.471 ' O ' ' N ' ' A' ' 15' ' ' ILE . 49.0 ttt180 -110.5 130.93 55.45 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.955 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.0 m -49.84 158.5 0.48 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.492 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.426 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 45.3 m -74.25 -37.05 63.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.371 0.605 . . . . 0.0 109.71 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -84.64 -16.03 43.36 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.992 -1.004 . . . . 0.0 111.114 179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.51 34.5 11.79 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.315 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -85.51 -25.92 26.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.753 0.311 . . . . 0.0 111.408 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.5 164.22 3.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.352 0.596 . . . . 0.0 111.441 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.706 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.65 147.94 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.537 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.125 -178.793 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.496 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 15.5 m80 -123.16 121.19 35.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.825 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.51 139.98 31.81 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.838 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.576 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -127.07 140.43 49.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.467 -179.627 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.559 HG22 ' OE1' ' A' ' 26' ' ' GLU . 21.9 t -103.83 95.76 4.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 177.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.755 HD11 HD22 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -42.7 -23.78 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.85 -178.994 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.415 ' CB ' ' HG2' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -76.03 -48.81 19.49 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 179.242 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.416 HG23 ' HB ' ' A' ' 41' ' ' VAL . 40.6 p -64.47 -27.19 68.81 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.548 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.81 HD12 ' HB3' ' A' ' 62' ' ' LEU . 47.9 mm -56.36 107.38 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.472 178.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.434 ' N ' ' O ' ' A' ' 63' ' ' ILE . 15.6 t70 -53.25 -28.48 27.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.543 -179.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.441 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 0.0 OUTLIER -172.83 163.46 5.01 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.02 0.438 . . . . 0.0 110.963 179.852 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.792 HD11 HD13 ' A' ' 104' ' ' LEU . 15.0 tp -109.17 122.19 46.76 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.722 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.441 ' HB2' ' HB3' ' A' ' 61' ' ' ARG . 4.2 mt-30 -124.22 146.56 48.64 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-O 120.776 0.322 . . . . 0.0 111.177 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.655 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.16 145.1 19.16 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.61 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.436 ' O ' ' HE1' ' A' ' 97' ' ' MET . 72.4 p -68.94 150.79 97.52 Favored Pre-proline 0 C--N 1.333 -0.124 0 CA-C-O 120.804 0.335 . . . . 0.0 111.182 -179.786 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -75.64 163.38 34.03 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.753 2.302 . . . . 0.0 112.506 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.667 ' HB1' ' CZ ' ' A' ' 94' ' ' ARG . . . -64.24 -23.89 67.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.389 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.6 m -70.66 -19.86 62.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.872 0.368 . . . . 0.0 111.125 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.9 m -71.87 123.15 22.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.041 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -56.16 -18.04 8.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.276 179.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.618 ' NZ ' HD21 ' B' ' 669' ' ' LEU . 0.0 OUTLIER -129.01 118.68 22.96 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.73 179.357 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.409 ' HB3' ' HG2' ' A' ' 97' ' ' MET . 3.0 mpp? -85.38 134.62 34.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.457 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.409 ' HB2' HG23 ' A' ' 51' ' ' THR . 3.0 mpp? -149.79 142.36 24.47 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.589 -179.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.655 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 21.8 mt -116.63 145.64 43.26 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.032 178.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.441 ' HB3' ' HB2' ' A' ' 49' ' ' GLN . 10.2 ttm180 -143.6 148.82 36.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.092 0.472 . . . . 0.0 112.237 -179.098 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.81 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -128.29 115.94 19.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.625 178.276 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.625 HG23 ' HG2' ' A' ' 86' ' ' ARG . 24.8 mm -76.41 156.5 5.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.807 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.421 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -117.52 171.99 14.13 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.734 -0.745 . . . . 0.0 112.631 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.1 mttt -98.07 127.78 44.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.812 0.339 . . . . 0.0 110.909 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.513 HG22 ' N ' ' A' ' 67' ' ' ASP . 14.8 p -97.34 161.04 2.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.191 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.513 ' N ' HG22 ' A' ' 66' ' ' VAL . 2.3 m-20 -112.28 75.87 0.94 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.767 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -62.79 -17.57 61.36 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.31 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.4 m -57.27 -22.77 43.85 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.144 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 16.9 mmtm -63.01 -65.38 0.69 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.79 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.7 mttp 58.23 92.25 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.851 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 -110.32 166.98 10.54 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.873 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.2 mttp -133.95 -168.02 2.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.812 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -136.54 -176.69 4.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.879 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 -59.11 -20.86 57.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.326 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -105.86 29.07 6.96 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.016 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.31 26.08 35.5 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.551 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 26.8 m-20 -65.9 -163.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.699 0.285 . . . . 0.0 110.917 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -137.22 116.81 12.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.662 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.406 ' O ' ' O ' ' A' ' 81' ' ' VAL . 99.3 t -86.63 -60.67 2.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.613 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.63 ' O ' HG12 ' A' ' 81' ' ' VAL . 0.9 OUTLIER 43.6 98.84 0.03 OUTLIER Pre-proline 0 CA--C 1.537 0.452 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.109 179.868 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.478 ' O ' HG21 ' A' ' 66' ' ' VAL . 81.8 Cg_exo -45.01 149.64 1.17 Allowed 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.591 2.194 . . . . 0.0 112.707 -179.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 5.1 mtpt -105.14 162.17 20.54 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.953 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.411 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.9 Cg_exo -82.07 111.77 2.21 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 123.598 2.865 . . . . 0.0 112.269 -179.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -71.91 143.18 49.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.917 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.625 ' HG2' HG23 ' A' ' 63' ' ' ILE . 14.3 mtt180 -131.49 144.82 51.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.585 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.478 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 27.6 m-70 -97.04 111.37 23.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.802 0.334 . . . . 0.0 110.216 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 3.1 mtp -94.3 126.36 39.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.339 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.937 ' CD1' HD11 ' A' ' 16' ' ' ILE . 88.8 m-85 -130.55 116.57 18.33 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.508 179.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.437 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -98.18 114.49 26.73 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.842 0.353 . . . . 0.0 110.661 179.863 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.736 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 43.0 m-85 -94.37 139.64 30.84 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.559 -179.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.6 m-80 -99.19 31.98 2.87 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.712 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.488 ' HB3' HG23 ' A' ' 96' ' ' VAL . 2.1 m-20 -175.41 113.68 0.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.722 -179.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.667 ' CZ ' ' HB1' ' A' ' 53' ' ' ALA . 10.1 ttp85 -56.62 -19.28 15.34 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.784 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.62 -47.77 58.42 Favored 'General case' 0 N--CA 1.44 -0.954 0 CA-C-O 120.851 0.358 . . . . 0.0 110.752 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.488 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -67.0 -45.4 87.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 178.927 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.465 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -63.91 -37.24 86.67 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.755 179.202 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.456 ' N ' ' HG3' ' A' ' 97' ' ' MET . 9.3 m-20 -60.14 -30.18 69.13 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-O 121.179 0.514 . . . . 0.0 109.948 178.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -81.69 -63.26 1.43 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.169 179.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.663 HG22 HD11 ' A' ' 104' ' ' LEU . 9.0 mm -48.56 -59.89 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.948 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.438 ' HA ' HD12 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -48.54 -30.69 5.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.648 -179.997 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.401 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 17.1 mtm -83.45 -45.68 13.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.405 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.715 ' HB ' HD12 ' A' ' 18' ' ' ILE . 0.3 OUTLIER -57.23 -53.05 62.53 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.756 179.747 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.792 HD13 HD11 ' A' ' 48' ' ' LEU . 6.4 mt -49.87 -53.61 24.67 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.176 0.512 . . . . 0.0 109.924 179.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.697 ' HG2' HD23 ' A' ' 48' ' ' LEU . 59.9 mm-40 -56.45 -47.56 78.87 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.963 179.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -49.82 -34.51 19.92 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-O 121.112 0.482 . . . . 0.0 110.494 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.027 HG22 ' HE1' ' A' ' 111' ' ' TYR . 3.4 mt -85.71 -51.73 13.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.374 179.337 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.705 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.48 -57.02 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.43 179.266 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.416 ' HA ' ' HG2' ' A' ' 112' ' ' LYS . 35.0 t -47.33 -28.54 2.06 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.209 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.525 ' HB2' ' O ' ' A' ' 107' ' ' ILE . 0.7 OUTLIER -71.9 -24.99 61.75 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.12 179.879 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 1.027 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -74.85 -35.04 62.36 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.526 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.764 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.77 -43.02 17.24 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 107.871 -1.159 . . . . 0.0 107.871 178.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -61.42 -32.02 71.97 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 113.898 -1.501 . . . . 0.0 108.957 178.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.456 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.7 -18.91 22.38 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.616 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.7 t70 . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.252 -0.88 . . . . 0.0 111.082 179.902 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.779 0.324 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 662' ' ' LEU . . . . . 0.426 ' O ' HD23 ' B' ' 662' ' ' LEU . 5.3 tt -104.45 -30.94 9.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.908 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -176.23 89.92 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.896 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 21.6 t -144.55 80.15 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.045 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 665' ' ' LEU . . . . . 0.863 HD13 ' N ' ' B' ' 666' ' ' SER . 1.2 tm? -129.41 145.86 51.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.882 -179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 666' ' ' SER . . . . . 0.863 ' N ' HD13 ' B' ' 665' ' ' LEU . 2.7 t -138.32 77.67 1.64 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.771 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 667' ' ' GLU . . . . . 0.452 ' CB ' ' CE1' ' B' ' 670' ' ' PHE . 8.0 pt-20 -94.13 19.2 9.56 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.083 0.468 . . . . 0.0 111.618 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -77.72 -17.65 57.38 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.212 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.618 HD21 ' NZ ' ' A' ' 57' ' ' LYS . 0.5 OUTLIER -105.15 20.01 19.6 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.296 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 670' ' ' PHE . . . . . 0.452 ' CE1' ' CB ' ' B' ' 667' ' ' GLU . 2.4 m-85 -59.69 122.07 13.22 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.796 0.332 . . . . 0.0 110.969 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -92.03 143.95 25.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.803 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -92.81 109.23 20.66 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.001 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 673' ' ' VAL . . . . . 0.441 ' CG1' ' NE2' ' A' ' 105' ' ' GLN . 12.0 t -58.1 135.33 84.25 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.844 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -72.98 128.34 13.04 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.372 2.048 . . . . 0.0 112.461 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 675' ' ' THR . . . . . 0.642 HG21 HG21 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -117.24 153.32 33.1 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.777 179.845 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 7.4 tttm -59.41 159.22 8.32 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.922 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 11.9 p 59.04 -169.47 0.13 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.915 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 60.88 80.18 0.22 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.903 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 679' ' ' ILE . . . . . 0.581 HG22 ' O ' ' B' ' 679' ' ' ILE . 20.6 mt -109.95 31.4 1.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.149 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.85 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo . . . . . 0 N--CA 1.489 1.238 0 CA-C-O 121.171 0.404 . . . . 0.0 111.998 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.0 p -68.83 -31.53 70.57 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.937 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.9 m170 -93.08 25.41 3.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.153 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.532 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 12.5 p -156.66 159.49 38.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.2 0.524 . . . . 0.0 111.107 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.581 ' HA3' HG12 ' A' ' 96' ' ' VAL . . . 168.24 136.49 2.06 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 111.039 -0.824 . . . . 0.0 111.039 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.58 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.5 148.16 28.27 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -178.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.505 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -157.23 171.45 20.4 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.225 -179.076 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.648 HD12 ' HA ' ' A' ' 13' ' ' SER . 4.3 mm -101.7 122.77 54.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.982 -179.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.492 ' HB3' ' CH2' ' A' ' 29' ' ' TRP . 3.7 t80 -118.44 105.27 11.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.951 0.405 . . . . 0.0 111.051 178.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 4.3 mm-40 67.45 54.75 0.67 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.756 179.283 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.425 ' HA ' HD21 ' B' ' 662' ' ' LEU . 1.1 mttm 70.19 -4.66 1.49 Allowed 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 179.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.515 ' O ' HG23 ' A' ' 8' ' ' ILE . 21.7 t -104.04 146.7 11.17 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.501 0 CA-C-O 121.134 0.492 . . . . 0.0 110.806 179.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.648 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -98.48 114.81 27.33 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.459 179.705 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -133.97 -177.37 14.89 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.365 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.58 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 15.5 mm -105.38 130.5 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-O 120.815 0.341 . . . . 0.0 111.237 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.876 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.4 OUTLIER -101.14 113.63 37.83 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.967 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.532 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -122.47 114.7 21.05 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 121.452 0.644 . . . . 0.0 110.623 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.77 HD13 HG22 ' A' ' 103' ' ' THR . 10.7 mt -82.41 142.82 13.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.906 -178.391 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.595 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -116.94 94.78 4.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.292 179.471 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.31 0.69 40.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.384 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -82.78 0.61 42.95 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.385 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.595 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.0 OUTLIER -100.93 -161.94 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.884 0.373 . . . . 0.0 110.911 -179.957 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.0 t -178.84 100.57 0.2 Allowed Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.307 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.433 ' HB3' ' HB2' ' A' ' 43' ' ' SER . 16.8 Cg_exo -65.68 160.99 72.8 Favored 'Cis proline' 0 C--N 1.346 0.412 0 C-N-CA 123.526 -1.447 . . . . 0.0 112.585 0.301 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.766 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -55.77 -171.36 0.0 OUTLIER 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.805 179.428 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -163.3 142.06 8.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.465 0.65 . . . . 0.0 112.193 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.707 ' HB3' ' CG1' ' A' ' 40' ' ' VAL . 