data_2k0b_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 2k0b _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 ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.444 0 CA-C-O 121.186 0.517 . . . . 0.0 109.78 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -74.85 148.84 85.19 Favored Pre-proline 0 C--N 1.319 -0.749 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 174.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . 0.447 ' O ' ' HB2' ' X' ' 12' ' ' GLU . 86.9 Cg_exo -46.85 -24.18 2.94 Favored 'Trans proline' 0 CA--C 1.535 0.563 0 C-N-CA 122.158 1.905 . . . . 0.0 112.555 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 27.3 mmm180 -93.38 -23.49 18.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.881 -0.6 . . . . 0.0 112.512 179.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 43.5 mt -98.37 -28.3 13.71 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.633 0.254 . . . . 0.0 110.883 -176.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.583 ' O ' ' HB3' ' X' ' 15' ' ' SER . 11.2 tp -75.82 -17.39 15.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 171.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' X' ' 8' ' ' PRO . 0.3 OUTLIER -91.12 -53.7 4.26 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.894 175.643 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 4.3 m -95.31 -26.19 16.02 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -170.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -94.86 -41.94 8.95 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.583 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 23.2 t -67.2 -25.72 66.27 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.984 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . 0.426 ' OE1' HG21 ' X' ' 40' ' ' ILE . 4.2 tm0? -63.66 -54.88 28.84 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 121.174 0.511 . . . . 0.0 110.308 176.055 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.69 ' SD ' HD12 ' X' ' 29' ' ' LEU . 14.2 ptp -71.69 -33.62 68.96 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.459 -177.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 28.1 tp -67.61 -36.46 80.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.881 0.372 . . . . 0.0 110.81 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 20.7 t -79.75 -38.24 33.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.243 -178.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 42.2 tpp -75.75 -31.52 59.59 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.617 0.228 . . . . 0.0 111.617 -175.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.88 47.27 0.62 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.145 -1.026 . . . . 0.0 112.754 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.619 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 50.4 m-85 -119.41 169.15 10.27 Favored 'General case' 0 CA--C 1.509 -0.603 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 175.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 42.0 m -151.31 -148.71 0.27 Allowed 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.113 -0.635 . . . . 0.0 110.369 -179.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.531 ' OD1' HD22 ' X' ' 29' ' ' LEU . 2.3 m-20 -92.46 115.81 28.43 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 174.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . 0.585 ' HG3' ' HA ' ' X' ' 47' ' ' ILE . 48.0 mm-40 -82.9 43.26 0.84 Allowed 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.715 177.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 143.05 -14.33 2.36 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.581 -178.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.58 7.38 36.92 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.834 -0.698 . . . . 0.0 111.902 -178.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.538 ' CE3' ' HA ' ' X' ' 29' ' ' LEU . 55.9 p-90 -86.51 -13.85 44.78 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 119.046 -0.502 . . . . 0.0 111.3 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.69 HD12 ' SD ' ' X' ' 17' ' ' MET . 36.9 tp -48.21 -51.0 27.21 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -167.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 25.5 p -65.43 -47.83 74.86 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.739 0.304 . . . . 0.0 111.019 177.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . 0.501 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 10.0 mtm180 -54.97 -52.48 62.92 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.903 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.441 ' HB2' ' HE3' ' X' ' 28' ' ' TRP . 2.6 tm? -55.94 -55.25 34.9 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 123.034 0.533 . . . . 0.0 110.808 178.129 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.47 HD13 ' HG ' ' X' ' 29' ' ' LEU . 84.2 mt -56.91 -65.17 0.66 Allowed 'General case' 0 C--O 1.225 -0.214 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.195 -176.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -54.76 -38.7 67.54 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -172.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 42.8 p -71.88 -13.24 61.61 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -177.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -120.15 38.91 3.83 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.7 -0.227 . . . . 0.0 110.537 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 43.54 46.83 6.07 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.916 0.887 . . . . 0.0 112.029 -175.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 63.18 76.62 0.36 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.247 178.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -111.88 123.63 50.66 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.299 -174.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.53 ' HB ' HD11 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.87 -8.76 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.454 174.2 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.46 -44.04 95.81 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.53 -0.843 . . . . 0.0 112.338 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -93.47 -18.91 21.77 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.698 0.285 . . . . 0.0 110.865 178.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.584 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -71.05 -51.05 27.51 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.487 177.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.791 HD12 HD11 ' X' ' 47' ' ' ILE . 10.3 mp -62.45 -28.9 70.13 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.509 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . 0.503 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 17.0 t70 -51.59 -44.77 62.93 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.474 0.484 . . . . 0.0 111.691 178.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 2.0 p -96.48 -23.68 16.45 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -177.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.791 HD11 HD12 ' X' ' 44' ' ' LEU . 25.3 pt -81.94 45.44 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 N-CA-C 112.935 0.716 . . . . 0.0 112.935 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . 0.469 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 3.0 mt-30 88.33 15.63 0.07 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.05 0.94 . . . . 0.0 113.342 173.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . 0.503 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 32.9 m-85 . . . . . 0 C--N 1.328 -0.365 0 O-C-N 121.985 -0.447 . . . . 0.0 110.219 171.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.439 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . 0.768 ' OD2' ' HD3' ' X' ' 9' ' ' ARG . 29.5 t70 -81.7 145.82 55.2 Favored Pre-proline 0 C--N 1.321 -0.672 0 CA-C-N 114.138 -1.392 . . . . 0.0 108.18 178.502 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . 0.564 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 92.9 Cg_exo -42.64 -26.0 0.57 Allowed 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 123.004 2.469 . . . . 0.0 113.879 -177.355 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . 0.768 ' HD3' ' OD2' ' X' ' 7' ' ' ASP . 3.6 mpp_? -92.89 -38.61 11.63 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.402 HD23 ' HB2' ' X' ' 14' ' ' LEU . 87.9 mt -97.03 -15.57 20.98 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 -172.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.454 ' O ' ' HB3' ' X' ' 15' ' ' SER . 15.2 tt -72.48 -19.59 19.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 172.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -94.44 -51.03 4.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.317 174.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 13' ' ' SER . . . . . 0.41 ' O ' ' HG2' ' X' ' 17' ' ' MET . 34.5 m -94.73 -29.63 14.69 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -169.005 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.647 HD22 HD22 ' X' ' 18' ' ' LEU . 10.0 tt -94.24 -40.62 9.9 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.454 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 5.6 t -67.53 -26.1 66.16 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.708 -179.03 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . 0.421 ' HA ' ' OG ' ' X' ' 19' ' ' SER . 1.1 pp0? -73.64 -28.48 61.8 Favored 'General case' 0 C--O 1.224 -0.263 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 175.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.566 ' HG3' HD12 ' X' ' 29' ' ' LEU . 91.0 mmm -65.46 -42.29 92.48 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 174.232 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . 0.647 HD22 HD22 ' X' ' 14' ' ' LEU . 4.4 mm? -67.38 -34.64 77.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.067 179.005 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 19' ' ' SER . . . . . 0.421 ' OG ' ' HA ' ' X' ' 16' ' ' GLN . 5.1 p -84.83 -34.79 22.62 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -175.595 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 20' ' ' MET . . . . . 0.507 ' HA ' ' HE3' ' X' ' 20' ' ' MET . 21.2 mmt -78.44 -15.2 58.9 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 121.141 -0.224 . . . . 0.0 111.486 -178.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 98.68 44.57 2.45 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.499 178.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -125.6 -177.78 4.02 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 176.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 42.5 m -156.96 -134.86 0.04 OUTLIER 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 175.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.57 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 2.8 p30 -122.15 131.43 53.95 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 169.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -97.61 55.11 1.21 Allowed 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.099 -0.64 . . . . 0.0 109.868 178.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 144.31 -0.22 1.08 Allowed Glycine 0 CA--C 1.518 0.227 0 C-N-CA 120.279 -0.963 . . . . 0.0 113.632 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.0 11.22 63.58 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.004 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.702 ' CZ2' HG21 ' X' ' 47' ' ' ILE . 42.0 p-90 -87.21 -5.62 58.89 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -176.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.57 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 53.7 tp -59.83 -26.59 65.92 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 122.075 -0.39 . . . . 0.0 111.35 -175.083 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 80.5 p -93.73 -11.47 31.37 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.816 0.341 . . . . 0.0 111.082 175.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . 0.487 ' CG ' ' HA ' ' X' ' 28' ' ' TRP . 13.3 mmm180 -94.99 -61.98 1.39 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.25 0.548 . . . . 0.0 110.746 -178.458 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.473 ' C ' HD11 ' X' ' 32' ' ' LEU . 2.9 tm? -47.16 -72.37 0.05 Allowed 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 114.345 -1.298 . . . . 0.0 111.408 -177.136 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.503 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.3 mp -53.79 -50.0 67.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.579 -175.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.22 -34.06 14.01 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -176.154 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 2.7 m -99.05 -2.86 36.11 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 111.732 0.271 . . . . 0.0 111.732 -174.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -123.86 37.75 4.34 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -177.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 47.8 t30 69.48 26.33 5.18 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.38 0.61 . . . . 0.0 110.73 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.503 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 29.4 m-85 54.54 64.9 1.66 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.268 178.254 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . 0.424 ' O ' ' HG ' ' X' ' 33' ' ' LEU . 33.7 p-10 -103.79 133.8 48.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.013 -0.994 . . . . 0.0 112.551 -173.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.487 ' O ' HD11 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -91.45 -3.92 10.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.95 170.285 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.96 -36.32 81.18 Favored Glycine 0 N--CA 1.444 -0.807 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.736 177.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -96.88 -17.66 20.02 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.304 -0.448 . . . . 0.0 110.783 176.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.475 ' O ' HG13 ' X' ' 47' ' ' ILE . . . -68.44 -45.99 71.05 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.217 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.532 ' O ' HD11 ' X' ' 47' ' ' ILE . 10.2 mp -63.41 -34.01 76.8 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.788 0.328 . . . . 0.0 110.754 178.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -58.85 -38.31 78.44 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.743 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 9.6 p -96.48 -5.93 38.38 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -172.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.702 HG21 ' CZ2' ' X' ' 28' ' ' TRP . 1.4 pp -98.81 -27.07 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 CA-C-N 119.565 1.075 . . . . 0.0 112.502 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . 0.509 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.6 mp0 -159.8 -35.92 0.06 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.784 0.326 . . . . 0.0 110.949 -179.11 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.426 -177.011 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.48 0 CA-C-O 121.881 0.848 . . . . 0.0 109.837 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -89.68 150.08 43.44 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 172.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -46.36 -25.27 3.12 Favored 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 122.339 2.026 . . . . 0.0 113.05 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 66.0 mtt85 -87.59 -38.59 15.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.661 178.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.554 HD22 ' HD2' ' X' ' 38' ' ' TYR . 98.0 mt -81.95 -26.61 33.85 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.498 -176.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.542 ' O ' HD13 ' X' ' 11' ' ' ILE . 0.3 OUTLIER -69.48 -20.18 23.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 174.188 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -88.34 -63.99 1.21 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.186 -0.915 . . . . 0.0 111.668 173.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 11.5 m -89.67 -26.7 20.57 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -167.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.528 ' HG ' HD12 ' X' ' 29' ' ' LEU . 7.8 tt -93.4 -42.74 9.12 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.496 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 15.3 t -67.12 -31.13 71.39 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.789 -175.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . 0.442 ' NE2' HG21 ' X' ' 40' ' ' ILE . 4.7 pp0? -65.91 -33.35 75.63 Favored 'General case' 0 C--O 1.227 -0.103 0 C-N-CA 120.501 -0.48 . . . . 0.0 111.022 -179.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.772 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 14.7 ptm -89.03 -30.31 18.81 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.046 177.597 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 53.3 tp -59.71 -41.5 90.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.935 0.398 . . . . 0.0 110.665 177.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 14.6 m -87.69 -40.1 14.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.228 -175.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 20' ' ' MET . . . . . 0.462 ' HB3' ' HE1' ' X' ' 20' ' ' MET . 86.3 mmm -72.28 -27.18 62.31 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -175.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.25 46.87 0.62 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 119.901 -1.142 . . . . 0.0 113.172 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.772 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 39.7 m-85 -122.69 160.24 26.27 Favored 'General case' 0 CA--C 1.511 -0.552 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 171.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 5.0 m -147.87 178.11 8.77 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.095 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.589 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.3 p30 -85.07 130.03 34.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.201 0.524 . . . . 0.0 110.082 173.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . 0.673 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 51.7 tp10 -69.67 -25.08 63.72 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.212 -176.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -145.66 15.25 1.8 Allowed Glycine 0 C--O 1.228 -0.238 0 C-N-CA 120.336 -0.935 . . . . 0.0 113.597 -178.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . 0.416 ' O ' ' HD3' ' X' ' 31' ' ' ARG . . . 90.91 22.89 31.72 Favored Glycine 0 CA--C 1.509 -0.337 0 C-N-CA 120.468 -0.872 . . . . 0.0 111.92 179.616 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.673 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 38.8 p-90 -96.12 -5.0 41.75 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -176.343 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.589 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 3.2 tp -51.37 -38.73 54.81 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -170.226 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 30' ' ' THR . . . . . 0.764 ' O ' ' HG3' ' X' ' 34' ' ' GLN . 70.5 p -79.72 -46.2 17.5 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 119.928 -0.709 . . . . 0.0 110.195 173.185 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . 0.618 ' HD2' ' H ' ' X' ' 31' ' ' ARG . 1.4 mpt_? -53.34 -66.19 0.43 Allowed 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.422 0.689 . . . . 0.0 112.398 -179.065 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.605 HD21 ' HE2' ' X' ' 36' ' ' LYS . 3.5 tm? -50.91 -60.5 3.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.437 -177.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.507 HD11 ' O ' ' X' ' 29' ' ' LEU . 11.0 mp -52.51 -47.8 66.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.405 -175.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . 0.764 ' HG3' ' O ' ' X' ' 30' ' ' THR . 33.2 mt-30 -64.88 -26.07 68.16 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -173.325 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 70.4 p -74.02 -16.68 61.05 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.315 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . 0.605 ' HE2' HD21 ' X' ' 32' ' ' LEU . 2.8 mptp? -121.33 37.08 4.43 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 121.266 -0.173 . . . . 0.0 111.462 177.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 37.9 t30 66.25 52.72 1.1 Allowed 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.161 0.505 . . . . 0.0 111.357 177.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.554 ' HD2' HD22 ' X' ' 10' ' ' LEU . 1.2 m-85 44.71 58.61 3.82 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.131 177.164 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . 0.482 ' O ' ' HG ' ' X' ' 33' ' ' LEU . 24.9 p-10 -111.15 151.49 28.1 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 119.167 -1.013 . . . . 0.0 113.523 -172.141 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.442 HG21 ' NE2' ' X' ' 16' ' ' GLN . 0.0 OUTLIER -90.66 -2.88 10.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 114.11 -1.405 . . . . 0.0 110.119 172.245 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.31 -37.06 85.89 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.851 -0.69 . . . . 0.0 111.797 -178.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.21 -21.0 17.54 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.251 -0.474 . . . . 0.0 110.532 175.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.62 -47.26 82.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.303 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . . . . . . . . . 1.1 tp -62.68 -26.35 68.61 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.355 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -67.28 -45.64 76.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.057 -179.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 27.5 p -97.31 -20.7 17.68 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -170.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.484 HG23 ' HE2' ' X' ' 17' ' ' MET . 4.6 pt -64.58 -30.37 50.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 118.959 0.799 . . . . 0.0 112.586 -171.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -166.42 -41.56 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.201 0.524 . . . . 0.0 109.923 177.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 . . . . . 0 C--N 1.326 -0.416 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.007 -175.227 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.415 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.01 154.22 41.76 Favored Pre-proline 0 C--O 1.218 -0.59 0 CA-C-N 114.785 -1.098 . . . . 0.0 108.322 174.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . 0.459 ' HA ' HG22 ' X' ' 11' ' ' ILE . 57.4 Cg_exo -45.7 -22.46 1.19 Allowed 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 123.305 2.67 . . . . 0.0 114.55 -174.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -83.99 -42.17 16.5 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 122.055 -0.403 . . . . 0.0 112.045 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.424 HD23 ' CE1' ' X' ' 38' ' ' TYR . 67.9 mt -99.25 -19.45 17.09 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -175.578 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.591 ' O ' ' HB3' ' X' ' 15' ' ' SER . 0.1 OUTLIER -69.4 -22.73 25.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 175.653 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -93.78 -37.58 11.71 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.765 176.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 13' ' ' SER . . . . . 0.521 ' HB3' HD21 ' X' ' 33' ' ' LEU . 7.4 m -95.83 -40.72 9.19 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -171.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.428 HD13 ' C ' ' X' ' 14' ' ' LEU . 3.3 tm? -94.58 -48.41 6.11 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -178.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.591 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 22.9 t -64.49 -27.11 68.75 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.053 -176.344 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . 0.425 HE21 ' HB3' ' X' ' 16' ' ' GLN . 0.0 OUTLIER -62.56 -46.65 87.38 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.206 0.527 . . . . 0.0 109.812 174.801 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.429 ' HE1' HG21 ' X' ' 47' ' ' ILE . 77.2 mtp -71.36 -43.62 66.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.723 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 29.1 tp -62.58 -32.48 73.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.953 -176.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 8.0 t -96.33 -11.04 26.41 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.749 0.278 . . . . 