2.7 tt -108.22 147.61 31.12 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.92 -1.036 . . . . 0.0 108.578 178.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.5 m -143.42 104.29 4.22 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.492 ' CH2' ' HB3' ' A' ' 9' ' ' PHE . 82.3 t90 -92.07 110.59 21.97 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.903 178.678 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.6 ttt180 -109.39 129.27 55.54 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.644 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.1 t -49.77 156.68 0.67 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.613 0.244 . . . . 0.0 110.514 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.0 m -72.28 -36.2 68.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.352 0.596 . . . . 0.0 109.75 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -82.27 -18.51 42.16 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.063 179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.58 34.81 15.18 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.435 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -93.03 -21.25 19.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.629 0.252 . . . . 0.0 111.62 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.24 161.24 6.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.341 0.591 . . . . 0.0 111.492 -179.774 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.478 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -145.64 148.95 16.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.107 -178.873 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.478 ' CE1' ' CE1' ' A' ' 9' ' ' PHE . 16.3 m80 -123.3 120.47 33.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.606 179.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -96.51 143.14 27.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.948 -179.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.707 ' CG1' ' HB3' ' A' ' 27' ' ' LEU . 1.2 t -127.11 138.81 53.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.479 -179.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.445 ' O ' HG12 ' A' ' 45' ' ' ILE . 21.8 t -104.02 94.15 3.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 177.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.607 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.6 OUTLIER -41.31 -23.47 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.221 -178.698 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.433 ' HB2' ' HB3' ' A' ' 24' ' ' PRO . 1.2 t -77.34 -49.07 15.73 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 179.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.427 HG23 ' HB ' ' A' ' 41' ' ' VAL . 30.6 p -64.9 -27.73 69.06 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.488 178.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.886 HD12 ' HB3' ' A' ' 62' ' ' LEU . 40.6 mm -55.99 110.19 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.582 179.181 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -57.28 -29.56 63.97 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.519 -179.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.438 ' CG ' HG13 ' A' ' 63' ' ' ILE . 1.2 pttt -172.47 168.97 5.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.033 0.444 . . . . 0.0 111.09 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.915 HD22 ' NE2' ' A' ' 105' ' ' GLN . 1.1 tp -109.21 117.09 33.21 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.239 -179.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.527 ' O ' ' N ' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -111.17 138.85 47.1 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 110.032 -0.358 . . . . 0.0 110.032 179.033 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.674 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -156.84 141.44 16.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.71 0.29 . . . . 0.0 111.129 -179.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.515 HG23 ' HB2' ' A' ' 59' ' ' MET . 43.9 p -50.16 137.8 20.66 Favored Pre-proline 0 CA--C 1.531 0.215 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.95 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -72.18 163.25 39.3 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.52 2.147 . . . . 0.0 112.58 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.82 -31.59 72.31 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.128 179.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 68.5 m -70.71 -21.84 62.51 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.902 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 27.6 m -91.06 117.15 29.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.732 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -55.4 -18.93 7.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.589 179.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.3 mmtm -74.85 130.77 40.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.867 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.493 ' HE2' ' HB2' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -112.59 102.52 10.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.621 179.897 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.515 ' HB2' HG23 ' A' ' 51' ' ' THR . 32.8 mtm -149.59 146.6 27.4 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.484 -179.401 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.674 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 32.1 mt -121.53 152.73 38.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.793 178.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.527 ' N ' ' O ' ' A' ' 49' ' ' GLN . 6.9 ttm180 -151.78 145.3 24.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.802 -179.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.886 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.2 mp -120.46 118.16 29.55 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 178.281 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.611 HD12 ' HG2' ' A' ' 86' ' ' ARG . 26.8 mm -76.48 156.48 5.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.596 0.236 . . . . 0.0 111.058 -179.581 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.445 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -113.14 141.72 17.05 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.548 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.4 mttm -71.41 115.7 10.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.93 0.395 . . . . 0.0 110.915 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.543 HG11 ' HG3' ' A' ' 84' ' ' PRO . 12.0 p -96.84 162.5 2.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.074 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.539 ' N ' HG22 ' A' ' 66' ' ' VAL . 3.5 m-20 -132.9 64.39 1.61 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.536 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -65.39 -14.79 61.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.561 -179.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.8 m -108.75 34.95 3.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.709 0.29 . . . . 0.0 110.987 -179.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 5.9 mmmm -122.97 -65.85 1.06 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.167 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 32.9 mttt 66.1 96.86 0.05 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.394 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.76 132.56 55.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.181 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 5.8 mmtp -82.32 159.94 22.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.853 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 51.6 p30 -112.45 -173.48 2.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.893 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -60.05 -20.36 57.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.329 -179.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -101.05 24.13 9.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.126 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.21 21.89 34.4 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.731 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -89.79 117.07 28.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.697 0.284 . . . . 0.0 110.771 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -70.26 108.1 4.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.811 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.412 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 21.3 t -111.03 119.49 59.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.751 -179.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.657 ' O ' HG13 ' A' ' 81' ' ' VAL . 14.6 p -99.72 100.71 11.6 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.86 178.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.412 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 74.7 Cg_exo -38.58 143.66 0.23 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 122.829 2.353 . . . . 0.0 113.121 -178.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.458 ' CA ' HG23 ' A' ' 66' ' ' VAL . 8.7 pttt -112.06 166.36 11.08 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.997 -179.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.543 ' HG3' HG11 ' A' ' 66' ' ' VAL . 2.6 Cg_exo -80.16 92.21 1.11 Allowed 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 123.621 2.881 . . . . 0.0 112.232 -179.034 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -83.29 114.93 21.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.103 -179.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.611 ' HG2' HD12 ' A' ' 63' ' ' ILE . 0.1 OUTLIER -108.84 134.38 51.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.835 179.879 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.489 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 4.3 m-70 -100.82 111.41 23.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.378 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.446 ' CE ' ' CZ ' ' B' ' 670' ' ' PHE . 1.0 OUTLIER -104.88 139.03 40.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.179 -179.622 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.876 ' CD2' HD11 ' A' ' 16' ' ' ILE . 0.2 OUTLIER -140.04 120.33 13.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.977 179.888 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.524 ' HB2' HG12 ' A' ' 8' ' ' ILE . 1.2 m -88.66 114.72 25.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.275 -179.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.505 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 6.8 m-85 -95.2 133.61 38.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.9 0.381 . . . . 0.0 111.094 179.607 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 24.3 m-20 -92.55 43.76 1.14 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.706 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.704 ' HB3' HG23 ' A' ' 96' ' ' VAL . 1.1 m-20 174.77 114.49 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.293 -179.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.493 ' HB2' ' HE2' ' A' ' 58' ' ' MET . 0.2 OUTLIER -57.32 -16.95 10.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.933 179.7 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.62 -42.48 64.42 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.18 0.514 . . . . 0.0 109.906 179.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.704 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -65.82 -54.25 29.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.266 178.905 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.43 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -59.35 -35.96 74.84 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.438 179.388 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.569 ' O ' ' HE2' ' A' ' 102' ' ' MET . 29.1 t70 -67.08 -31.72 72.4 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.066 0.46 . . . . 0.0 110.428 179.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 90.3 m-20 -81.74 -30.03 32.63 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.335 179.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.666 HG23 HD11 ' A' ' 18' ' ' ILE . 4.5 mm -83.23 -59.97 2.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.817 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.61 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 17.8 ttpp -47.55 -38.3 13.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.644 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.569 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 41.6 mtm -79.94 -25.62 40.4 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.242 -179.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.77 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -80.76 -40.74 24.66 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.126 179.962 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.607 ' CD2' HD11 ' A' ' 42' ' ' LEU . 13.2 mt -57.73 -53.01 63.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.267 -0.424 . . . . 0.0 109.993 179.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.915 ' NE2' HD22 ' A' ' 48' ' ' LEU . 4.6 mm-40 -60.59 -43.66 97.12 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.433 179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -47.18 -36.44 8.7 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 121.22 0.533 . . . . 0.0 110.512 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.037 HG22 ' HE1' ' A' ' 111' ' ' TYR . 14.4 mt -85.88 -51.59 13.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.512 179.193 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.673 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.21 -60.49 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.681 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.425 ' HA ' ' HG2' ' A' ' 112' ' ' LYS . 6.6 t -46.96 -25.87 0.88 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.538 -0.755 . . . . 0.0 111.25 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.459 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 15.7 mtt180 -72.26 -25.07 61.47 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.942 179.5 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 1.037 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.2 OUTLIER -75.38 -36.7 60.87 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 179.698 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.737 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.59 -42.87 19.46 Favored 'General case' 0 CA--C 1.505 -0.76 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.988 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -61.39 -30.24 70.42 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.007 -1.451 . . . . 0.0 108.967 177.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.459 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -91.66 -20.65 21.38 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.54 178.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 38.6 t70 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.288 -0.863 . . . . 0.0 110.839 179.825 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 . . . . . 0 N--CA 1.488 1.432 0 CA-C-O 120.771 0.319 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 662' ' ' LEU . . . . . 0.719 ' HB3' HD23 ' B' ' 665' ' ' LEU . 3.6 mm? -109.59 -41.62 4.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.916 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 62.23 93.53 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.92 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 21.3 t 65.66 95.1 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.162 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 665' ' ' LEU . . . . . 0.719 HD23 ' HB3' ' B' ' 662' ' ' LEU . 0.2 OUTLIER -113.59 149.79 34.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.845 179.947 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 666' ' ' SER . . . . . 0.689 ' H ' HD13 ' B' ' 665' ' ' LEU . 2.7 t -145.07 80.93 1.63 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.791 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 667' ' ' GLU . . . . . 0.442 ' HA ' ' CD1' ' B' ' 670' ' ' PHE . 0.1 OUTLIER -94.08 19.16 9.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.188 0.518 . . . . 0.0 111.588 -179.934 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -102.71 -19.21 14.85 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.149 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.85 19.92 19.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.156 -179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 670' ' ' PHE . . . . . 0.446 ' CZ ' ' CE ' ' A' ' 88' ' ' MET . 2.0 m-85 -63.73 134.48 55.41 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.842 0.353 . . . . 0.0 110.915 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -102.32 165.07 11.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.838 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -107.18 122.35 46.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.97 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 673' ' ' VAL . . . . . 0.402 HG11 ' HG3' ' A' ' 105' ' ' GLN . 11.1 t -71.08 136.09 84.84 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.871 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -63.96 128.03 20.89 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.291 1.994 . . . . 0.0 112.101 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 675' ' ' THR . . . . . 0.677 HG23 ' OE1' ' A' ' 105' ' ' GLN . 1.8 p -133.07 127.78 34.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.653 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 7.4 mttt -52.62 162.17 0.61 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.145 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -178.38 -175.74 0.47 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.978 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -143.64 109.04 5.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.857 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 679' ' ' ILE . . . . . 0.538 HG22 ' O ' ' B' ' 679' ' ' ILE . 19.8 mm -97.75 35.95 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.085 179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 40.7 t . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.177 -0.916 . . . . 0.0 110.857 179.954 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo . . . . . 0 N--CA 1.489 1.216 0 CA-C-O 120.919 0.3 . . . . 0.0 111.755 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.72 ' O ' HG21 ' A' ' 103' ' ' THR . 0.5 OUTLIER -105.75 -37.62 6.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.76 -179.952 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.419 ' CE1' ' HB2' ' A' ' 20' ' ' GLU . 25.2 m170 -89.76 24.06 2.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.119 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.56 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 8.9 p -156.33 142.31 18.05 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.139 0.495 . . . . 0.0 111.228 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.47 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -175.45 140.27 5.13 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 110.746 -0.942 . . . . 0.0 110.746 -179.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.549 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -81.94 139.73 34.44 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.602 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -148.92 171.23 16.66 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.043 -179.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.647 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.96 128.72 55.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-O 120.827 0.346 . . . . 0.0 111.791 -179.55 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.491 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 7.1 t80 -129.19 110.62 12.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.111 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.431 ' HG2' ' CE1' ' A' ' 9' ' ' PHE . 5.6 mm-40 67.41 47.69 1.23 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.947 179.014 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.2 mmtm 72.25 -5.95 1.66 Allowed 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 179.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.466 ' O ' HG23 ' A' ' 8' ' ' ILE . 14.4 t -99.23 148.52 6.2 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 CA-C-O 121.034 0.445 . . . . 0.0 110.474 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.455 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -111.34 113.86 26.62 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.084 -179.924 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.874 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -132.31 -133.91 3.48 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.877 -0.678 . . . . 0.0 112.112 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.874 HD13 ' O ' ' A' ' 14' ' ' GLY . 17.5 mm -136.13 135.27 50.18 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.491 0 CA-C-O 120.81 0.338 . . . . 0.0 111.322 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.91 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.32 139.99 20.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 176.669 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.56 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -150.1 118.56 6.47 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 119.489 -0.884 . . . . 0.0 111.68 -178.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.586 HD12 ' HB ' ' A' ' 103' ' ' THR . 11.3 mt -81.57 142.92 13.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 114.469 -1.242 . . . . 0.0 112.053 -178.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.624 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -119.98 92.59 3.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.045 179.052 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.419 ' HB2' ' CE1' ' A' ' 3' ' ' HIS . 1.2 tt0 -82.46 -0.39 46.12 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.33 -179.645 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -83.08 1.31 40.83 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.336 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.624 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -102.58 -162.72 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.842 0.354 . . . . 0.0 110.819 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.42 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 8.3 p -174.28 101.08 0.29 Allowed Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.366 179.