0.0 111.749 -175.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 14.0 tpt -102.0 -31.71 10.53 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.777 -0.369 . . . . 0.0 111.372 -178.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.28 44.91 0.7 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.547 -0.835 . . . . 0.0 111.607 -177.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -128.99 146.58 50.94 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 177.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 14.9 m -146.22 -164.03 1.88 Allowed 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.899 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 9.1 p-10 -76.33 116.68 17.25 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 172.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 58.9 tt0 -100.96 65.17 1.09 Allowed 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 177.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 140.64 -6.07 2.64 Favored Glycine 0 N--CA 1.449 -0.478 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.268 -174.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.79 16.75 55.96 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 121.089 -0.577 . . . . 0.0 112.124 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.548 ' CZ2' HG22 ' X' ' 47' ' ' ILE . 58.6 p-90 -93.32 -13.33 28.28 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -174.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.899 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 3.7 tp -57.01 -33.62 67.35 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.648 -0.658 . . . . 0.0 112.135 -170.35 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 30' ' ' THR . . . . . 0.482 ' O ' ' HG2' ' X' ' 34' ' ' GLN . 10.4 p -87.89 -10.41 50.77 Favored 'General case' 0 C--O 1.218 -0.599 0 C-N-CA 120.185 -0.606 . . . . 0.0 111.034 175.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . 0.524 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 20.0 mtp180 -95.6 -56.4 2.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.337 0.589 . . . . 0.0 110.868 -178.328 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.408 ' HA ' HD23 ' X' ' 32' ' ' LEU . 2.8 tm? -50.46 -53.31 30.69 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.948 -177.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.701 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 9.6 mp -68.31 -47.08 68.53 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -170.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' X' ' 30' ' ' THR . 3.5 mm100 -37.98 -71.27 0.08 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 -172.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 33.3 p -60.81 -29.91 69.75 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.802 0.334 . . . . 0.0 111.84 -173.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -88.01 37.07 0.79 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.409 177.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 15.2 p30 46.37 34.32 2.23 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.352 1.061 . . . . 0.0 112.56 179.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.701 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 31.9 m-85 68.57 73.9 0.27 Allowed 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.869 -176.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . 0.449 ' O ' ' HB3' ' X' ' 43' ' ' ALA . 35.2 t0 -100.47 125.5 46.78 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.975 -175.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.709 ' O ' HD11 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.95 -13.79 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.625 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.662 169.856 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.63 -37.93 95.58 Favored Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.564 -0.827 . . . . 0.0 112.352 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.08 -18.75 19.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.436 -0.382 . . . . 0.0 111.065 176.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.569 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -70.47 -36.36 73.84 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.498 178.46 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.872 HD12 HD11 ' X' ' 47' ' ' ILE . 7.1 mp -60.7 -36.88 79.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.188 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . 0.534 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.1 t70 -51.93 -41.72 62.25 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 123.48 0.487 . . . . 0.0 111.354 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 5.1 p -96.23 -5.81 39.53 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -177.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.872 HD11 HD12 ' X' ' 44' ' ' LEU . 14.1 pt -101.95 44.33 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 CA-C-N 118.164 0.438 . . . . 0.0 111.63 174.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 79.04 27.1 0.43 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.94 0.896 . . . . 0.0 112.367 174.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . 0.534 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 62.3 m-85 . . . . . 0 C--N 1.326 -0.431 0 CA-C-O 120.882 0.372 . . . . 0.0 110.173 173.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . 0.561 ' HA ' HG23 ' X' ' 11' ' ' ILE . . . . . . . . 0 CA--C 1.515 -0.372 0 CA-C-O 121.554 0.692 . . . . 0.0 109.935 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . 0.484 ' O ' HG12 ' X' ' 11' ' ' ILE . 7.6 t70 -93.94 147.96 34.41 Favored Pre-proline 0 C--N 1.314 -0.974 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 175.133 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . 0.406 ' HD2' ' CG ' ' X' ' 7' ' ' ASP . 85.0 Cg_exo -44.18 -30.32 3.41 Favored 'Trans proline' 0 CA--C 1.532 0.421 0 C-N-CA 122.903 2.402 . . . . 0.0 112.709 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . 0.457 ' HB3' ' HD2' ' X' ' 38' ' ' TYR . 80.3 mtm-85 -84.15 -29.49 26.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.514 178.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 88.1 mt -97.88 -20.71 17.32 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -174.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.561 HG23 ' HA ' ' X' ' 6' ' ' ALA . 10.7 pt -73.64 -13.41 16.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 168.535 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -95.21 -53.13 3.9 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.629 174.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 23.7 t -93.29 -32.22 14.4 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -169.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . . . . . . . . . 8.3 tt -93.28 -40.33 10.48 Favored 'General case' 0 CA--C 1.51 -0.592 0 O-C-N 121.395 -0.816 . . . . 0.0 109.002 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.456 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 10.5 t -70.03 -23.1 63.06 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.494 -176.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 4.4 pp0? -65.3 -26.78 68.21 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.249 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.668 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 15.9 ptm -99.14 -24.74 14.77 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 121.033 -0.267 . . . . 0.0 110.504 175.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 35.7 tp -62.22 -40.73 97.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.752 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 40.3 p -91.4 -25.81 19.18 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.487 -178.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 44.5 ttm -73.89 -31.26 63.04 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.499 -0.318 . . . . 0.0 111.148 -176.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 104.54 47.12 1.23 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.081 -1.057 . . . . 0.0 112.685 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.668 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 13.9 m-30 -114.27 175.92 5.27 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 175.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 23' ' ' SER . . . . . 0.502 ' O ' HG22 ' X' ' 47' ' ' ILE . 12.3 m -145.9 158.64 43.85 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 119.812 -0.755 . . . . 0.0 111.407 -178.174 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -68.68 133.74 48.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.464 173.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . 0.754 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 2.3 tm-20 -91.28 -16.95 26.74 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -175.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -170.25 21.1 0.08 OUTLIER Glycine 0 CA--C 1.519 0.32 0 C-N-CA 119.221 -1.466 . . . . 0.0 114.49 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 87.19 24.0 38.77 Favored Glycine 0 C--N 1.32 -0.311 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.402 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.754 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 59.1 p-90 -96.86 -14.65 21.69 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 119.157 -0.449 . . . . 0.0 112.179 -178.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.568 HD11 ' SD ' ' X' ' 17' ' ' MET . 26.0 tp -52.33 -24.31 7.34 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -169.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 21.8 p -88.65 -61.59 1.68 Allowed 'General case' 0 C--N 1.32 -0.683 0 O-C-N 121.826 -0.546 . . . . 0.0 110.469 169.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . 0.703 ' HG2' ' HA ' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -49.37 -56.74 8.56 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -177.482 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.591 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 2.5 tm? -54.12 -46.46 72.19 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 122.642 0.377 . . . . 0.0 110.842 -178.243 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.584 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 11.2 mp -70.04 -51.38 32.55 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.454 -178.259 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -44.37 -56.22 4.38 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -176.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 61.9 p -75.92 -2.7 31.55 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -175.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 53.7 mttp -120.59 28.27 8.07 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 40.7 t30 64.02 30.86 13.92 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.737 0.779 . . . . 0.0 110.262 178.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.584 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 8.6 m-30 59.43 63.55 1.53 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.874 -174.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . 0.56 ' O ' ' HB2' ' X' ' 43' ' ' ALA . 32.2 t70 -95.86 124.83 40.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.871 -173.153 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.578 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.44 -6.25 10.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.396 171.769 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.29 -40.81 99.5 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.442 -0.885 . . . . 0.0 111.982 177.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.5 -20.98 16.14 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.173 -0.514 . . . . 0.0 110.906 176.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.567 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -66.88 -39.15 87.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.646 178.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.909 HD11 HD13 ' X' ' 47' ' ' ILE . 5.7 mp -57.85 -37.02 73.13 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.149 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -49.78 -46.34 50.68 Favored 'General case' 0 CA--C 1.532 0.269 0 O-C-N 123.696 0.623 . . . . 0.0 111.499 178.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -88.21 -21.69 24.41 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -177.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.909 HD13 HD11 ' X' ' 44' ' ' LEU . 8.1 pt -88.05 43.3 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 O-C-N 121.757 -0.589 . . . . 0.0 111.639 174.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . 0.453 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 1.5 mp0 85.88 38.13 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.526 1.13 . . . . 0.0 112.982 174.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . 0.563 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 26.6 m-85 . . . . . 0 C--N 1.328 -0.335 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 170.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.3 0 CA-C-O 121.084 0.469 . . . . 0.0 110.252 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . 0.401 ' O ' HG23 ' X' ' 11' ' ' ILE . 8.3 m-20 -77.75 154.78 80.93 Favored Pre-proline 0 C--O 1.216 -0.669 0 CA-C-N 115.448 -0.797 . . . . 0.0 109.298 176.158 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -46.04 -26.2 3.39 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 122.911 2.407 . . . . 0.0 112.675 177.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 56.0 mtm-85 -92.02 -33.96 14.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.188 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 93.7 mt -98.4 -19.52 17.68 Favored 'General case' 0 C--O 1.219 -0.519 0 O-C-N 122.223 -0.298 . . . . 0.0 111.578 -173.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.558 ' O ' ' HB3' ' X' ' 15' ' ' SER . 10.6 tt -74.08 -15.36 16.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 169.477 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . 0.508 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 4.7 tm-20 -94.77 -60.74 1.63 Allowed 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 114.754 -1.112 . . . . 0.0 110.277 175.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 36.7 m -89.77 -26.43 20.6 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -170.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . . . . . . . . . 7.5 tt -92.88 -40.41 10.63 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.558 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 28.1 t -70.18 -17.09 63.15 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.908 178.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . 0.508 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 0.0 OUTLIER -55.24 -50.73 68.71 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.509 178.383 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.984 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 0.5 OUTLIER -91.18 -23.66 20.17 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.012 179.405 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . 0.499 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 24.2 tp -63.49 -40.95 98.43 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.798 0.332 . . . . 0.0 110.805 -178.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 12.2 t -99.55 9.38 43.3 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.211 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 20' ' ' MET . . . . . 0.457 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 55.1 tpp -104.5 -31.2 9.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.836 0.351 . . . . 0.0 110.874 -179.31 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 108.9 45.75 1.01 Allowed Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.313 -0.946 . . . . 0.0 111.831 -177.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.984 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 46.0 m-85 -125.79 178.78 5.51 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 175.162 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 44.8 m -161.39 160.23 29.22 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 176.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.632 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 50.2 p-10 -78.39 160.52 27.73 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.374 -0.53 . . . . 0.0 109.89 172.157 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . 0.739 ' HG2' ' CD1' ' X' ' 28' ' ' TRP . 18.1 pt-20 -64.05 -20.39 65.9 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.407 178.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 144.24 42.56 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.217 -0.992 . . . . 0.0 114.324 174.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 154.95 -16.85 0.54 Allowed Glycine 0 C--N 1.333 0.403 0 C-N-CA 118.39 -1.862 . . . . 0.0 115.389 171.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.739 ' CD1' ' HG2' ' X' ' 25' ' ' GLU . 43.2 p-90 -87.03 -20.03 27.78 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 118.459 1.13 . . . . 0.0 113.033 -173.807 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.632 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 42.3 tp -55.79 -21.32 18.7 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.15 0.886 . . . . 0.0 111.401 -176.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.88 -31.67 17.22 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 175.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . 0.664 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -95.15 -52.05 4.37 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 -178.678 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.551 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 3.2 tm? -49.83 -51.56 39.05 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.49 0.716 . . . . 0.0 111.535 -177.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.706 ' O ' ' HA ' ' X' ' 38' ' ' TYR . 8.0 mp -71.99 -9.03 57.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.751 -177.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.7 -38.5 10.78 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.714 0.293 . . . . 0.0 110.775 -179.134 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 9.3 p -75.21 -39.49 60.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.44 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -78.3 37.92 0.28 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.956 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 41.9 45.92 3.34 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.851 0.86 . . . . 0.0 112.151 -177.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.706 ' HA ' ' O ' ' X' ' 33' ' ' LEU . 67.7 m-85 59.78 77.86 0.3 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.312 177.227 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -134.84 138.69 44.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.931 -175.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.603 ' O ' HD11 ' X' ' 44' ' ' LEU . 0.1 OUTLIER -90.14 -9.72 10.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.919 169.294 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.57 -34.41 89.44 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.203 178.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.01 -15.29 19.12 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.334 -0.433 . . . . 0.0 110.612 176.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.513 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -76.56 -35.84 57.97 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.163 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.603 HD11 ' O ' ' X' ' 40' ' ' ILE . 9.5 mp -69.7 -32.65 71.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.275 177.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -60.92 -31.85 71.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.157 177.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 21.8 p -98.01 -33.91 11.0 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -174.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.559 HG21 ' CH2' ' X' ' 28' ' ' TRP . 1.8 pt -65.71 -35.04 74.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 C-N-CA 119.337 -0.945 . . . . 0.0 112.837 -169.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . 0.431 ' OE1' ' HD1' ' X' ' 22' ' ' PHE . 1.0 OUTLIER -166.89 -34.95 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 120.735 0.302 . . . . 0.0 110.382 179.075 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . 0.511 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 52.7 m-85 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.978 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.324 0 CA-C-O 121.722 0.772 . . . . 0.0 109.149 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . 0.419 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 32.3 t70 -93.85 144.53 28.28 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 114.86 -1.064 . . . . 0.0 108.34 178.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . 0.419 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 93.0 Cg_exo -42.36 -23.66 0.3 Allowed 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.362 2.708 . . . . 0.0 114.054 -178.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . 0.458 ' HD3' ' CE2' ' X' ' 38' ' ' TYR . 60.1 mtt85 -87.73 -46.07 9.8 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.772 HD22 ' HB2' ' X' ' 14' ' ' LEU . 74.3 mt -99.41 -11.89 20.73 Favored 'General case' 0 C--O 1.219 -0.504 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -175.463 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.646 ' O ' ' HB3' ' X' ' 15' ' ' SER . 11.2 tt -69.25 -25.65 29.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 121.552 0.691 . . . . 0.0 109.202 176.087 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -96.61 -38.11 10.09 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.661 176.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 32.5 m -96.01 -33.0 12.3 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -172.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.772 ' HB2' HD22 ' X' ' 10' ' ' LEU . 10.1 tt -95.33 -49.0 5.65 Favored 'General case' 0 CA--C 1.508 -0.657 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.646 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 37.2 t -61.42 -31.4 71.33 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 114.426 -1.261 . . . . 0.0 111.403 -177.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -53.47 -55.0 29.04 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.871 0.367 . . . . 0.0 110.22 176.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.727 ' HB3' ' HB2' ' X' ' 22' ' ' PHE . 68.8 mtm -69.23 -39.91 78.24 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.493 -178.419 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . 0.48 HD22 ' O ' ' X' ' 14' ' ' LEU . 4.3 mm? -64.91 -32.5 74.23 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -177.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 20.7 p -86.13 -37.35 18.87 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.852 0.315 . . . . 0.0 111.852 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 13.4 tpt -69.99 -24.95 63.39 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.362 -176.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.9 34.54 1.5 Allowed Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.434 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.727 ' HB2' ' HB3' ' X' ' 17' ' ' MET . 5.6 m-85 -110.58 -176.13 2.9 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 173.056 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 15.3 m -152.47 -149.28 0.29 Allowed 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.392 178.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.424 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 12.2 p-10 -122.88 131.78 53.89 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 170.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -115.69 68.05 0.71 Allowed 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.097 -0.641 . . . . 0.0 111.012 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 136.9 5.51 1.89 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.378 -0.915 . . . . 0.0 113.136 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 79.38 7.63 88.34 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.173 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.53 ' HB2' ' HB2' ' X' ' 32' ' ' LEU . 46.0 p-90 -79.65 -10.1 59.74 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 111.556 0.206 . . . . 0.0 111.556 -178.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.616 HD12 ' HG ' ' X' ' 14' ' ' LEU . 14.5 tp -55.97 -24.65 39.76 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 122.015 -0.428 . . . . 0.0 111.283 -174.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 30' ' ' THR . . . . . 0.633 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 20.5 p -94.41 -47.47 6.57 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 122.072 -0.393 . . . . 0.0 110.706 169.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 15.6 mmm180 -55.65 -59.78 4.37 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.303 0.641 . . . . 