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.45 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 58.4 Cg_endo -71.84 165.56 81.51 Favored 'Cis proline' 0 C--N 1.346 0.41 0 C-N-CA 123.518 -1.451 . . . . 0.0 112.765 0.466 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.32 175.72 0.21 Allowed 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.549 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.497 ' HG2' HG21 ' A' ' 22' ' ' VAL . 6.6 pt-20 -163.71 138.71 6.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.112 179.179 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.81 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.72 143.92 35.55 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 178.861 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.724 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.2 m -127.52 113.55 16.28 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -178.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.534 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 77.9 t90 -92.0 110.33 21.69 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -110.73 130.97 55.43 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.68 0.276 . . . . 0.0 110.905 -179.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.3 t -49.84 158.52 0.48 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.561 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.415 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 48.1 m -73.76 -37.34 65.05 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.483 0.658 . . . . 0.0 109.69 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -84.2 -16.32 43.81 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.001 -1.0 . . . . 0.0 111.18 179.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.49 34.54 11.74 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.308 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.8 t0 -85.54 -25.61 26.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.677 0.275 . . . . 0.0 111.379 -179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.73 163.94 2.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.213 0.53 . . . . 0.0 111.423 -179.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.724 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.68 146.16 19.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.196 -178.729 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.464 ' CD2' ' CZ ' ' A' ' 9' ' ' PHE . 37.4 m80 -119.84 120.75 37.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.664 179.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.496 HG23 HG23 ' A' ' 28' ' ' THR . 0.3 OUTLIER -96.53 137.42 35.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.063 -179.76 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.562 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.1 t -126.53 139.31 52.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.221 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.467 ' CG1' HG23 ' A' ' 44' ' ' THR . 47.0 t -103.96 95.98 4.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 177.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.731 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.9 OUTLIER -41.16 -25.52 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.12 -178.919 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.45 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 2.0 t -76.14 -48.51 20.33 Favored 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.465 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.467 HG23 ' CG1' ' A' ' 41' ' ' VAL . 30.9 p -64.69 -27.86 69.2 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 178.449 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.849 HD12 ' HB3' ' A' ' 62' ' ' LEU . 42.0 mm -56.48 107.14 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.512 178.619 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.407 ' N ' ' O ' ' A' ' 63' ' ' ILE . 8.2 t70 -47.89 -33.98 8.3 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.926 0.393 . . . . 0.0 111.011 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.431 ' HG3' HG12 ' A' ' 63' ' ' ILE . 1.8 pttt -172.44 164.02 5.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.72 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 1.034 HD11 HD13 ' A' ' 104' ' ' LEU . 15.1 tp -108.65 123.29 48.74 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.61 -179.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -119.53 148.56 43.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.537 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.674 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.1 148.37 22.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.573 0.225 . . . . 0.0 111.043 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.568 HG21 ' O ' ' A' ' 57' ' ' LYS . 35.7 p -57.95 138.86 83.23 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-O 120.626 0.25 . . . . 0.0 110.985 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -76.63 163.22 32.06 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.562 2.174 . . . . 0.0 112.446 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.94 -28.06 68.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.144 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.0 t -70.74 -17.78 62.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.172 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.0 m -101.04 114.31 28.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.781 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -58.75 -16.93 19.01 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.889 179.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.568 ' O ' HG21 ' A' ' 51' ' ' THR . 15.7 mmmt -80.72 104.08 10.99 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.841 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.401 ' HG2' ' CA ' ' A' ' 94' ' ' ARG . 2.1 mpp? -82.58 108.6 16.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.855 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.579 ' HE3' ' HE1' ' B' ' 670' ' ' PHE . 31.9 mtm -149.7 143.19 25.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.632 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.674 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 25.4 mt -120.48 145.55 47.15 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.096 178.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.467 ' HB2' ' CE2' ' B' ' 670' ' ' PHE . 14.7 ttm-85 -141.9 151.3 42.52 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.949 0.404 . . . . 0.0 111.857 -179.058 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.849 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -128.19 117.42 21.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.817 178.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.611 HD12 ' HG2' ' A' ' 86' ' ' ARG . 17.3 mm -76.6 156.52 5.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.792 0.329 . . . . 0.0 111.279 -179.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.416 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -114.95 166.96 12.21 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.447 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.6 mmtp -74.66 114.37 13.01 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.932 0.396 . . . . 0.0 110.858 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.458 HG22 ' N ' ' A' ' 67' ' ' ASP . 7.6 p -107.12 160.58 6.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.313 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.458 ' N ' HG22 ' A' ' 66' ' ' VAL . 2.4 t0 -113.04 39.57 2.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.807 179.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -62.59 -21.91 65.98 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.187 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.2 m -80.02 -21.07 43.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.208 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.4 mmtp -79.63 -68.37 0.67 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.9 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.3 mtpt 60.04 89.25 0.07 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.818 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.28 -176.51 3.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.923 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 11.1 mttt -134.38 -167.74 2.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.674 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -135.91 -179.21 5.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.91 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -56.93 -22.32 36.84 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.347 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.73 33.49 4.04 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.989 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 55.5 26.17 44.35 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.51 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -66.8 -169.51 0.08 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.816 0.341 . . . . 0.0 111.001 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -135.58 119.39 17.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.568 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 60.2 t -89.28 -63.92 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.424 -179.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.446 ' O ' HG13 ' A' ' 81' ' ' VAL . 4.8 p 34.21 80.41 0.26 Allowed Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.849 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -45.51 124.69 6.85 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.848 2.365 . . . . 0.0 112.592 -179.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.425 ' O ' HG23 ' A' ' 66' ' ' VAL . 0.2 OUTLIER -72.09 161.62 77.9 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.018 179.976 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.409 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.5 Cg_exo -83.13 128.46 4.97 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 123.645 2.897 . . . . 0.0 112.42 -179.036 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -102.46 115.32 30.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.936 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.611 ' HG2' HD12 ' A' ' 63' ' ' ILE . 0.5 OUTLIER -121.46 143.47 49.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.568 -179.948 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.479 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 17.3 m-70 -99.02 111.37 23.79 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.732 0.301 . . . . 0.0 110.372 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.404 ' HE1' ' HA ' ' B' ' 666' ' ' SER . 0.0 OUTLIER -94.81 121.04 35.99 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.008 0.432 . . . . 0.0 111.199 -179.532 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.91 ' CD1' HD11 ' A' ' 16' ' ' ILE . 92.9 m-85 -122.9 116.73 24.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.467 179.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.412 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -97.11 114.55 26.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.846 -179.937 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.602 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 17.0 m-85 -94.66 137.14 34.14 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.182 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 24.6 m-20 -97.08 39.26 1.19 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.823 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.497 ' CB ' HG23 ' A' ' 96' ' ' VAL . 5.4 m-20 179.59 111.17 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.553 -179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.428 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.3 OUTLIER -53.41 -21.67 6.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.781 179.795 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.79 -47.3 66.49 Favored 'General case' 0 N--CA 1.441 -0.92 0 CA-C-O 120.891 0.377 . . . . 0.0 110.834 179.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.497 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -65.76 -47.22 86.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 178.873 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.45 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 0.0 OUTLIER -64.52 -37.42 87.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.372 179.539 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.45 ' N ' ' HG3' ' A' ' 97' ' ' MET . 35.7 t0 -68.75 -33.88 74.65 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.095 0.474 . . . . 0.0 109.965 179.278 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.435 ' O ' ' OG1' ' A' ' 103' ' ' THR . 53.2 m-20 -81.88 -26.86 33.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.475 179.294 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.47 HD11 ' N ' ' A' ' 5' ' ' GLY . 1.6 mm -86.4 -59.7 2.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.041 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.568 ' HD3' HG11 ' B' ' 673' ' ' VAL . 7.9 ttmt -44.15 -30.6 0.79 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.374 -179.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.77 -37.93 34.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.446 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.72 HG21 ' O ' ' A' ' 2' ' ' SER . 0.3 OUTLIER -59.33 -57.42 13.09 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.714 179.588 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 1.034 HD13 HD11 ' A' ' 48' ' ' LEU . 5.7 mt -47.97 -56.03 8.6 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.892 179.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.481 ' NE2' HG21 ' B' ' 673' ' ' VAL . 0.0 OUTLIER -56.37 -44.99 80.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.883 179.444 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -52.19 -34.44 45.3 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-O 121.168 0.509 . . . . 0.0 110.404 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.989 HG22 ' HE1' ' A' ' 111' ' ' TYR . 5.0 mt -85.64 -51.91 12.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.328 179.291 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.693 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.8 OUTLIER -42.26 -57.58 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.501 179.396 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.7 m -46.92 -26.12 0.92 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.178 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.438 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 14.4 mtp85 -74.06 -25.02 59.61 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.282 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.989 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -76.32 -34.34 59.01 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.748 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.01 -43.51 17.88 Favored 'General case' 0 CA--C 1.505 -0.776 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 178.851 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -61.65 -31.56 71.67 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 113.867 -1.515 . . . . 0.0 109.099 178.112 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.438 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.67 -18.85 22.48 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.697 178.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 36.6 t70 . . . . . 0 C--O 1.248 0.995 0 CA-C-O 118.231 -0.89 . . . . 0.0 111.071 179.941 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 12.3 t70 . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.793 0.33 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 2.8 tt -168.69 86.15 0.18 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.851 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 61.01 92.76 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.892 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 664' ' ' VAL . . . . . 0.588 HG12 ' O ' ' B' ' 664' ' ' VAL . 21.7 t -96.51 40.59 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.109 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 665' ' ' LEU . . . . . 0.944 HD11 HD21 ' B' ' 669' ' ' LEU . 30.0 tp -111.49 127.96 55.86 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.873 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 666' ' ' SER . . . . . 0.404 ' HA ' ' HE1' ' A' ' 88' ' ' MET . 0.2 OUTLIER 178.75 -84.85 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.001 179.85 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -94.29 19.21 9.75 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.61 -179.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -86.58 -31.53 21.14 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.26 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.944 HD21 HD11 ' B' ' 665' ' ' LEU . 3.1 pp -120.54 20.04 11.87 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.189 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 670' ' ' PHE . . . . . 0.579 ' HE1' ' HE3' ' A' ' 59' ' ' MET . 1.1 m-85 -93.01 168.23 11.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.991 0.424 . . . . 0.0 111.255 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -148.21 126.9 12.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.652 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -71.1 98.81 1.73 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.096 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 673' ' ' VAL . . . . . 0.568 HG11 ' HD3' ' A' ' 101' ' ' LYS . 21.9 m -59.39 121.18 54.61 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.82 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -48.39 141.69 18.66 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.736 2.29 . . . . 0.0 112.842 -179.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 675' ' ' THR . . . . . 0.552 HG21 HG21 ' A' ' 108' ' ' ILE . 0.6 OUTLIER -139.0 116.84 11.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.73 179.784 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 2.3 mtmt 179.94 165.98 1.22 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.876 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 96.9 p -126.37 153.69 44.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.936 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 6.0 pm0 45.24 -168.45 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.414 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 4.3 mt 59.63 87.32 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.069 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 2.0 t . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.891 -179.994 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_endo . . . . . 0 N--CA 1.488 1.193 0 CA-C-O 120.819 0.258 . . . . 0.0 111.829 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -92.75 -37.48 12.33 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.859 179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 33.8 m170 -86.62 11.5 12.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.434 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.571 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 3.4 p -151.25 155.39 38.69 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.162 0.506 . . . . 0.0 111.328 179.543 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.502 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 173.62 138.02 2.55 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.866 -0.894 . . . . 0.0 110.866 -179.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.558 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.22 133.41 35.25 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.54 0.571 . . . . 0.0 112.54 -178.53 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.711 ' HB2' ' CZ ' ' A' ' 91' ' ' PHE . . . -141.6 171.23 14.35 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.182 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.646 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.66 127.99 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.827 -179.598 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.49 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 7.6 t80 -129.41 110.81 12.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.957 0.408 . . . . 0.0 111.155 178.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.411 ' HG3' ' CE1' ' A' ' 9' ' ' PHE . 36.8 mt-10 67.53 49.38 1.01 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.826 179.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 69.76 -4.69 1.37 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.214 179.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.454 ' O ' HG23 ' A' ' 8' ' ' ILE . 15.7 t -100.07 148.11 6.95 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.479 0 CA-C-O 121.108 0.48 . . . . 0.0 110.41 179.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.434 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -112.1 112.83 24.73 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.956 179.885 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.884 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -130.46 -128.97 3.04 Favored Glycine 0 N--CA 1.445 -0.71 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.958 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.884 HD13 ' O ' ' A' ' 14' ' ' GLY . 19.4 mm -138.66 135.48 43.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 120.692 0.282 . . . . 0.0 111.313 179.638 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.89 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.8 141.2 17.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 106.279 -1.748 . . . . 0.0 106.279 176.575 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.571 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.41 116.99 5.4 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 119.532 -0.867 . . . . 0.0 111.549 -178.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.916 HD13 HG22 ' A' ' 103' ' ' THR . 4.7 mt -85.28 137.81 20.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 114.553 -1.203 . . . . 0.0 111.85 -178.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.638 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.7 OUTLIER -116.6 93.43 4.21 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.316 179.545 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -80.36 0.08 34.62 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.475 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -82.7 0.41 43.51 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.36 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.638 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -101.75 -162.27 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.873 0.368 . . . . 0.0 110.886 179.89 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.1 t -175.73 101.23 0.25 Allowed Pre-proline 0 C--N 1.327 -0.41 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.427 179.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.442 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 57.5 Cg_endo -71.31 160.23 92.71 Favored 'Cis proline' 0 C--N 1.346 0.434 0 C-N-CA 123.471 -1.47 . . . . 0.0 112.784 0.409 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.572 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -53.64 176.97 0.03 OUTLIER 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.421 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.504 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.64 135.0 4.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.43 179.309 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.81 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -108.08 130.57 55.09 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 178.736 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.738 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.4 m -114.52 113.44 24.44 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -178.201 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.535 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 78.1 t90 -91.94 110.58 21.94 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.246 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.505 ' O ' ' N ' ' A' ' 15' ' ' ILE . 1.5 ttt180 -110.83 131.27 55.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.199 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.413 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 17.1 m -49.91 160.6 0.31 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.424 179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.424 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 45.9 m -75.66 -37.34 59.71 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.341 0.591 . . . . 0.0 109.751 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -85.42 -14.53 45.93 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.107 179.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 85.65 34.72 12.91 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.323 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.32 -26.1 26.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.812 0.339 . . . . 0.0 111.358 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.28 162.49 2.95 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.275 0.56 . . . . 0.0 111.411 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.738 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.61 145.63 20.24 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.035 -178.768 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 31.3 m-70 -120.03 120.99 37.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.779 179.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.4 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.51 128.52 43.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.708 -179.982 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.559 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -114.72 140.25 36.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.522 -179.547 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.421 HG12 ' HB3' ' A' ' 43' ' ' SER . 28.3 t -104.03 96.29 4.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 177.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.81 HD11 HD22 ' A' ' 104' ' ' LEU . 0.5 OUTLIER -42.81 -24.46 0.06 Allowed 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.874 -178.89 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.442 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 1.5 t -74.84 -48.02 27.36 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.255 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.405 HG23 ' HB ' ' A' ' 41' ' ' VAL . 48.4 p -64.66 -27.71 69.11 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 108.976 -0.749 . . . . 0.0 108.976 178.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.877 HD12 ' HB3' ' A' ' 62' ' ' LEU . 44.6 mm -56.58 108.06 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.249 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.645 178.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.444 ' N ' ' O ' ' A' ' 63' ' ' ILE . 14.9 t0 -55.27 -28.13 51.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.395 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.431 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 2.7 ptpt -172.45 161.97 5.22 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.901 0.381 . . . . 0.0 110.873 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.695 HD11 HD13 ' A' ' 104' ' ' LEU . 46.5 tp -109.09 118.94 38.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.975 -179.607 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.414 ' HB3' ' HB3' ' A' ' 61' ' ' ARG . 3.2 tt0 -117.6 145.68 44.15 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.788 179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.66 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.1 145.92 19.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.654 -0.248 . . . . 0.0 110.997 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.526 HG23 ' HB2' ' A' ' 59' ' ' MET . 72.7 p -52.34 138.68 38.21 Favored Pre-proline 0 CA--C 1.53 0.173 0 CA-C-O 120.595 0.236 . . . . 0.0 110.954 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.24 163.21 39.94 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.484 2.122 . . . . 0.0 112.469 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.43 -32.07 73.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.12 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.5 m -70.77 -20.69 62.59 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.995 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 12.1 m -89.37 117.65 28.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.855 179.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -56.64 -17.91 10.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.622 179.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.5 mmmm -80.1 127.23 32.07 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.825 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.08 104.35 13.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.526 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.526 ' HB2' HG23 ' A' ' 51' ' ' THR . 47.8 mtm -149.6 146.29 27.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.615 -179.424 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.66 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 26.7 mt -119.8 148.75 43.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.596 178.797 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.443 ' HB2' ' CE2' ' B' ' 670' ' ' PHE . 1.7 ttt180 -144.52 147.19 32.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.879 0.371 . . . . 0.0 111.559 -179.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.877 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.6 mp -128.37 113.74 15.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.815 178.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.604 ' HA ' ' HB3' ' A' ' 86' ' ' ARG . 7.1 mm -76.7 156.48 5.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.747 0.308 . . . . 0.0 111.239 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -116.84 179.26 17.52 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.489 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.2 mmtm -92.57 127.37 38.04 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.809 0.338 . . . . 0.0 111.032 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.519 HG22 ' N ' ' A' ' 67' ' ' ASP . 11.2 p -97.58 161.2 2.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.152 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.519 ' N ' HG22 ' A' ' 66' ' ' VAL . 7.4 m-20 -91.7 74.22 5.82 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.138 179.365 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.51 ' CG ' HG11 ' A' ' 81' ' ' VAL . 9.9 mp0 -54.29 -21.01 8.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.603 -179.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.7 m -48.53 -27.46 2.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.882 0.372 . . . . 0.0 111.317 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.8 mmmt -67.46 -65.83 0.64 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.757 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 26.3 mttt 60.93 93.01 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.022 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.57 124.46 34.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.754 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 1.1 mttp -76.18 167.49 21.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.944 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -104.43 -50.48 3.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.203 0.525 . . . . 0.0 111.168 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.3 t30 174.36 -31.54 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.198 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -93.37 40.78 1.07 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.091 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 58.33 19.16 38.9 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.645 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -80.38 174.23 11.81 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.821 0.343 . . . . 0.0 110.8 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -133.29 111.99 11.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.825 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 24.4 t -103.33 141.58 18.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.432 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.51 HG11 ' CG ' ' A' ' 68' ' ' GLU . 45.4 t -110.65 90.6 10.81 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.633 179.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_exo -44.55 145.51 2.6 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.681 2.254 . . . . 0.0 112.57 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.454 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -54.06 154.44 7.72 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.156 -179.889 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.477 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 4.2 Cg_exo -83.7 -176.29 2.64 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 123.513 2.808 . . . . 0.0 112.351 -179.193 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -89.72 113.82 25.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.59 179.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.604 ' HB3' ' HA ' ' A' ' 63' ' ' ILE . 0.0 OUTLIER -116.1 143.15 45.86 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.056 -179.652 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.523 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 14.4 m-70 -94.93 116.44 28.71 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.183 179.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.591 ' HE1' ' HA ' ' B' ' 666' ' ' SER . 0.0 OUTLIER -94.04 110.95 22.62 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.005 0.431 . . . . 0.0 111.186 -179.413 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.89 ' CD1' HD11 ' A' ' 16' ' ' ILE . 94.2 m-85 -110.93 116.61 31.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.501 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.417 ' HB2' HG12 ' A' ' 8' ' ' ILE . 0.8 OUTLIER -100.79 114.39 28.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.884 0.373 . . . . 0.0 110.711 179.928 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.711 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 42.6 m-85 -93.41 150.69 20.26 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.426 -179.751 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 -107.98 31.54 5.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.404 179.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.513 ' HB3' HG23 ' A' ' 96' ' ' VAL . 2.1 m-20 -175.93 113.68 0.12 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.468 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.438 ' O ' ' HG3' ' A' ' 97' ' ' MET . 0.0 OUTLIER -56.57 -19.07 14.06 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.882 179.77 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.92 -45.07 64.92 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.735 179.764 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.513 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -67.81 -48.27 76.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.966 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.438 ' HG3' ' O ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -62.07 -35.56 79.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.865 179.165 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.4 ' N ' ' HG3' ' A' ' 97' ' ' MET . 7.3 m-20 -61.15 -31.47 71.19 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.217 179.111 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 17.9 m-80 -81.73 -51.76 7.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.42 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.681 HG23 HD11 ' A' ' 18' ' ' ILE . 10.7 mm -58.46 -59.77 3.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.623 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.481 ' HD3' HG11 ' B' ' 673' ' ' VAL . 5.3 ttmt -51.18 -31.75 21.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.912 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 14.1 mtm -83.34 -31.44 26.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.592 -179.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.916 HG22 HD13 ' A' ' 18' ' ' ILE . 0.9 OUTLIER -82.32 -27.16 32.41 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.798 -179.568 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.81 HD22 HD11 ' A' ' 42' ' ' LEU . 19.3 mt -67.69 -42.08 82.63 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 179.322 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.611 ' NE2' HG23 ' B' ' 673' ' ' VAL . 0.7 OUTLIER -66.29 -48.72 69.48 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.603 -179.362 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.445 ' HG2' ' HA ' ' A' ' 103' ' ' THR . 11.1 pt20 -46.86 -33.39 4.48 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 121.087 0.47 . . . . 0.0 110.973 -178.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.036 HG22 ' HE1' ' A' ' 111' ' ' TYR . 11.3 mt -82.42 -53.36 11.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.603 179.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.686 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.24 -57.15 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.872 -0.603 . . . . 0.0 111.342 179.65 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -46.87 -26.92 1.08 Allowed 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.134 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.446 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 19.7 mtp180 -73.95 -25.05 59.75 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.29 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 1.036 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -76.1 -35.59 59.25 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.735 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.718 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -80.54 -43.78 20.14 Favored 'General case' 0 CA--C 1.505 -0.755 0 N-CA-C 107.827 -1.175 . . . . 0.0 107.827 178.911 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -61.54 -31.08 71.09 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 113.876 -1.511 . . . . 0.0 109.053 178.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.446 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.62 -19.41 21.92 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.691 178.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.5 t0 . . . . . 0 C--O 1.248 1.007 0 CA-C-O 118.199 -0.905 . . . . 0.0 111.033 179.989 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 4.0 t0 . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.885 0.374 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 1.1 tp -104.92 -33.1 8.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.85 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 663' ' ' GLU . . . . . 0.432 ' O ' HG12 ' B' ' 664' ' ' VAL . 2.6 pt-20 -86.95 53.34 2.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.991 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 664' ' ' VAL . . . . . 0.601 ' O ' HG22 ' B' ' 664' ' ' VAL . 14.5 p 43.75 39.7 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.578 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 665' ' ' LEU . . . . . 0.587 HD21 HD21 ' B' ' 669' ' ' LEU . 2.1 tm? -74.58 112.88 11.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.91 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 666' ' ' SER . . . . . 0.591 ' HA ' ' HE1' ' A' ' 88' ' ' MET . 0.2 OUTLIER -176.67 -86.03 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.986 179.955 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -94.28 19.17 9.78 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.628 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -85.63 -25.1 26.81 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.249 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.587 HD21 HD21 ' B' ' 665' ' ' LEU . 3.5 pp -120.26 19.85 12.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.35 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 670' ' ' PHE . . . . . 0.443 ' CE2' ' HB2' ' A' ' 61' ' ' ARG . 1.3 m-85 -92.84 159.0 15.57 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.862 0.363 . . . . 0.0 110.948 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -151.45 138.51 19.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.92 179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -68.48 108.08 3.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.913 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 673' ' ' VAL . . . . . 0.611 HG23 ' NE2' ' A' ' 105' ' ' GLN . 30.8 m -60.15 141.97 90.03 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.056 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -54.03 136.24 66.43 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.588 2.192 . . . . 0.0 112.701 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 675' ' ' THR . . . . . 0.56 HG21 HG21 ' A' ' 108' ' ' ILE . 0.4 OUTLIER -126.31 116.76 21.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.536 179.585 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -61.92 110.02 1.43 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.963 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 19.8 p -143.26 -169.77 3.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.865 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 678' ' ' GLN . . . . . 0.61 ' O ' HD13 ' B' ' 679' ' ' ILE . 7.9 pt20 -133.62 121.17 21.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.904 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 679' ' ' ILE . . . . . 0.61 HD13 ' O ' ' B' ' 678' ' ' GLN . 23.6 mm -134.8 75.07 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.147 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.852 -179.883 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo . . . . . 0 N--CA 1.489 1.223 0 CA-C-O 121.149 0.395 . . . . 0.0 111.996 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.43 ' O ' ' CD2' ' A' ' 3' ' ' HIS . 83.1 p -97.98 22.78 8.86 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.116 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.43 ' CD2' ' O ' ' A' ' 2' ' ' SER . 24.3 m170 -152.12 21.23 0.66 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.093 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.581 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 3.9 p -155.79 157.58 36.73 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.122 0.487 . . . . 0.0 111.218 179.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.513 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 171.33 139.15 2.7 Favored Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 111.119 -0.792 . . . . 0.0 111.119 -179.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.553 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -82.78 144.2 30.33 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -178.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.556 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -153.28 171.19 18.94 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.054 -179.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.663 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.79 125.74 55.85 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 CA-C-O 120.745 0.307 . . . . 0.0 111.721 -179.68 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.478 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.2 t80 -125.17 109.16 12.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.938 0.399 . . . . 0.0 111.194 178.498 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.421 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 49.9 mt-10 67.5 48.06 1.16 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.888 179.025 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.6 mttt 73.3 -5.84 1.87 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.2 0.445 . . . . 0.0 112.2 179.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.459 ' O ' HG23 ' A' ' 8' ' ' ILE . 16.8 t -100.21 148.68 6.49 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.496 0 CA-C-O 121.174 0.511 . . . . 0.0 110.448 179.639 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.45 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -110.8 113.18 25.56 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.97 179.883 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.886 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.9 -133.86 3.51 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.803 -0.713 . . . . 0.0 111.983 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.886 HD13 ' O ' ' A' ' 14' ' ' GLY . 18.4 mm -135.93 135.68 50.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.682 0.277 . . . . 0.0 111.319 179.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.932 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.74 140.37 19.82 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 176.5 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.581 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -149.55 117.51 6.31 Favored 'General case' 0 C--N 1.31 -1.115 0 C-N-CA 119.607 -0.837 . . . . 