0.0 112.012 -178.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.53 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 2.8 tm? -55.97 -60.53 3.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.934 -1.03 . . . . 0.0 111.128 -176.118 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.432 HD13 ' O ' ' X' ' 29' ' ' LEU . 9.8 mp -57.32 -45.61 84.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.387 -176.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . 0.633 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.3 OUTLIER -49.82 -48.43 50.86 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 123.217 0.323 . . . . 0.0 111.436 179.685 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 14.1 m -67.15 -46.21 74.74 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.171 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -81.74 37.14 0.46 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.682 -179.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 5.5 p-10 40.33 49.92 2.6 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.806 0.842 . . . . 0.0 112.387 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.458 ' CE2' ' HD3' ' X' ' 9' ' ' ARG . 79.2 m-85 61.72 67.93 0.73 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.143 177.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -120.6 137.94 54.15 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.82 -177.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.606 ' O ' HD11 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.9 -9.8 10.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.432 171.826 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -60.78 -38.43 95.23 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.587 -178.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . 0.454 ' HB2' HD13 ' X' ' 32' ' ' LEU . . . -99.51 -15.4 18.68 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.486 -0.357 . . . . 0.0 110.594 175.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.461 ' CB ' ' HA ' ' X' ' 40' ' ' ILE . . . -68.41 -51.33 45.12 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.357 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.606 HD11 ' O ' ' X' ' 40' ' ' ILE . 11.1 mp -59.52 -28.69 67.29 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.886 0.374 . . . . 0.0 110.913 178.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . 0.439 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 37.1 t70 -65.36 -33.09 75.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.797 -179.095 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 5.0 p -95.87 -5.81 40.77 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 -172.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.679 HD13 ' HD2' ' X' ' 22' ' ' PHE . 0.0 OUTLIER -105.03 -27.39 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-N 119.005 0.821 . . . . 0.0 112.522 -179.047 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . 0.622 ' NE2' ' HB ' ' X' ' 47' ' ' ILE . 3.0 mp0 -157.49 -48.84 0.07 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.282 0.563 . . . . 0.0 110.279 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . 0.439 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 48.1 m-85 . . . . . 0 C--N 1.323 -0.55 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.781 -173.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.515 -0.385 0 CA-C-O 121.707 0.765 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . 0.582 ' CG ' ' HD2' ' X' ' 8' ' ' PRO . 21.5 t70 -75.75 154.32 85.24 Favored Pre-proline 0 C--N 1.318 -0.764 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 176.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . 0.582 ' HD2' ' CG ' ' X' ' 7' ' ' ASP . 71.1 Cg_exo -39.07 -25.41 0.1 Allowed 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 123.233 2.622 . . . . 0.0 113.627 -178.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . 0.518 ' HD3' ' OD2' ' X' ' 7' ' ' ASP . 5.6 mtp180 -77.11 -48.11 18.64 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 176.054 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.458 ' HA ' HD21 ' X' ' 10' ' ' LEU . 79.6 mt -92.05 -26.4 18.34 Favored 'General case' 0 C--O 1.217 -0.608 0 O-C-N 122.254 -0.279 . . . . 0.0 111.672 -175.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.509 ' O ' ' HB3' ' X' ' 15' ' ' SER . 12.7 tt -69.69 -15.32 19.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 173.065 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -91.8 -58.4 2.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.001 174.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 50.2 m -90.86 -29.96 17.22 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -169.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.415 HD22 ' O ' ' X' ' 14' ' ' LEU . 5.2 tt -94.52 -45.05 7.58 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 -179.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.509 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 19.3 t -64.77 -25.73 68.05 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.8 -175.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . 0.653 ' O ' ' HB2' ' X' ' 20' ' ' MET . 5.2 pp0? -65.96 -24.31 66.78 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 120.952 -0.299 . . . . 0.0 111.562 -179.549 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.489 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 4.6 ppp? -101.52 -27.38 13.14 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.775 0.322 . . . . 0.0 110.564 176.19 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 24.7 tp -65.93 -43.29 88.52 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.983 -179.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 29.6 t -96.84 8.82 43.5 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.09 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 20' ' ' MET . . . . . 0.653 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 10.3 tpt -100.36 -31.42 11.34 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.972 0.415 . . . . 0.0 110.561 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.11 42.1 2.88 Favored Glycine 0 N--CA 1.447 -0.611 0 N-CA-C 111.058 -0.817 . . . . 0.0 111.058 -174.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.489 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 11.4 m-30 -115.76 171.23 7.88 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 32.4 m -153.35 161.95 41.79 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.605 177.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.487 ' OD2' ' HA2' ' X' ' 27' ' ' GLY . 15.6 p30 -68.54 136.95 53.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.124 0.487 . . . . 0.0 110.389 174.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . 0.629 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 38.5 tt0 -61.54 -19.45 62.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.366 -0.833 . . . . 0.0 111.22 -176.166 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -149.69 -64.68 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.677 176.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . 0.487 ' HA2' ' OD2' ' X' ' 24' ' ' ASP . . . 179.52 32.9 0.06 OUTLIER Glycine 0 CA--C 1.506 -0.531 0 N-CA-C 110.755 -0.938 . . . . 0.0 110.755 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.629 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 40.5 p-90 -96.83 -4.02 41.09 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -172.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.473 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 20.9 tp -59.11 -24.08 62.67 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.746 -0.596 . . . . 0.0 112.058 -170.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 6.7 m -95.05 -11.88 27.57 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 121.368 0.604 . . . . 0.0 111.074 174.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -95.66 -54.84 3.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.727 -177.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.423 ' C ' HD12 ' X' ' 32' ' ' LEU . 2.7 tm? -61.37 -61.04 2.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.105 -177.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.609 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 7.8 mp -60.37 -60.75 3.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.254 -172.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 12.2 mp0 -46.45 -43.01 16.21 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -173.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 40.2 p -76.9 -12.17 59.92 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 -176.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -118.69 32.97 5.85 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.624 0.231 . . . . 0.0 111.624 -177.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 45.9 t30 60.37 40.71 17.14 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.43 0.634 . . . . 0.0 110.513 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.609 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 18.1 m-85 55.86 61.03 2.96 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.649 -179.293 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . 0.589 ' O ' ' HB2' ' X' ' 43' ' ' ALA . 22.2 t70 -86.06 118.19 25.37 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.471 -173.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.422 ' H ' HG12 ' X' ' 40' ' ' ILE . 0.3 OUTLIER -90.53 -4.34 10.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.37 173.72 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.92 -39.96 93.43 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 120.589 -0.815 . . . . 0.0 111.73 176.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.16 -25.86 14.39 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.07 -0.565 . . . . 0.0 111.11 178.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.589 ' HB2' ' O ' ' X' ' 39' ' ' ASP . . . -65.01 -41.81 95.02 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.899 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.673 ' HA ' HG12 ' X' ' 47' ' ' ILE . 7.1 mp -65.34 -33.73 76.67 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.381 -178.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . 0.634 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.4 t70 -58.43 -39.34 79.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.018 0.437 . . . . 0.0 110.554 178.053 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 8.8 p -94.83 -6.38 42.96 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -177.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.673 HG12 ' HA ' ' X' ' 44' ' ' LEU . 13.0 pt -100.72 42.93 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 O-C-N 121.703 -0.623 . . . . 0.0 111.382 174.138 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . 0.447 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 2.1 mt-30 89.49 -6.93 0.41 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.798 1.239 . . . . 0.0 113.318 173.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . 0.634 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 6.9 m-85 . . . . . 0 C--N 1.325 -0.475 0 O-C-N 121.944 -0.472 . . . . 0.0 111.59 178.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.512 -0.512 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . 0.472 ' O ' HG12 ' X' ' 11' ' ' ILE . 9.0 t70 -108.34 150.22 40.29 Favored Pre-proline 0 C--N 1.316 -0.871 0 CA-C-N 114.15 -1.387 . . . . 0.0 107.416 -177.399 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . 0.449 ' HD2' ' CG ' ' X' ' 7' ' ' ASP . 94.8 Cg_exo -42.76 -31.99 2.32 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.906 2.404 . . . . 0.0 113.25 -177.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . 0.491 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 69.1 mtp180 -78.08 -26.56 48.21 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 178.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.575 HD22 ' CE1' ' X' ' 38' ' ' TYR . 56.5 mt -97.67 -22.3 16.54 Favored 'General case' 0 C--O 1.221 -0.421 0 C-N-CA 122.283 0.233 . . . . 0.0 110.788 177.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.541 ' O ' ' HB3' ' X' ' 15' ' ' SER . 43.5 mm -66.86 -13.86 17.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 108.617 -0.882 . . . . 0.0 108.617 171.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -93.73 -64.19 1.11 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.66 -1.155 . . . . 0.0 111.1 171.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 13' ' ' SER . . . . . 0.557 ' O ' ' HE3' ' X' ' 17' ' ' MET . 15.9 m -86.92 -25.65 24.29 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -168.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . . . . . . . . . 60.5 tp -93.37 -43.96 8.52 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.541 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 46.3 t -63.23 -26.75 68.93 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.173 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.05 -47.92 79.78 Favored 'General case' 0 N--CA 1.461 0.089 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 174.399 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.607 ' HB3' ' O ' ' X' ' 22' ' ' PHE . 59.1 mtm -75.79 -43.99 43.59 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.204 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 28.9 tp -57.72 -32.86 67.83 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 123.4 0.437 . . . . 0.0 111.578 -177.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 46.8 t -88.07 -30.93 19.53 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.576 -178.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 20' ' ' MET . . . . . 0.446 ' HB3' ' CE1' ' X' ' 22' ' ' PHE . 15.0 tpt -80.6 -31.51 36.69 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -176.319 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.43 24.57 4.37 Favored Glycine 0 CA--C 1.52 0.371 0 C-N-CA 119.976 -1.107 . . . . 0.0 113.939 176.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.607 ' O ' ' HB3' ' X' ' 17' ' ' MET . 0.0 OUTLIER -138.61 167.09 22.7 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 171.136 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 36.6 m -158.59 -91.57 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 119.971 -0.692 . . . . 0.0 111.926 -175.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.566 ' HB2' HD22 ' X' ' 29' ' ' LEU . 56.2 t0 -119.17 122.92 43.11 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.297 -176.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . 0.741 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 54.8 tt0 -61.44 -29.45 69.95 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.249 176.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 155.84 40.33 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 119.567 -1.301 . . . . 0.0 115.294 173.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . 0.443 ' H ' ' CG ' ' X' ' 24' ' ' ASP . . . 146.09 -14.81 1.7 Allowed Glycine 0 C--N 1.332 0.342 0 C-N-CA 119.178 -1.487 . . . . 0.0 114.724 171.037 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.741 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 56.8 p-90 -96.2 -14.73 22.51 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 117.81 0.805 . . . . 0.0 113.041 -173.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.566 HD22 ' HB2' ' X' ' 24' ' ' ASP . 38.8 tp -54.76 -34.72 62.94 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.864 -0.523 . . . . 0.0 112.392 -170.261 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 30' ' ' THR . . . . . 0.533 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 80.3 p -85.5 -16.45 39.52 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 122.167 -0.333 . . . . 0.0 111.273 177.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 13.7 mtm105 -95.37 -52.6 4.09 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.971 0.415 . . . . 0.0 111.216 -176.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.635 HD12 ' HD3' ' X' ' 36' ' ' LYS . 2.4 tm? -52.07 -70.34 0.09 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.241 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.579 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 7.0 mp -58.43 -45.51 88.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.992 -175.425 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . 0.533 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.0 OUTLIER -53.23 -38.99 63.44 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -174.231 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 40.5 p -94.37 -2.34 52.23 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.837 0.351 . . . . 0.0 111.938 -177.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . 0.635 ' HD3' HD12 ' X' ' 32' ' ' LEU . 24.7 mtpp -118.29 38.05 3.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.9 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 41.64 45.12 2.86 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.744 0.817 . . . . 0.0 111.928 -176.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.579 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 53.1 m-85 60.05 78.01 0.29 Allowed 'General case' 0 C--O 1.233 0.209 0 CA-C-N 114.873 -1.058 . . . . 0.0 111.382 178.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . 0.506 ' O ' ' HB3' ' X' ' 43' ' ' ALA . 2.9 t0 -97.86 120.96 39.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.704 -177.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.644 ' O ' HD11 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.12 -19.96 7.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 172.029 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.18 -46.37 91.15 Favored Glycine 0 N--CA 1.441 -0.973 0 C-N-CA 120.493 -0.86 . . . . 0.0 112.277 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -83.81 -22.05 31.91 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.475 -0.362 . . . . 0.0 111.002 178.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.696 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -68.91 -47.4 65.9 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.944 178.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.644 HD11 ' O ' ' X' ' 40' ' ' ILE . 10.8 mp -67.36 -29.12 68.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.03 -179.417 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -65.13 -28.45 69.43 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 121.284 0.564 . . . . 0.0 110.897 178.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 7.6 p -96.08 -32.69 12.41 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -175.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.696 HG12 ' O ' ' X' ' 43' ' ' ALA . 0.9 OUTLIER -83.36 -29.43 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -173.137 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . 0.584 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.3 mt-30 -164.04 -35.9 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 -177.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . 0.513 ' CE2' ' HE2' ' X' ' 22' ' ' PHE . 37.4 m-85 . . . . . 0 C--N 1.323 -0.551 0 CA-C-O 120.809 0.338 . . . . 0.0 110.707 -177.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.51 -0.577 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -106.94 142.19 24.47 Favored Pre-proline 0 C--N 1.314 -0.955 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 -179.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -44.96 -20.88 0.43 Allowed 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.152 2.568 . . . . 0.0 113.325 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 87.8 mtm-85 -92.56 -37.73 12.31 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 122.901 0.48 . . . . 0.0 112.11 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.425 ' HA ' ' HB2' ' X' ' 13' ' ' SER . 36.7 mt -98.84 -10.66 22.63 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -175.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.695 ' O ' ' HB2' ' X' ' 15' ' ' SER . 12.6 tt -68.1 -21.91 27.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 175.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -95.62 -26.22 15.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.847 170.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 13' ' ' SER . . . . . 0.425 ' HB2' ' HA ' ' X' ' 10' ' ' LEU . 20.3 m -96.65 -48.51 5.48 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -171.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.428 HD21 HD23 ' X' ' 29' ' ' LEU . 2.4 tm? -93.11 -44.13 8.52 Favored 'General case' 0 CA--C 1.507 -0.709 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 -179.508 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.695 ' HB2' ' O ' ' X' ' 11' ' ' ILE . 18.9 m -64.67 -17.83 64.42 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.277 -176.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . 0.525 ' NE2' ' HB3' ' X' ' 17' ' ' MET . 4.7 pp0? -78.28 -28.44 47.6 Favored 'General case' 0 N--CA 1.461 0.117 0 C-N-CA 120.557 -0.457 . . . . 0.0 111.091 177.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 1.064 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 23.0 ptp -94.16 -26.53 16.65 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.588 178.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 36.8 tp -57.46 -40.18 77.94 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.459 -179.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 25.6 m -70.8 -37.76 73.28 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -177.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -84.66 -26.24 27.93 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 111.895 0.331 . . . . 0.0 111.895 -174.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.69 46.15 0.86 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.318 -0.944 . . . . 0.0 112.277 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 1.064 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 6.5 m-85 -127.36 146.46 50.45 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 175.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 58.6 m -151.51 -116.89 0.04 OUTLIER 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.784 -175.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.675 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.4 p30 -122.47 142.89 50.09 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.182 172.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . 0.714 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 29.5 tt0 -67.58 -50.61 57.53 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.582 0.706 . . . . 0.0 110.054 177.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -133.77 -3.61 3.25 Favored Glycine 0 C--N 1.319 -0.372 0 CA-C-N 114.978 -1.01 . . . . 0.0 112.855 -178.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.05 12.16 3.66 Favored Glycine 0 C--N 1.33 0.205 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.739 178.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.715 ' CZ2' HG22 ' X' ' 47' ' ' ILE . 28.2 p-90 -80.35 -6.96 58.82 Favored 'General case' 0 C--O 1.22 -0.453 0 N-CA-C 111.998 0.369 . . . . 0.0 111.998 -178.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.675 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 15.0 tp -56.6 -32.37 65.19 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.934 0.397 . . . . 0.0 111.627 -173.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 30' ' ' THR . . . . . 0.48 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 35.1 p -82.3 -19.97 38.38 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.341 176.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . 0.602 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 8.8 mtm180 -95.24 -57.03 2.53 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.694 -175.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -51.35 -62.35 1.67 Allowed 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.608 0.763 . . . . 0.0 111.157 -177.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.831 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 7.3 mp -60.62 -45.48 93.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.243 -176.558 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . 0.48 ' HB2' ' O ' ' X' ' 30' ' ' THR . 3.7 tp-100 -39.15 -61.21 0.79 Allowed 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -175.489 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 26.7 p -85.3 -2.82 58.49 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -174.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -108.3 28.73 8.03 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 122.202 -0.311 . . . . 0.0 111.274 177.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 48.0 t30 60.31 42.7 14.57 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.09 0.471 . . . . 0.0 110.866 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.831 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 89.4 m-85 53.55 58.61 5.01 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.562 0.696 . . . . 0.0 110.177 -178.067 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . 0.62 ' O ' ' HB1' ' X' ' 43' ' ' ALA . 38.0 t0 -77.01 117.1 18.26 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.448 -1.251 . . . . 0.0 111.428 -172.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.61 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.78 -5.11 10.