0.0 111.614 -178.581 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.899 HD13 HG22 ' A' ' 103' ' ' THR . 4.3 mt -85.39 142.77 12.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.738 -178.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.613 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -121.26 92.83 3.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.399 179.634 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.409 ' HB2' ' NE2' ' A' ' 3' ' ' HIS . 0.7 OUTLIER -81.18 0.42 36.57 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.487 -179.867 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -82.67 0.65 42.26 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.295 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.613 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -102.24 -162.56 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.924 0.392 . . . . 0.0 110.858 -179.962 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.414 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 10.1 p -174.43 101.07 0.28 Allowed Pre-proline 0 C--N 1.327 -0.374 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.437 179.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.45 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 56.4 Cg_endo -70.71 165.64 78.76 Favored 'Cis proline' 0 C--N 1.347 0.461 0 C-N-CA 123.438 -1.484 . . . . 0.0 112.807 0.278 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.462 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -58.25 176.74 0.15 Allowed 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.308 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.478 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 0.0 OUTLIER -163.7 135.46 4.87 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.287 179.287 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.804 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.85 147.37 31.01 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.786 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.737 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.2 m -132.73 113.65 13.22 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.551 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 79.7 t90 -91.96 110.5 21.86 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 178.331 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.468 ' O ' ' N ' ' A' ' 15' ' ' ILE . 8.8 ttt180 -110.51 131.0 55.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.961 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.5 m -49.87 158.92 0.44 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.53 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.411 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 48.4 m -74.42 -37.35 63.36 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.379 0.609 . . . . 0.0 109.674 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -84.21 -16.02 44.83 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.027 -0.988 . . . . 0.0 111.154 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.47 34.53 11.81 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.235 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.92 -25.53 26.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.638 0.256 . . . . 0.0 111.364 -179.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.78 163.75 2.86 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.31 0.576 . . . . 0.0 111.403 -179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.737 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.65 146.83 19.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.07 -178.757 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.43 ' ND1' ' CZ ' ' A' ' 9' ' ' PHE . 12.6 m-70 -120.48 120.18 35.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.698 179.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.525 HG23 HG23 ' A' ' 28' ' ' THR . 0.3 OUTLIER -96.43 141.45 29.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.805 -179.772 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.555 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -129.98 139.83 50.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.413 -179.507 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.418 ' O ' HG12 ' A' ' 45' ' ' ILE . 30.7 t -103.87 96.32 4.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 177.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.812 HD11 HD22 ' A' ' 104' ' ' LEU . 0.6 OUTLIER -41.75 -24.21 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.127 -178.775 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.45 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 1.8 t -77.38 -48.59 16.9 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 179.388 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 34.7 p -64.49 -27.5 69.02 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.867 HD12 ' HB3' ' A' ' 62' ' ' LEU . 36.7 mm -56.48 112.59 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.595 178.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.418 ' N ' ' O ' ' A' ' 63' ' ' ILE . 1.4 t70 -52.37 -35.05 50.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.882 0.373 . . . . 0.0 111.034 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.412 ' HG2' ' HB ' ' A' ' 63' ' ' ILE . 12.6 pttt -172.34 167.44 5.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.813 179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 1.013 HD23 HG21 ' B' ' 673' ' ' VAL . 15.1 tp -109.05 118.85 37.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.986 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.4 ' HB3' ' HB3' ' A' ' 61' ' ' ARG . 10.6 tt0 -114.27 145.92 41.12 Favored 'General case' 0 C--O 1.225 -0.224 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.423 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.629 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -156.97 151.07 24.95 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.129 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.674 HG23 ' HB2' ' A' ' 59' ' ' MET . 9.5 p -56.44 136.41 76.47 Favored Pre-proline 0 C--N 1.331 -0.196 0 CA-C-O 120.657 0.265 . . . . 0.0 111.295 -179.576 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -71.95 163.44 38.81 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.665 2.243 . . . . 0.0 112.358 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.44 -25.14 49.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.403 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.9 t -92.25 18.27 8.48 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.209 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.408 ' CB ' ' HB ' ' A' ' 51' ' ' THR . 94.0 p -87.13 123.15 31.87 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.921 0.391 . . . . 0.0 111.296 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -58.52 -18.56 30.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.133 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.35 166.96 21.61 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.671 179.473 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.426 ' HG2' ' CA ' ' A' ' 94' ' ' ARG . 3.0 mpp? -112.01 124.29 52.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.201 -179.501 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.674 ' HB2' HG23 ' A' ' 51' ' ' THR . 31.0 mtm -149.69 138.48 20.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.637 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.629 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 16.0 mt -117.68 143.54 46.09 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.054 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.513 ' HD3' HD13 ' A' ' 63' ' ' ILE . 0.3 OUTLIER -144.59 149.57 36.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.022 0.439 . . . . 0.0 112.023 -179.043 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.867 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.8 mp -128.08 118.05 22.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.819 178.533 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.711 HD12 ' HG2' ' A' ' 86' ' ' ARG . 10.0 mm -76.5 156.5 5.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.037 -179.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -117.7 152.04 17.8 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.53 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.1 mttm -76.73 115.63 16.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.824 0.345 . . . . 0.0 110.911 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.504 HG22 ' N ' ' A' ' 67' ' ' ASP . 14.5 p -88.16 160.87 2.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.174 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.504 ' N ' HG22 ' A' ' 66' ' ' VAL . 14.0 p30 -101.71 73.11 1.41 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.623 179.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.529 ' HA ' HG13 ' A' ' 81' ' ' VAL . 9.4 mt-10 -54.92 -23.99 21.48 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.256 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.6 m -63.44 -21.77 66.49 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.0 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -63.33 -62.88 1.39 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.795 179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 5.8 mttm 62.77 94.47 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.819 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.6 128.74 45.02 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.857 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.48 153.96 37.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.913 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.46 -42.16 7.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.984 0.421 . . . . 0.0 111.007 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 167.76 -29.66 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.166 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -101.6 20.79 15.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.356 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.21 36.05 56.29 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.555 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -90.29 0.38 57.26 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 54.77 110.42 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.901 0.381 . . . . 0.0 111.661 179.423 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 7.1 t -113.44 133.54 59.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.619 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.529 HG13 ' HA ' ' A' ' 68' ' ' GLU . 42.5 t -106.17 85.78 1.79 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.605 179.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 81' ' ' VAL . 1.5 Cg_endo -43.85 139.9 5.19 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.954 2.436 . . . . 0.0 112.633 -179.598 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -58.82 165.08 3.53 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.122 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.429 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 5.3 Cg_exo -81.7 158.29 18.86 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 123.683 2.922 . . . . 0.0 112.33 -179.094 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -84.0 117.3 23.3 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.011 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.711 ' HG2' HD12 ' A' ' 63' ' ' ILE . 0.4 OUTLIER -114.65 141.55 47.65 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.751 179.864 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.502 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 10.0 m-70 -99.09 111.33 23.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.756 0.312 . . . . 0.0 110.164 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.456 ' HE3' ' CE1' ' B' ' 670' ' ' PHE . 9.0 ttt -94.74 134.7 37.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.065 0.46 . . . . 0.0 111.586 -179.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.932 ' CD1' HD11 ' A' ' 16' ' ' ILE . 51.5 m-85 -135.31 116.62 14.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.667 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.443 ' HB3' ' HB ' ' A' ' 8' ' ' ILE . 0.5 OUTLIER -92.22 114.8 27.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.894 0.378 . . . . 0.0 110.491 179.775 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.476 ' CE1' ' HB2' ' A' ' 7' ' ' ALA . 9.0 m-85 -89.74 136.33 33.1 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.733 -179.368 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -101.08 27.79 5.82 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.306 179.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.441 ' CB ' HG23 ' A' ' 96' ' ' VAL . 9.9 m-20 -175.24 112.76 0.13 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.556 -179.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.458 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -55.79 -19.39 11.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.927 179.72 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.21 -47.95 59.25 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.796 179.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.441 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -66.83 -45.37 87.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.006 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.458 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -63.9 -37.02 85.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.766 179.31 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.481 ' O ' ' HE2' ' A' ' 102' ' ' MET . 14.1 m-20 -61.14 -31.95 71.66 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 121.093 0.473 . . . . 0.0 109.941 178.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 -81.97 -54.04 5.64 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.502 179.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.538 HD12 ' CG2' ' A' ' 16' ' ' ILE . 15.3 mm -57.5 -60.01 2.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.896 179.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.468 ' HD3' HG11 ' B' ' 673' ' ' VAL . 0.4 OUTLIER -51.6 -37.3 49.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.269 -179.584 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.481 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 39.1 mtm -81.35 -27.72 34.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.218 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.899 HG22 HD13 ' A' ' 18' ' ' ILE . 1.0 OUTLIER -81.49 -31.44 32.9 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.852 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.812 HD22 HD11 ' A' ' 42' ' ' LEU . 33.7 mt -64.8 -55.95 16.55 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.188 -0.46 . . . . 0.0 109.96 179.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.404 ' NE2' ' O ' ' A' ' 101' ' ' LYS . 0.5 OUTLIER -62.34 -35.9 80.54 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.926 179.64 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -50.39 -36.97 35.11 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-O 121.289 0.566 . . . . 0.0 109.811 179.287 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.015 HG22 ' HE1' ' A' ' 111' ' ' TYR . 12.4 mt -85.78 -52.08 12.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.02 178.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.67 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.53 -58.1 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.342 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.229 179.225 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 1.4 m -47.29 -25.98 1.11 Allowed 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.133 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.454 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 33.6 mtp180 -74.08 -25.04 59.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.214 179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 1.015 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -75.41 -35.28 61.04 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 179.661 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.74 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.34 -43.46 19.03 Favored 'General case' 0 CA--C 1.505 -0.783 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 178.873 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -61.66 -31.59 71.72 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 113.838 -1.528 . . . . 0.0 108.983 178.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.454 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.54 -19.13 22.27 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.681 178.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 29.4 t0 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.151 -0.928 . . . . 0.0 110.999 -179.953 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.854 0.359 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 5.1 mp -124.2 69.62 1.08 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.878 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -87.13 53.78 2.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.027 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 16.5 m 42.18 61.36 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.219 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.716 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 665' ' ' LEU . . . . . 0.857 HD13 ' N ' ' B' ' 666' ' ' SER . 0.9 OUTLIER -59.07 150.98 23.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.914 179.991 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 666' ' ' SER . . . . . 0.857 ' N ' HD13 ' B' ' 665' ' ' LEU . 7.2 m -121.52 70.35 0.94 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.615 179.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -91.44 19.17 6.36 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.785 -179.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -105.7 5.58 31.17 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.243 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.28 19.86 12.06 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.715 0.293 . . . . 0.0 111.145 -179.979 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 670' ' ' PHE . . . . . 0.456 ' CE1' ' HE3' ' A' ' 88' ' ' MET . 4.1 m-85 -68.19 131.37 45.27 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.889 0.376 . . . . 0.0 111.007 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -107.16 127.02 53.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.788 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -71.98 112.57 8.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.934 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 673' ' ' VAL . . . . . 1.013 HG21 HD23 ' A' ' 48' ' ' LEU . 26.9 m -59.19 148.47 71.7 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.022 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.21 135.15 28.67 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.618 2.212 . . . . 0.0 112.485 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 675' ' ' THR . . . . . 0.414 HG21 HG21 ' A' ' 108' ' ' ILE . 0.8 OUTLIER -129.9 116.69 19.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.89 179.781 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 2.6 pttt 179.88 109.98 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.806 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 9.3 p 60.85 152.03 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.081 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -90.43 78.4 6.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.843 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 9.0 tt -108.44 -20.42 6.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.373 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.866 179.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo . . . . . 0 N--CA 1.489 1.221 0 CA-C-O 120.794 0.247 . . . . 0.0 111.665 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.67 ' O ' HG21 ' A' ' 103' ' ' THR . 25.9 p -106.19 -37.55 6.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.896 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.42 ' O ' ' N ' ' A' ' 18' ' ' ILE . 18.6 m80 -91.39 25.83 2.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.009 179.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.555 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 19.2 p -158.31 133.63 8.71 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 121.244 0.545 . . . . 0.0 111.212 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.534 ' N ' HD11 ' A' ' 100' ' ' ILE . . . -170.29 138.78 5.17 Favored Glycine 0 N--CA 1.448 -0.527 0 N-CA-C 110.767 -0.933 . . . . 0.0 110.767 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.566 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -80.26 142.28 34.75 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -178.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.507 ' C ' HD13 ' A' ' 8' ' ' ILE . . . -154.66 171.19 19.9 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.326 -179.35 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.645 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -99.08 127.59 51.58 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.388 -179.782 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.471 ' CB ' ' CE2' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -127.19 107.18 9.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.994 0.426 . . . . 0.0 111.545 179.122 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 68.04 53.87 0.62 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.221 179.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.06 -0.7 1.64 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.91 179.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.566 ' O ' HG23 ' A' ' 8' ' ' ILE . 37.1 t -105.15 151.91 7.22 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.481 0 CA-C-O 121.201 0.524 . . . . 0.0 110.576 179.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.471 ' HA ' HD12 ' A' ' 8' ' ' ILE . 54.7 p -114.09 115.84 28.19 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.136 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.729 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -138.04 -139.27 3.83 Favored Glycine 0 N--CA 1.444 -0.804 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.94 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.729 HD13 ' O ' ' A' ' 14' ' ' GLY . 15.9 mm -129.32 134.93 62.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 120.844 0.354 . . . . 0.0 111.219 179.691 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.845 HD11 ' CD1' ' A' ' 89' ' ' PHE . 