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.109 0.481 . . . . 0.0 110.291 170.958 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -80.28 -36.48 23.91 Favored Glycine 0 N--CA 1.439 -1.117 0 C-N-CA 120.476 -0.869 . . . . 0.0 111.52 178.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.56 -20.49 18.96 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.182 -0.509 . . . . 0.0 111.273 178.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.658 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -65.27 -45.01 86.19 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.019 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.61 HD13 ' O ' ' X' ' 40' ' ' ILE . 11.0 mp -66.26 -29.34 69.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.644 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -63.66 -29.5 70.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.281 176.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 3.6 p -98.04 -16.16 19.73 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -175.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.715 HG22 ' CZ2' ' X' ' 28' ' ' TRP . 0.4 OUTLIER -94.06 -30.61 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 119.431 -0.908 . . . . 0.0 113.17 -176.292 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . 0.478 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.7 mp0 -161.22 -42.58 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.968 0.413 . . . . 0.0 110.966 -178.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . 0.435 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 60.0 m-85 . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.639 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.322 0 CA-C-O 121.434 0.635 . . . . 0.0 109.457 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . 0.517 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 28.9 t70 -81.7 147.22 58.42 Favored Pre-proline 0 C--N 1.318 -0.771 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 176.535 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . 0.517 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 83.9 Cg_exo -47.06 -24.92 3.68 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.07 1.847 . . . . 0.0 112.849 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 77.8 mtm-85 -94.17 -28.46 15.64 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.518 HD21 ' HB2' ' X' ' 14' ' ' LEU . 50.2 mt -97.95 -16.97 19.48 Favored 'General case' 0 CA--C 1.514 -0.42 0 O-C-N 122.14 -0.35 . . . . 0.0 111.284 -177.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.517 ' HA ' ' HB2' ' X' ' 15' ' ' SER . 14.2 tt -73.02 -8.77 12.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 172.492 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . 0.528 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 45.8 mt-10 -93.65 -62.61 1.33 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.637 -1.165 . . . . 0.0 110.754 173.318 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 11.0 m -90.05 -27.93 19.38 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -168.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.518 ' HB2' HD21 ' X' ' 10' ' ' LEU . 9.5 tt -94.28 -44.39 7.97 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.517 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 12.9 t -66.71 -18.95 65.64 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.125 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . 0.528 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 0.0 OUTLIER -64.03 -44.27 93.03 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 175.239 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.554 ' SD ' HD12 ' X' ' 29' ' ' LEU . 62.1 mtt -69.86 -38.35 76.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.606 178.139 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . 0.403 ' HB2' ' HA ' ' X' ' 15' ' ' SER . 7.9 mp -62.12 -32.5 73.08 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.499 178.233 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 37.2 t -80.6 -44.35 19.08 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.331 -178.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 26.2 mmt -78.66 -32.21 47.07 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -175.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.6 46.86 0.82 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.363 -0.922 . . . . 0.0 112.124 -178.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -128.52 162.97 25.98 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 177.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 44.8 m -139.78 -143.25 0.16 Allowed 'General case' 0 C--N 1.315 -0.91 0 C-N-CA 120.576 -0.45 . . . . 0.0 109.789 178.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.713 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 21.8 p-10 -99.72 128.23 45.82 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.94 0.4 . . . . 0.0 110.272 173.395 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . 0.784 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 42.9 tp10 -83.71 56.99 3.86 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.751 0.786 . . . . 0.0 109.223 176.229 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 133.31 -87.33 0.27 Allowed Glycine 0 N--CA 1.446 -0.686 0 CA-C-N 114.827 -1.079 . . . . 0.0 111.476 -174.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -172.27 29.28 0.11 Allowed Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 121.041 -0.599 . . . . 0.0 111.741 177.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.784 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 53.3 p-90 -95.92 -9.66 30.74 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 -176.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.713 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 10.6 tp -59.69 -19.96 53.15 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 121.826 -0.546 . . . . 0.0 110.761 -175.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' X' X ' 30' ' ' THR . . . . . 0.641 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 38.7 p -93.83 -48.03 6.48 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 121.993 -0.442 . . . . 0.0 110.624 169.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 42.7 mmm-85 -63.71 -61.22 2.45 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.287 -176.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.634 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 2.0 tm? -50.33 -52.38 37.31 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.84 -178.276 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.418 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 62.3 mt -61.06 -62.01 2.16 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.305 -179.514 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . 0.641 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.0 OUTLIER -42.8 -54.69 4.0 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -175.966 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 29.6 p -68.39 -24.74 64.81 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -175.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 61.0 mttm -105.19 37.4 2.2 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.978 178.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 42.05 41.86 2.16 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.715 0.806 . . . . 0.0 112.841 -178.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.455 ' CD1' HD23 ' X' ' 10' ' ' LEU . 74.3 m-85 65.96 66.22 0.5 Allowed 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.033 177.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . 0.474 ' O ' ' HB2' ' X' ' 43' ' ' ALA . 38.9 t70 -104.25 120.18 40.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.257 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.541 ' HB ' HD11 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.26 -3.6 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.155 173.719 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.8 -41.01 97.76 Favored Glycine 0 N--CA 1.443 -0.878 0 C-N-CA 120.402 -0.904 . . . . 0.0 111.961 177.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.99 -20.27 16.84 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.156 -0.522 . . . . 0.0 111.18 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.474 ' HB2' ' O ' ' X' ' 39' ' ' ASP . . . -74.33 -31.71 62.54 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.011 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.748 ' HA ' HG13 ' X' ' 47' ' ' ILE . 6.5 mp -75.43 -19.15 59.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.199 179.428 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . 0.543 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.5 t70 -70.33 -27.14 64.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.87 0.367 . . . . 0.0 110.502 177.287 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 17.9 p -95.83 -23.44 16.92 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.748 HG13 ' HA ' ' X' ' 44' ' ' LEU . 2.4 pp -84.09 42.55 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 178.336 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . 0.406 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 1.5 mt-30 84.67 7.55 0.5 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.164 0.985 . . . . 0.0 112.801 172.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . 0.543 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 15.9 m-85 . . . . . 0 C--N 1.325 -0.473 0 CA-C-O 121.082 0.468 . . . . 0.0 110.944 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.293 0 CA-C-O 121.821 0.82 . . . . 0.0 108.868 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -78.36 147.3 72.05 Favored Pre-proline 0 C--O 1.216 -0.678 0 CA-C-N 114.462 -1.245 . . . . 0.0 108.17 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -44.99 -23.14 0.85 Allowed 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 122.728 2.285 . . . . 0.0 113.272 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . 0.638 ' HD2' ' CE2' ' X' ' 38' ' ' TYR . 78.3 mtm180 -93.2 -33.93 13.8 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.996 -0.547 . . . . 0.0 112.315 -179.583 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.452 ' HA ' HD22 ' X' ' 10' ' ' LEU . 83.8 mt -97.82 -19.02 18.41 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 122.212 -0.305 . . . . 0.0 111.019 -176.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.57 ' O ' HD13 ' X' ' 11' ' ' ILE . 0.3 OUTLIER -75.54 -9.9 13.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 170.826 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -96.44 -58.28 2.1 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.549 171.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 45.9 t -96.35 -24.9 15.95 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 -167.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.423 ' HB3' ' HB3' ' X' ' 10' ' ' LEU . 9.8 tt -95.77 -43.87 7.68 Favored 'General case' 0 CA--C 1.508 -0.659 0 CA-C-N 118.997 0.817 . . . . 0.0 109.823 -176.566 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.545 ' HA ' ' HB3' ' X' ' 18' ' ' LEU . 61.4 p -74.91 -9.78 58.87 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.968 -178.476 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . 0.461 ' OE1' HG22 ' X' ' 40' ' ' ILE . 5.1 tm0? -57.45 -60.54 3.5 Favored 'General case' 0 C--N 1.339 0.111 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 174.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.801 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 0.6 OUTLIER -73.77 -29.08 61.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.654 178.614 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . 0.545 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 26.4 tp -61.77 -30.97 71.15 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.504 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 23.1 t -97.42 -34.18 11.13 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 120.586 0.231 . . . . 0.0 111.254 -177.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' X' X ' 20' ' ' MET . . . . . 0.454 ' HE1' ' HB3' ' X' ' 20' ' ' MET . 81.1 mtp -79.61 -12.88 59.82 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -176.373 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.68 42.1 3.21 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.272 -0.966 . . . . 0.0 113.264 176.