0.2 OUTLIER -100.36 140.62 18.96 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.721 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 176.703 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.555 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.46 118.1 5.74 Favored 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 119.537 -0.865 . . . . 0.0 111.507 -178.347 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.685 HD12 ' HB ' ' A' ' 103' ' ' THR . 6.9 mt -80.79 142.96 13.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 114.385 -1.28 . . . . 0.0 112.254 -178.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.642 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -119.39 92.65 3.84 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.96 179.057 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.26 -0.95 47.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.305 -179.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 95.2 m-20 -83.0 1.07 41.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.57 -0.287 . . . . 0.0 111.241 179.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.642 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -102.91 -162.92 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.837 0.351 . . . . 0.0 110.758 179.998 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.412 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 9.9 p -174.42 101.07 0.28 Allowed Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.333 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.456 ' CB ' ' HB2' ' A' ' 43' ' ' SER . 58.5 Cg_endo -71.74 165.4 81.75 Favored 'Cis proline' 0 C--N 1.347 0.464 0 C-N-CA 123.569 -1.43 . . . . 0.0 112.905 0.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.55 176.57 0.13 Allowed 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.514 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.518 ' HA ' ' O ' ' A' ' 40' ' ' VAL . 13.7 pt-20 -163.76 136.85 5.36 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.229 179.104 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.796 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.92 129.06 55.12 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 178.954 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.507 HG22 ' CG2' ' A' ' 37' ' ' VAL . 6.7 m -111.67 113.18 25.39 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.555 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.489 ' HA ' ' O ' ' A' ' 15' ' ' ILE . 75.4 t90 -91.99 110.63 22.0 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.737 178.668 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -107.98 126.84 53.18 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.912 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.4 t -49.77 156.53 0.69 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.378 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.442 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 54.4 m -71.69 -38.04 70.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.433 0.635 . . . . 0.0 109.415 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -78.75 -9.99 59.62 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 114.897 -1.047 . . . . 0.0 111.184 179.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 69.77 42.38 70.77 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.276 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -101.98 -23.18 14.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.729 0.299 . . . . 0.0 111.262 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -168.19 153.85 6.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.385 0.612 . . . . 0.0 111.487 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.507 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.5 OUTLIER -140.97 155.47 21.74 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.072 -178.634 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.427 ' HB2' ' CE2' ' A' ' 9' ' ' PHE . 10.7 m-70 -131.2 121.96 25.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.491 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.42 127.23 42.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.0 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.567 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -113.11 138.94 40.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.16 -179.915 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.474 ' CG1' HG23 ' A' ' 44' ' ' THR . 44.5 t -103.86 95.85 4.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.067 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.727 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.7 OUTLIER -41.8 -25.09 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.123 -0.489 . . . . 0.0 112.008 -178.905 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.456 ' HB2' ' CB ' ' A' ' 24' ' ' PRO . 2.1 t -76.07 -48.64 20.06 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 179.352 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.474 HG23 ' CG1' ' A' ' 41' ' ' VAL . 31.0 p -64.68 -27.89 69.23 Favored 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.407 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.842 HD12 ' HB3' ' A' ' 62' ' ' LEU . 41.6 mm -56.43 108.15 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.471 178.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.423 ' N ' ' O ' ' A' ' 63' ' ' ILE . 50.5 t0 -48.74 -34.03 11.37 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.807 0.337 . . . . 0.0 111.143 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.414 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 2.3 pttt -172.56 165.02 5.57 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.853 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.811 HD23 HG21 ' B' ' 673' ' ' VAL . 8.3 tp -109.03 119.19 38.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.76 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.411 ' HB2' ' HB3' ' A' ' 61' ' ' ARG . 3.8 mt-30 -115.72 147.13 41.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.413 179.46 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.668 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.03 149.11 22.83 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.79 -0.187 . . . . 0.0 110.969 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.1 p -54.13 138.89 55.97 Favored Pre-proline 0 CA--C 1.53 0.18 0 CA-C-O 120.628 0.251 . . . . 0.0 110.819 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -68.99 163.18 38.64 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.538 2.159 . . . . 0.0 112.524 -179.665 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.03 -31.67 72.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.088 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -70.71 -20.94 62.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.944 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 38.8 m -94.0 116.14 28.55 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.714 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -55.86 -18.59 9.13 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.64 179.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 17.7 mmtt -67.76 128.67 37.35 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.836 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -109.09 99.15 8.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.504 179.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.44 ' O ' HD23 ' A' ' 60' ' ' LEU . 46.2 mtm -149.6 143.03 25.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.755 -179.253 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.668 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 24.8 mt -121.78 145.19 48.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.205 178.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.442 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 14.8 ttm-85 -140.29 150.71 44.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.937 0.399 . . . . 0.0 111.6 -179.373 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.842 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.4 mp -128.07 117.75 22.22 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.958 178.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.46 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 21.4 mm -76.54 156.51 5.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.857 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.415 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -118.69 139.17 14.26 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.64 -0.791 . . . . 0.0 112.614 -179.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.5 mttt -59.69 123.49 17.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.86 0.362 . . . . 0.0 110.787 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.48 HG22 ' N ' ' A' ' 67' ' ' ASP . 11.7 p -101.23 160.02 3.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.287 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.48 ' N ' HG22 ' A' ' 66' ' ' VAL . 3.0 m-20 -98.06 48.16 1.0 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.806 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.38 -20.41 54.58 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.262 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.0 m -59.33 -21.45 59.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.163 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.7 mmmt -72.82 -67.66 0.54 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.856 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.506 ' HA ' HG23 ' A' ' 81' ' ' VAL . 11.5 mttm 62.12 94.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.767 -179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.58 170.29 8.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.839 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -133.01 -166.7 1.8 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.737 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -138.32 -170.16 2.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.993 179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -58.78 -21.28 55.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.303 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -110.25 29.09 7.99 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.01 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.63 26.17 38.14 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.639 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -62.44 -164.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.798 0.332 . . . . 0.0 110.934 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -133.45 115.41 14.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.581 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 90.1 t -86.98 -61.16 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.558 -179.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.676 ' O ' HG12 ' A' ' 81' ' ' VAL . 0.9 OUTLIER 40.85 95.98 0.04 OUTLIER Pre-proline 0 CA--C 1.536 0.414 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.128 179.904 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.499 ' HD2' ' HA ' ' A' ' 81' ' ' VAL . 9.6 Cg_endo -52.05 139.08 52.66 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.599 2.199 . . . . 0.0 112.398 -179.301 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 1.4 mmmm -69.09 155.97 92.49 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.946 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.42 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 2.3 Cg_endo -85.25 153.58 10.83 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.528 2.818 . . . . 0.0 112.444 -179.171 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -80.93 156.26 26.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.759 179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.42 ' HG3' HG23 ' A' ' 63' ' ' ILE . 0.9 OUTLIER -163.66 119.26 1.65 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.815 -179.739 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.459 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 40.9 m-70 -94.05 111.42 23.14 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 179.423 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.564 ' HE1' ' HB3' ' B' ' 667' ' ' GLU . 0.0 OUTLIER -94.25 110.97 22.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.993 0.425 . . . . 0.0 111.241 -179.282 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.845 ' CD1' HD11 ' A' ' 16' ' ' ILE . 96.2 m-85 -115.16 116.6 28.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.537 179.755 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -101.63 114.53 28.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.637 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.467 ' CZ ' ' HB2' ' A' ' 7' ' ' ALA . 3.7 m-85 -94.35 137.27 33.71 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.077 -179.751 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -94.0 41.06 1.08 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.707 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.612 ' HB3' HG23 ' A' ' 96' ' ' VAL . 1.6 m-20 177.97 115.41 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.333 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.425 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.0 OUTLIER -58.2 -16.47 13.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.829 179.721 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -73.19 -45.31 57.1 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-O 121.099 0.476 . . . . 0.0 110.12 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.612 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -65.24 -49.93 76.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.42 179.031 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.425 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.1 OUTLIER -62.69 -36.24 82.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.49 179.523 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -70.43 -35.01 73.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.076 0.465 . . . . 0.0 110.191 179.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.404 ' O ' ' OG1' ' A' ' 103' ' ' THR . 73.1 m-20 -81.75 -27.48 33.79 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.468 179.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.534 HD11 ' N ' ' A' ' 5' ' ' GLY . 1.3 mm -86.21 -59.19 2.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.959 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.611 ' HD3' HG11 ' B' ' 673' ' ' VAL . 6.5 ttmt -43.98 -31.05 0.81 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.193 -179.55 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.416 ' HG3' ' N ' ' A' ' 103' ' ' THR . 19.8 ptp -77.83 -39.75 42.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.352 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.685 ' HB ' HD12 ' A' ' 18' ' ' ILE . 0.3 OUTLIER -60.13 -52.42 65.43 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.794 179.654 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.77 HD13 HD11 ' A' ' 48' ' ' LEU . 9.5 mt -51.5 -59.45 4.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.369 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.432 ' NE2' ' O ' ' A' ' 101' ' ' LYS . 0.8 OUTLIER -60.49 -34.26 73.8 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.87 179.601 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -56.09 -36.22 67.89 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.232 0.539 . . . . 0.0 109.856 179.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.031 HG22 ' HE1' ' A' ' 111' ' ' TYR . 8.3 mt -85.76 -50.61 14.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.367 179.104 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.679 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.13 -56.4 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.427 179.433 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -46.26 -28.23 1.23 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.047 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.468 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 29.2 mtt180 -72.77 -25.04 61.03 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.346 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 1.031 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -76.34 -35.12 58.91 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 179.884 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.735 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.17 -44.01 18.5 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 178.954 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 54.7 t0 -61.87 -31.24 71.5 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 113.822 -1.535 . . . . 0.0 109.148 178.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.468 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.68 -19.35 21.93 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.85 178.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.274 -0.869 . . . . 0.0 110.982 179.973 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 73.8 m-20 . . . . . 0 N--CA 1.488 1.437 0 CA-C-O 120.782 0.325 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 662' ' ' LEU . . . . . . . . . . . . . 3.9 tp 60.21 63.76 1.35 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.891 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -176.46 95.56 0.05 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.86 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 21.4 t 66.38 95.6 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.086 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 665' ' ' LEU . . . . . 0.701 HD13 ' H ' ' B' ' 666' ' ' SER . 0.2 OUTLIER 63.16 147.93 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.809 179.962 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 666' ' ' SER . . . . . 0.701 ' H ' HD13 ' B' ' 665' ' ' LEU . 3.0 t -133.46 74.76 1.57 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.851 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 667' ' ' GLU . . . . . 0.564 ' HB3' ' HE1' ' A' ' 88' ' ' MET . 1.1 pt-20 -94.13 19.12 9.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.553 -179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -83.23 0.71 44.28 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.395 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -120.2 19.88 12.11 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.587 0.232 . . . . 0.0 111.071 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 670' ' ' PHE . . . . . 0.511 ' CE1' ' HE3' ' A' ' 88' ' ' MET . 1.8 m-85 -63.44 122.11 15.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.834 0.35 . . . . 0.0 110.915 179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -101.53 170.98 7.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.933 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -114.48 113.36 24.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.955 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 673' ' ' VAL . . . . . 0.811 HG21 HD23 ' A' ' 48' ' ' LEU . 35.1 m -66.14 149.72 97.49 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.01 -179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -72.27 155.65 55.88 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.57 2.18 . . . . 0.0 112.514 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 675' ' ' THR . . . . . 0.595 HG21 HG21 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -139.07 116.99 11.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.744 179.881 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 3.6 tttt -56.38 121.67 10.1 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.073 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 32.1 t -149.97 -44.24 0.13 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.105 179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -122.44 163.28 20.13 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.864 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 20.9 pt -82.72 -20.41 9.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.405 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 11.8 m . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.239 -0.886 . . . . 0.0 110.868 179.953 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo . . . . . 0 N--CA 1.488 1.177 0 CA-C-O 121.006 0.336 . . . . 0.0 111.727 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.446 ' O ' ' CD2' ' A' ' 3' ' ' HIS . 26.3 p -105.8 22.85 14.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.12 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.446 ' CD2' ' O ' ' A' ' 2' ' ' SER . 22.3 m170 -157.52 24.99 0.29 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.934 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.577 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 2.6 p -158.49 156.15 29.75 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.205 0.526 . . . . 0.0 111.295 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.493 ' O ' ' N ' ' A' ' 16' ' ' ILE . . . 172.75 139.44 2.85 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 110.898 -0.881 . . . . 0.0 110.898 -179.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.544 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -84.0 143.17 29.96 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.621 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . . . -152.46 171.15 18.52 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.079 -179.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.654 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -102.67 126.48 56.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-O 120.786 0.327 . . . . 0.0 111.715 -179.613 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.481 ' HB3' ' CE2' ' A' ' 29' ' ' TRP . 6.6 t80 -126.63 109.81 12.51 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.917 0.389 . . . . 0.0 111.128 178.388 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 3.8 mm-40 67.73 50.43 0.87 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.828 179.214 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 6.1 mttt 69.23 -3.42 1.55 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 179.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.493 ' O ' HG23 ' A' ' 8' ' ' ILE . 17.0 t -101.38 148.58 7.13 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.453 0 CA-C-O 121.097 0.475 . . . . 0.0 110.564 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.451 ' HA ' HD12 ' A' ' 8' ' ' ILE . 73.0 p -111.12 114.62 28.01 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.024 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.893 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -134.18 -133.99 3.38 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.953 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.893 HD13 ' O ' ' A' ' 14' ' ' GLY . 18.8 mm -136.35 136.49 48.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.683 0.278 . . . . 0.0 111.34 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.94 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.84 141.47 17.5 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.63 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 176.436 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.577 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.4 118.39 5.86 Favored 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.534 -178.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.935 HD13 HG22 ' A' ' 103' ' ' THR . 4.8 mt -85.33 142.73 12.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 114.537 -1.21 . . . . 0.0 111.796 -178.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.619 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -121.65 93.07 3.89 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.419 179.596 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.442 ' HB2' ' NE2' ' A' ' 3' ' ' HIS . 0.1 OUTLIER -81.19 1.09 33.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.532 -179.777 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -81.86 0.47 39.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.122 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.619 HG23 ' O ' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -101.75 -161.99 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 120.801 0.334 . . . . 0.0 110.838 179.971 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.41 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 15.6 p -175.24 100.93 0.26 Allowed Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.455 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.442 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 10.5 Cg_exo -70.11 166.04 76.04 Favored 'Cis proline' 0 C--N 1.347 0.471 0 C-N-CA 123.55 -1.437 . . . . 0.0 112.512 0.296 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.459 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -60.04 176.99 0.27 Allowed 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.248 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.523 ' HG2' HG21 ' A' ' 22' ' ' VAL . 6.9 pt-20 -163.78 138.19 5.88 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.141 179.177 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.823 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.76 149.05 28.66 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.874 -0.788 . . . . 0.0 108.874 178.86 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.792 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.3 m -133.84 112.58 11.44 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -178.272 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.538 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 76.8 t90 -92.11 110.68 22.06 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.258 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.411 ' O ' ' N ' ' A' ' 15' ' ' ILE . 7.1 ptp180 -112.13 133.44 54.27 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.718 0.294 . . . . 0.0 110.761 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 25.4 m -49.82 161.02 0.26 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.593 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.407 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 53.5 m -74.22 -37.78 63.75 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.404 0.621 . . . . 0.0 109.659 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.72 -17.29 41.76 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.041 179.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.81 33.74 10.83 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.367 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -83.83 -27.85 28.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.714 0.292 . . . . 0.0 111.258 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.96 161.49 5.72 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.283 0.564 . . . . 0.0 111.348 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.792 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.8 OUTLIER -145.69 140.82 22.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.164 -0.926 . . . . 0.0 111.036 -178.709 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.476 ' CD2' ' CE1' ' A' ' 9' ' ' PHE . 89.4 m-70 -114.58 121.25 42.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.683 179.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.482 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.54 140.94 30.43 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.842 -179.856 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.567 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 1.0 OUTLIER -127.79 140.47 49.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.329 -179.673 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.439 ' O ' HG12 ' A' ' 45' ' ' ILE . 41.1 t -103.95 95.94 4.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 177.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.771 HD11 HD22 ' A' ' 104' ' ' LEU . 0.7 OUTLIER -42.27 -23.83 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.972 -178.955 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.442 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.5 OUTLIER -76.42 -48.32 20.13 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.255 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.411 HG23 ' CG1' ' A' ' 41' ' ' VAL . 38.9 p -64.53 -27.89 69.28 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 178.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.826 HD12 ' HB3' ' A' ' 62' ' ' LEU . 48.4 mm -56.9 108.49 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.582 178.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.414 ' N ' ' O ' ' A' ' 63' ' ' ILE . 8.3 t70 -51.93 -33.77 38.81 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.871 0.367 . . . . 0.0 110.819 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.422 ' HG3' HG12 ' A' ' 63' ' ' ILE . 13.8 pttt -171.23 165.04 7.3 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.703 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.89 HD23 HG21 ' B' ' 673' ' ' VAL . 16.6 tp -108.82 122.47 47.25 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.85 -179.554 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -115.49 141.56 47.89 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 116.518 -0.31 . . . . 0.0 110.473 179.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.658 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.06 141.15 16.31 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.075 -179.739 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.562 HG23 ' HB2' ' A' ' 59' ' ' MET . 44.6 p -52.58 142.97 30.08 Favored Pre-proline 0 CA--C 1.53 0.174 0 CA-C-N 116.607 -0.27 . . . . 0.0 111.09 -179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -72.69 163.24 39.05 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.566 2.177 . . . . 0.0 112.516 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.45 -31.44 70.75 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.189 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 1.5 m -70.79 -21.32 62.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.021 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 46.6 t -96.83 117.22 30.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.929 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -55.19 -19.97 9.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.515 179.322 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 13.8 mmtt -61.26 121.62 13.03 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.624 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.439 ' HE2' ' H ' ' A' ' 94' ' ' ARG . 1.3 mpt? -106.16 99.41 9.0 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.857 -179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.562 ' HB2' HG23 ' A' ' 51' ' ' THR . 3.1 mpp? -149.88 138.52 20.81 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.93 0.395 . . . . 0.0 111.996 -179.517 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.661 HD12 ' CZ ' ' A' ' 91' ' ' PHE . 15.5 mt -120.0 140.73 50.51 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.615 178.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.464 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 13.0 ttm180 -143.38 151.67 40.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.032 0.444 . . . . 0.0 112.126 -178.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.826 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.5 mp -128.52 117.63 21.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.95 178.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.479 ' O ' ' HA ' ' A' ' 45' ' ' ILE . 14.2 mm -76.66 156.43 5.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.718 -0.219 . . . . 0.0 110.805 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.425 ' O ' ' HB2' ' A' ' 84' ' ' PRO . . . -117.24 178.05 16.92 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.531 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.5 mttm -102.05 120.31 40.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.785 0.326 . . . . 0.0 111.001 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.444 ' HB ' ' HA ' ' A' ' 84' ' ' PRO . 9.8 p -83.29 160.56 3.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.771 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.444 ' N ' HG22 ' A' ' 66' ' ' VAL . 12.4 t70 -132.75 36.92 3.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.741 0.305 . . . . 0.0 111.44 -179.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 43.08 29.89 0.23 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.323 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 36.3 m -94.26 -28.15 15.76 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.974 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.6 mmtm -57.06 -79.88 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.708 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 11.0 mtpt 55.37 89.82 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.2 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.419 ' HG2' ' HG3' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -116.77 121.19 40.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.589 179.644 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -74.39 150.59 39.96 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.068 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -97.58 -166.19 1.35 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.833 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -65.72 -15.44 62.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.346 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -113.11 14.22 19.47 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.685 -0.234 . . . . 0.0 111.399 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 54.91 40.46 72.73 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.501 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 87.6 m-20 -84.65 3.09 38.66 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.844 0.312 . . . . 0.0 111.844 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 79' ' ' GLU . 10.3 pt-20 42.24 97.2 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.09 0.472 . . . . 0.0 112.022 179.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.465 HG12 ' N ' ' A' ' 81' ' ' VAL . 13.9 t -109.83 157.66 10.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.721 -179.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.465 ' N ' HG12 ' A' ' 80' ' ' VAL . 52.8 t -111.92 82.24 4.01 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.326 179.288 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.419 ' HG3' ' HG2' ' A' ' 72' ' ' ARG . 83.1 Cg_exo -42.1 149.49 0.29 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.933 2.422 . . . . 0.0 112.954 -179.56 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -46.1 168.61 0.11 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.521 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.444 ' HA ' ' HB ' ' A' ' 66' ' ' VAL . 8.1 Cg_exo -77.18 179.61 6.35 Favored 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 123.705 2.937 . . . . 0.0 112.403 -178.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.4 162.98 0.29 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.876 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.438 ' CG ' HD12 ' A' ' 63' ' ' ILE . 0.2 OUTLIER -166.67 116.83 0.92 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.028 -179.67 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.479 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 37.8 m-70 -96.5 111.18 23.39 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.283 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.404 ' CE ' ' CZ ' ' B' ' 670' ' ' PHE . 0.0 OUTLIER -96.28 128.01 42.81 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.076 0.465 . . . . 0.0 111.637 -178.866 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.94 ' CD2' HD11 ' A' ' 16' ' ' ILE . 58.5 m-85 -132.15 116.57 17.17 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.481 179.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.459 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -91.61 115.04 27.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.953 0.406 . . . . 0.0 110.632 179.867 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.661 ' CZ ' HD12 ' A' ' 60' ' ' LEU . 2.8 m-85 -91.53 137.72 32.14 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.162 -179.522 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 22.5 m-20 -102.04 34.87 2.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.743 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.6 ' HB3' HG23 ' A' ' 96' ' ' VAL . 10.3 t30 179.14 123.42 0.05 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.943 -179.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.526 ' HA ' ' HG3' ' A' ' 97' ' ' MET . 2.8 mmm-85 -61.85 -14.41 33.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.547 179.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -71.72 -51.14 24.38 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 121.029 0.442 . . . . 0.0 110.352 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.6 HG23 ' HB3' ' A' ' 93' ' ' ASN . 0.2 OUTLIER -56.94 -45.28 83.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.624 179.415 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.526 ' HG3' ' HA ' ' A' ' 94' ' ' ARG . 1.0 OUTLIER -57.14 -48.97 77.36 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.584 178.877 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.454 ' O ' ' HE2' ' A' ' 102' ' ' MET . 12.1 t70 -52.87 -32.94 47.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.378 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 54.3 m-80 -82.52 -57.07 3.51 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.615 -0.72 . . . . 0.0 111.09 179.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.546 HD12 ' CG2' ' A' ' 16' ' ' ILE . 11.3 mm -65.08 -60.45 2.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.958 -179.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.458 ' HD3' HG11 ' B' ' 673' ' ' VAL . 5.6 ttmt -50.18 -37.84 36.87 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.493 -178.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.454 ' HE2' ' O ' ' A' ' 98' ' ' ASP . 14.4 mtm -80.04 -27.16 39.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.037 -179.663 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.935 HG22 HD13 ' A' ' 18' ' ' ILE . 1.0 OUTLIER -81.75 -31.71 31.83 Favored 'General case' 0 N--CA 1.443 -0.793 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 179.811 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.771 HD22 HD11 ' A' ' 42' ' ' LEU . 45.2 mt -65.1 -57.45 8.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.115 -0.493 . . . . 0.0 109.882 179.068 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.419 ' NE2' ' O ' ' A' ' 101' ' ' LYS . 0.1 OUTLIER -63.43 -34.06 76.92 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.932 179.562 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -52.31 -36.78 54.1 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.348 0.594 . . . . 0.0 109.829 179.332 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.015 HG22 ' HE1' ' A' ' 111' ' ' TYR . 12.1 mt -85.84 -51.71 12.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.049 178.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.77 HG21 HG21 ' B' ' 675' ' ' THR . 0.9 OUTLIER -42.63 -57.54 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.326 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.259 179.17 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 10.9 m -47.49 -26.29 1.34 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.027 179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.451 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 73.5 mtt180 -73.64 -25.04 60.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.265 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 1.015 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -75.49 -34.9 60.9 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 179.734 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.747 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -82.47 -43.31 17.38 Favored 'General case' 0 CA--C 1.505 -0.757 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 178.923 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -61.45 -31.54 71.5 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.875 -1.511 . . . . 0.0 109.092 178.15 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.451 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.65 -20.83 20.45 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.611 178.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.361 -0.828 . . . . 0.0 110.838 179.821 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.825 0.345 . . . . 0.0 111.196 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 662' ' ' LEU . . . . . 0.65 ' O ' HD12 ' B' ' 662' ' ' LEU . 4.2 pp -119.39 30.62 7.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.922 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 663' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -86.67 53.04 2.68 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.028 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 664' ' ' VAL . . . . . . . . . . . . . 17.7 m -142.56 40.23 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.08 -179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 665' ' ' LEU . . . . . 0.462 HD13 ' H ' ' B' ' 666' ' ' SER . 0.2 OUTLIER -75.98 162.07 28.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.792 -179.976 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 666' ' ' SER . . . . . 0.613 ' HB3' HD11 ' B' ' 669' ' ' LEU . 3.1 t -176.36 96.06 0.05 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.744 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 667' ' ' GLU . . . . . 0.449 ' HA ' ' CD1' ' B' ' 670' ' ' PHE . 2.4 pt-20 -94.08 19.24 9.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.112 0.482 . . . . 0.0 111.509 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -93.2 -10.36 35.99 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.338 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.673 ' N ' HD13 ' B' ' 669' ' ' LEU . 0.0 OUTLIER -120.2 19.91 12.11 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 120.679 0.276 . . . . 0.0 111.275 179.954 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 670' ' ' PHE . . . . . 0.449 ' CD1' ' HA ' ' B' ' 667' ' ' GLU . 2.7 m-85 -75.73 122.07 23.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.773 0.321 . . . . 0.0 110.884 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -111.74 166.93 10.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.801 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 11.4 p30 -108.31 112.13 24.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.991 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 673' ' ' VAL . . . . . 0.89 HG21 HD23 ' A' ' 48' ' ' LEU . 27.0 m -58.92 118.9 33.07 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.828 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_exo -48.02 136.73 23.38 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.614 2.21 . . . . 0.0 112.675 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 675' ' ' THR . . . . . 0.77 HG21 HG21 ' A' ' 108' ' ' ILE . 0.6 OUTLIER -122.56 116.87 24.62 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.759 179.825 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 179.88 166.0 1.2 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.832 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 9.9 t -167.79 78.12 0.16 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.884 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -71.68 -172.97 0.88 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.874 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 1.8 pp -110.56 -19.71 6.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.41 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 31.6 p . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.217 -0.896 . . . . 0.0 110.901 179.986 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo . . . . . 0 N--CA 1.487 1.143 0 CA-C-O 120.964 0.318 . . . . 0.0 111.839 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.659 ' O ' HG21 ' A' ' 103' ' ' THR . 58.1 p -86.38 -37.49 18.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.904 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.454 ' O ' ' N ' ' A' ' 18' ' ' ILE . 30.6 m170 -71.43 -4.95 29.26 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.381 179.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.487 ' HA ' ' HA ' ' A' ' 17' ' ' ALA . 2.0 p -143.73 158.4 43.7 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.982 0.42 . . . . 0.0 111.011 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.505 ' N ' HD11 ' A' ' 100' ' ' ILE . . . 172.26 141.58 3.46 Favored Glycine 0 C--O 1.225 -0.435 0 N-CA-C 110.909 -0.876 . . . . 0.0 110.909 -179.467 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.547 ' HA ' ' HA ' ' A' ' 15' ' ' ILE . . . -84.87 147.06 26.98 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.639 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.589 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -156.14 171.13 20.69 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.202 -179.14 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.681 HD13 ' N ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -101.93 122.98 54.81 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 N-CA-C 111.817 0.302 . . . . 0.0 111.817 -179.556 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.483 ' CE1' ' CD2' ' A' ' 38' ' ' HIS . 5.7 t80 -121.86 108.65 13.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.983 0.421 . . . . 0.0 111.111 178.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.424 ' HB2' ' O ' ' A' ' 9' ' ' PHE . 61.0 mt-10 67.43 48.95 1.07 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.911 179.016 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.7 mttm 73.28 -5.31 1.99 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 179.164 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.469 ' O ' HG23 ' A' ' 8' ' ' ILE . 18.6 t -101.13 148.67 6.9 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.514 0 CA-C-O 121.114 0.483 . . . . 0.0 110.534 179.632 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.435 ' HA ' HD12 ' A' ' 8' ' ' ILE . 0.9 OUTLIER -111.76 112.71 24.59 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.067 179.87 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.885 ' O ' HD13 ' A' ' 15' ' ' ILE . . . -131.57 -132.31 3.35 Favored Glycine 0 N--CA 1.448 -0.553 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.933 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.885 HD13 ' O ' ' A' ' 14' ' ' GLY . 17.8 mm -136.64 136.4 48.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 120.708 0.289 . . . . 0.0 111.345 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.913 HD11 ' CD2' ' A' ' 89' ' ' PHE . 0.3 OUTLIER -100.86 140.95 18.47 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 N-CA-C 106.246 -1.761 . . . . 0.0 106.246 176.56 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.487 ' HA ' ' HA ' ' A' ' 4' ' ' SER . . . -151.6 118.18 5.72 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.565 -0.854 . . . . 0.0 111.695 -178.454 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.536 HD12 ' HB ' ' A' ' 103' ' ' THR . 48.3 mt -84.06 142.94 12.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 114.623 -1.171 . . . . 0.0 112.155 -178.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.615 ' OD1' HG22 ' A' ' 22' ' ' VAL . 2.4 t-20 -118.84 92.52 3.83 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.653 178.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -82.85 0.67 42.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.601 -179.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -82.53 1.57 37.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.76 0.314 . . . . 0.0 111.066 179.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.615 HG22 ' OD1' ' A' ' 19' ' ' ASN . 0.1 OUTLIER -106.05 -163.03 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.825 -179.779 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.413 ' HA ' ' HA ' ' A' ' 24' ' ' PRO . 2.4 t -175.31 102.9 0.26 Allowed Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.32 179.669 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.45 ' CB ' ' CB ' ' A' ' 43' ' ' SER . 9.4 Cg_exo -70.5 161.71 87.76 Favored 'Cis proline' 0 C--N 1.347 0.46 0 C-N-CA 123.614 -1.411 . . . . 0.0 112.678 0.348 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.443 ' HB2' HG21 ' A' ' 107' ' ' ILE . . . -57.4 179.4 0.05 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.403 179.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.517 ' CG ' HG21 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -163.58 135.89 5.13 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.174 179.091 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.829 HD12 ' C ' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -107.92 138.42 44.19 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 178.958 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.8 HG22 ' CG2' ' A' ' 37' ' ' VAL . 1.0 OUTLIER -123.14 112.31 17.57 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -178.263 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.543 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 77.9 t90 -91.97 110.7 22.06 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 178.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.412 ' O ' ' N ' ' A' ' 15' ' ' ILE . 8.4 ptm180 -112.25 132.87 54.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.751 0.31 . . . . 0.0 110.916 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.408 ' HA ' ' HA3' ' A' ' 14' ' ' GLY . 8.4 t -50.02 161.71 0.24 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.692 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 54.6 m -75.38 -37.81 60.36 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.322 0.582 . . . . 0.0 109.759 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -83.4 -16.06 47.36 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.125 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.66 34.34 11.74 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.303 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -85.28 -26.37 26.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.717 0.294 . . . . 0.0 111.398 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.36 162.11 5.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.327 0.584 . . . . 0.0 111.449 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.8 ' CG2' HG22 ' A' ' 28' ' ' THR . 0.9 OUTLIER -145.65 140.45 21.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.811 -178.826 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.483 ' CD2' ' CE1' ' A' ' 9' ' ' PHE . 29.5 m-70 -116.2 120.58 39.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.785 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.483 HG23 HG23 ' A' ' 28' ' ' THR . 0.2 OUTLIER -96.45 135.62 38.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.851 -179.913 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.562 ' CG1' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -122.76 140.74 45.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.349 -179.527 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.445 ' O ' HG12 ' A' ' 45' ' ' ILE . 21.4 t -103.98 95.45 3.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 177.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.674 HD11 ' CD2' ' A' ' 104' ' ' LEU . 0.7 OUTLIER -41.95 -23.76 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.882 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.45 ' CB ' ' CB ' ' A' ' 24' ' ' PRO . 0.6 OUTLIER -76.97 -48.64 17.47 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 179.344 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.433 HG23 ' HB ' ' A' ' 41' ' ' VAL . 33.5 p -64.61 -26.82 68.56 Favored 'General case' 0 N--CA 1.441 -0.875 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 178.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.85 HD12 ' HB3' ' A' ' 62' ' ' LEU . 48.0 mm -56.57 108.66 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.602 178.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.426 ' N ' ' O ' ' A' ' 63' ' ' ILE . 3.7 t0 -53.32 -30.97 41.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.808 0.337 . . . . 0.0 111.011 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.423 ' CG ' ' CG1' ' A' ' 63' ' ' ILE . 5.1 ptpt -172.55 162.99 5.32 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.02 0.438 . . . . 0.0 110.878 179.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.911 HD11 HD13 ' A' ' 104' ' ' LEU . 12.0 tp -109.03 116.47 32.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.619 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.41 ' HB2' ' HB3' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -111.85 146.59 37.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.589 0.233 . . . . 0.0 110.627 -179.972 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.684 ' HB1' ' CD2' ' A' ' 60' ' ' LEU . . . -157.05 148.57 22.28 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.116 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.601 HG23 ' HB2' ' A' ' 59' ' ' MET . 37.2 p -60.46 135.32 91.67 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-O 120.676 0.274 . . . . 0.0 111.117 -179.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.16 163.34 35.18 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.577 2.185 . . . . 0.0 112.317 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -55.53 -30.36 60.57 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.284 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 10.6 t -70.81 -15.89 62.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.262 179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 54.0 p -70.94 122.56 20.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.888 0.375 . . . . 0.0 111.094 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -60.57 -14.68 21.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.466 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.774 ' CE ' HD11 ' B' ' 669' ' ' LEU . 0.1 OUTLIER -120.37 -176.66 3.27 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.875 179.791 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.433 ' HB3' ' HG2' ' A' ' 97' ' ' MET . 2.4 mpp? -134.76 120.52 19.52 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.175 -179.689 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.601 ' HB2' HG23 ' A' ' 51' ' ' THR . 53.7 mtm -149.91 142.35 24.35 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.999 0.428 . . . . 0.0 111.716 -179.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.684 ' CD2' ' HB1' ' A' ' 50' ' ' ALA . 20.6 mt -122.07 143.46 49.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.155 178.834 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.426 ' HG3' ' O ' ' A' ' 87' ' ' HIS . 53.3 ttp180 -143.61 152.71 41.72 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.231 0.456 . . . . 0.0 112.231 -178.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.85 ' HB3' HD12 ' A' ' 45' ' ' ILE . 1.3 mp -127.95 116.24 19.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.637 178.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.585 HG23 ' HG2' ' A' ' 86' ' ' ARG . 23.2 mm -76.54 156.68 5.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.701 0.286 . . . . 0.0 111.38 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.444 ' N ' HG22 ' A' ' 63' ' ' ILE . . . -122.85 129.91 7.65 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.857 -0.687 . . . . 0.0 112.301 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.67 125.55 25.62 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.964 0.411 . . . . 0.0 111.089 -179.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.524 HG22 ' N ' ' A' ' 67' ' ' ASP . 13.5 p -99.18 161.63 3.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.141 -179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.524 ' N ' HG22 ' A' ' 66' ' ' VAL . 0.4 OUTLIER -105.62 66.53 0.74 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.689 179.718 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -64.13 -16.2 61.34 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.416 -179.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 3.2 m -101.03 29.53 4.59 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.767 0.318 . . . . 0.0 110.858 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.9 mmmt -115.21 -63.15 1.5 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.905 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 8.8 mttm 61.63 95.36 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.53 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.42 124.74 47.58 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.129 -179.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 16.1 mmtt -80.12 170.26 16.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.878 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -122.58 -172.16 2.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.879 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -68.01 -21.27 65.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.163 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -100.88 27.64 5.83 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.002 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 56.42 26.48 51.61 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.632 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 19.4 m-20 -93.59 115.16 27.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.815 0.341 . . . . 0.0 110.907 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -76.11 115.15 15.54 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.729 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.42 ' O ' ' HD3' ' A' ' 82' ' ' PRO . 13.8 t -115.46 120.08 63.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.748 -179.571 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.703 ' O ' HG13 ' A' ' 81' ' ' VAL . 11.6 p -101.66 96.76 6.8 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.973 179.052 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.42 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 67.8 Cg_exo -36.26 151.34 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.068 2.512 . . . . 0.0 113.257 -178.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.0 mttp -104.36 169.63 7.01 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.131 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.485 ' HG3' HG11 ' A' ' 66' ' ' VAL . 2.8 Cg_exo -80.04 115.12 3.22 Favored 'Trans proline' 0 N--CA 1.461 -0.408 0 C-N-CA 123.694 2.929 . . . . 0.0 112.259 -178.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -85.37 114.65 22.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.164 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.585 ' HG2' HG23 ' A' ' 63' ' ' ILE . 0.2 OUTLIER -110.33 131.15 55.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.495 179.787 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.492 ' CD2' ' CG2' ' A' ' 40' ' ' VAL . 6.4 m-70 -95.39 111.0 22.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.798 0.332 . . . . 0.0 110.318 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.475 ' HE3' ' CE1' ' B' ' 670' ' ' PHE . 0.7 OUTLIER -101.37 141.79 33.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.357 -179.369 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.913 ' CD2' HD11 ' A' ' 16' ' ' ILE . 5.1 m-85 -140.96 116.93 10.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.063 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.443 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -87.01 115.29 24.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.417 179.566 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.445 ' CE1' ' HB2' ' A' ' 7' ' ' ALA . 8.9 m-85 -89.12 134.67 33.92 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.398 -179.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 22.4 m-20 -98.75 28.87 4.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.467 179.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.429 ' CB ' HG23 ' A' ' 96' ' ' VAL . 7.4 m-20 -175.47 114.32 0.14 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.555 -179.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.49 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.1 OUTLIER -56.52 -17.63 9.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.997 179.767 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -72.3 -50.32 27.9 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 120.887 0.375 . . . . 0.0 110.43 179.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.429 HG23 ' CB ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -65.88 -41.95 91.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.675 179.241 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.49 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -66.74 -37.82 85.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.927 179.317 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.463 ' N ' ' HG3' ' A' ' 97' ' ' MET . 29.2 t70 -62.61 -29.48 70.63 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.858 178.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.434 ' O ' ' OG1' ' A' ' 103' ' ' THR . 9.0 m-80 -81.9 -65.58 0.99 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.363 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.575 HG22 HD11 ' A' ' 104' ' ' LEU . 15.2 mm -46.53 -56.29 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 CA-C-O 121.148 0.499 . . . . 0.0 110.763 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.576 ' HD2' ' HB3' ' A' ' 50' ' ' ALA . 17.5 ttpp -48.07 -42.43 28.66 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.982 179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.492 ' HG2' ' N ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -75.18 -39.4 60.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.332 179.903 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.659 HG21 ' O ' ' A' ' 2' ' ' SER . 0.2 OUTLIER -60.0 -50.73 72.61 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.815 179.785 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.911 HD13 HD11 ' A' ' 48' ' ' LEU . 6.4 mt -53.36 -59.07 5.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.258 179.524 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.415 ' NE2' ' O ' ' A' ' 101' ' ' LYS . 0.7 OUTLIER -60.22 -33.66 72.57 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.654 179.524 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -56.4 -36.48 68.95 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 121.338 0.59 . . . . 0.0 109.44 178.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 1.022 HG22 ' HE1' ' A' ' 111' ' ' TYR . 6.9 mt -85.79 -51.65 13.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.002 178.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.667 ' HA ' ' CE2' ' A' ' 111' ' ' TYR . 0.9 OUTLIER -42.38 -57.41 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.328 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.138 179.187 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 75.4 m -47.09 -26.03 0.99 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.162 179.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.449 ' O ' ' CB ' ' A' ' 114' ' ' ALA . 71.0 mtt-85 -74.26 -25.05 59.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.146 179.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 1.022 ' HE1' HG22 ' A' ' 107' ' ' ILE . 0.1 OUTLIER -75.85 -35.09 60.05 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.875 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.743 ' N ' ' HD2' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -81.18 -43.69 18.96 Favored 'General case' 0 CA--C 1.506 -0.744 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 179.027 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -61.78 -31.33 71.52 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 113.862 -1.517 . . . . 0.0 109.064 178.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.449 ' CB ' ' O ' ' A' ' 110' ' ' ARG . . . -92.69 -19.01 22.26 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.64 178.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 39.1 t70 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.245 -0.883 . . . . 0.0 111.006 179.987 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 661' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.859 0.361 . . . . 0.0 111.25 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 662' ' ' LEU . . . . . 0.814 HD12 ' HB2' ' B' ' 663' ' ' GLU . 3.2 pp -91.98 -29.46 16.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.91 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 663' ' ' GLU . . . . . 0.814 ' HB2' HD12 ' B' ' 662' ' ' LEU . 3.5 mm-40 -175.21 38.65 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.864 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 664' ' ' VAL . . . . . 0.539 HG13 ' O ' ' B' ' 663' ' ' GLU . 5.7 m -159.34 87.51 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.045 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 665' ' ' LEU . . . . . 0.576 ' C ' HD12 ' B' ' 665' ' ' LEU . 4.2 pp -139.12 -166.62 2.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.873 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 666' ' ' SER . . . . . 0.529 ' N ' HD12 ' B' ' 665' ' ' LEU . 1.5 m -138.87 79.56 1.74 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.458 179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 667' ' ' GLU . . . . . . . . . . . . . 18.2 pt-20 -89.24 19.16 4.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.903 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 668' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -93.71 7.09 46.14 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.716 -0.674 . . . . 0.0 111.085 179.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.774 HD11 ' CE ' ' A' ' 57' ' ' LYS . 0.6 OUTLIER -120.34 19.97 12.01 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.136 179.926 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 670' ' ' PHE . . . . . 0.475 ' CE1' ' HE3' ' A' ' 88' ' ' MET . 1.7 m-85 -57.03 123.75 16.3 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.89 0.376 . . . . 0.0 111.091 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 671' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -111.65 171.06 7.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.74 179.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 22.4 p-10 -106.55 109.24 21.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.978 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 673' ' ' VAL . . . . . 0.869 HG21 HD23 ' A' ' 48' ' ' LEU . 27.7 m -58.13 153.76 33.9 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.936 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 674' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -68.62 137.83 40.06 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.615 2.21 . . . . 0.0 112.502 -179.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 675' ' ' THR . . . . . 0.558 HG21 HG21 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -129.56 116.88 19.56 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.713 179.875 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 676' ' ' LYS . . . . . . . . . . . . . 4.8 mttt 179.89 166.04 1.2 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.748 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 677' ' ' SER . . . . . . . . . . . . . 2.3 t -135.99 88.61 2.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.91 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 678' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -134.01 80.33 1.86 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.891 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 679' ' ' ILE . . . . . . . . . . . . . 8.6 tp -75.16 -20.52 16.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.355 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 680' ' ' SER . . . . . . . . . . . . . 40.0 t . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.936 179.95 . . . . . . . . 0 0 . 1 stop_ save_