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.801 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 46.0 m-85 -129.16 161.13 30.81 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 174.448 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 55.0 m -139.77 -177.83 5.14 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.707 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.522 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 6.2 p-10 -77.12 115.85 17.26 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.293 0.568 . . . . 0.0 109.983 175.347 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -86.11 59.68 5.78 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.117 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.73 -4.68 2.21 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.27 -0.967 . . . . 0.0 113.189 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . 0.404 ' HA2' ' OD2' ' X' ' 24' ' ' ASP . . . 86.09 21.04 53.95 Favored Glycine 0 N--CA 1.445 -0.744 0 C-N-CA 120.44 -0.886 . . . . 0.0 111.546 -177.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.554 ' HA ' ' HG3' ' X' ' 31' ' ' ARG . 46.2 p-90 -84.85 -10.74 56.84 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-O 119.625 -0.226 . . . . 0.0 111.432 -179.309 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.578 ' O ' HD13 ' X' ' 33' ' ' LEU . 48.5 tp -59.01 -28.27 66.24 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.896 -0.503 . . . . 0.0 111.785 -170.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 28.9 m -94.37 -11.08 30.66 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 120.948 0.404 . . . . 0.0 111.118 174.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . 0.554 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 5.0 mtp-105 -96.04 -53.12 3.77 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.148 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 8.8 tp -64.85 -77.54 0.06 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.867 0.692 . . . . 0.0 112.867 -172.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.724 ' HA ' ' HB2' ' X' ' 36' ' ' LYS . 1.6 pp -69.4 -16.93 63.61 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -171.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -64.33 -33.75 76.57 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.5 0.191 . . . . 0.0 110.98 178.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 78.1 p -95.69 -16.88 21.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.972 0.415 . . . . 0.0 110.383 175.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . 0.724 ' HB2' ' HA ' ' X' ' 33' ' ' LEU . 43.9 mttp -87.81 38.71 0.85 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.603 177.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 43.73 40.08 2.85 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.842 0.857 . . . . 0.0 112.953 -178.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.638 ' CE2' ' HD2' ' X' ' 9' ' ' ARG . 72.8 m-85 58.74 71.35 0.59 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.713 173.368 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -125.59 142.43 51.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.736 0.779 . . . . 0.0 112.705 -179.168 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.475 ' O ' ' HB2' ' X' ' 44' ' ' LEU . 0.1 OUTLIER -91.39 -3.98 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.27 173.594 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.12 -42.96 97.85 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.967 -178.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -94.17 -23.73 17.8 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.272 -0.464 . . . . 0.0 110.549 175.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.502 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -66.53 -32.57 74.0 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.093 178.355 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.759 HD11 HD13 ' X' ' 47' ' ' ILE . 3.3 tp -66.24 -35.87 81.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.236 0.541 . . . . 0.0 110.616 -179.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . 0.533 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 18.9 t70 -69.1 -34.27 74.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.019 178.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 44.9 p -91.63 -24.31 19.58 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -174.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.759 HD13 HD11 ' X' ' 44' ' ' LEU . 5.7 pt -72.19 -26.14 24.49 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 119.886 -0.726 . . . . 0.0 111.504 -176.444 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . 0.449 HE21 ' HB2' ' X' ' 48' ' ' GLN . 0.0 OUTLIER -173.94 -45.37 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 O-C-N 123.12 0.262 . . . . 0.0 111.081 178.679 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . 0.533 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 51.9 m-85 . . . . . 0 C--N 1.327 -0.377 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -173.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.397 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . 0.523 ' HB2' ' H ' ' X' ' 10' ' ' LEU . 2.9 m-20 -71.26 156.05 92.23 Favored Pre-proline 0 CA--C 1.505 -0.77 0 CA-C-N 114.895 -1.048 . . . . 0.0 108.622 178.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -58.44 -12.26 13.27 Favored 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 121.084 1.189 . . . . 0.0 110.489 169.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 37.3 mtp85 -93.34 -43.04 8.98 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 114.784 -1.098 . . . . 0.0 111.551 174.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.657 HD23 ' HB2' ' X' ' 14' ' ' LEU . 32.0 mt -88.13 -21.94 24.37 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -173.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.481 ' O ' ' HB3' ' X' ' 15' ' ' SER . 15.1 tt -69.52 -17.12 21.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 172.528 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 50.9 mm-40 -95.05 -64.95 1.01 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.684 173.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' X' X ' 13' ' ' SER . . . . . 0.464 ' HA ' HG22 ' X' ' 40' ' ' ILE . 13.2 m -81.6 -26.55 34.8 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -169.139 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.657 ' HB2' HD23 ' X' ' 10' ' ' LEU . 0.2 OUTLIER -94.98 -49.32 5.6 Favored 'General case' 0 CA--C 1.506 -0.741 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 -179.823 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.481 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 21.9 t -62.59 -27.03 68.91 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.521 -176.639 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -51.14 -49.24 61.23 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 120.938 0.399 . . . . 0.0 110.662 176.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.755 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 10.5 ptm -97.96 -31.45 12.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.828 -176.186 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 29.2 tp -64.35 -31.94 73.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.822 0.344 . . . . 0.0 111.071 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 15.8 m -98.73 -7.52 27.56 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.443 -178.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' X' X ' 20' ' ' MET . . . . . 0.427 ' HA ' ' CE ' ' X' ' 20' ' ' MET . 0.1 OUTLIER -92.63 -31.66 15.06 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.841 0.353 . . . . 0.0 110.808 -179.122 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.58 31.49 2.14 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.671 -0.776 . . . . 0.0 111.826 -176.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.755 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 20.4 m-30 -116.46 155.97 27.66 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 175.362 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -140.04 -159.43 0.96 Allowed 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 120.101 -0.639 . . . . 0.0 110.261 -179.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.989 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 18.8 p-10 -85.93 114.73 23.07 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.396 0.617 . . . . 0.0 109.542 172.164 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . 0.458 ' HB2' ' HE1' ' X' ' 28' ' ' TRP . 5.7 mm-40 -84.01 54.42 2.92 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.571 -178.344 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 139.77 -17.23 3.03 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.405 -177.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 111.65 7.69 23.65 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.173 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.458 ' HE1' ' HB2' ' X' ' 25' ' ' GLU . 51.7 p-90 -83.55 -22.26 32.45 Favored 'General case' 0 C--O 1.208 -1.112 0 CA-C-O 119.087 -0.483 . . . . 0.0 111.992 -178.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.989 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 11.6 tp -50.13 -34.67 22.97 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 118.898 0.772 . . . . 0.0 111.577 -174.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.53 -30.24 52.71 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 175.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 16.4 mtp180 -92.36 -55.52 3.38 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -175.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.498 HD13 ' C ' ' X' ' 32' ' ' LEU . 2.8 tm? -43.15 -59.89 1.88 Allowed 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.29 1.036 . . . . 0.0 111.996 -178.267 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.764 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.8 mp -70.58 -36.67 73.72 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.569 -174.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -52.63 -46.74 67.22 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -173.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 22.5 p -77.76 -12.09 59.94 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.801 0.334 . . . . 0.0 111.694 -178.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 50.1 mttp -112.51 37.66 2.99 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.114 -178.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 41.62 39.77 1.22 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.628 0.771 . . . . 0.0 112.172 -177.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.764 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 31.2 m-85 66.94 77.76 0.27 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.907 -179.329 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -106.19 126.7 52.54 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.675 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.645 ' O ' HD12 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.22 -12.97 9.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 120.932 0.396 . . . . 0.0 110.201 172.208 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -60.22 -41.13 98.13 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.631 179.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.87 -17.43 21.11 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.751 0.31 . . . . 0.0 111.085 177.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.547 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -69.97 -42.97 72.43 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.658 177.207 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.823 HD13 HD11 ' X' ' 47' ' ' ILE . 8.9 mp -62.47 -27.34 69.06 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.085 -178.391 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . 0.466 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 33.5 t70 -55.13 -39.6 69.61 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.814 0.34 . . . . 0.0 111.709 179.026 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 1.1 p -95.99 -24.48 16.35 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 -177.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.823 HD11 HD13 ' X' ' 44' ' ' LEU . 8.3 pt -82.78 44.66 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 178.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 82.68 25.5 0.15 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.135 0.974 . . . . 0.0 113.14 171.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . 0.466 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 66.2 m-85 . . . . . 0 N--CA 1.468 0.455 0 N-CA-C 110.34 -0.244 . . . . 0.0 110.34 174.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.516 -0.344 0 CA-C-O 121.11 0.481 . . . . 0.0 109.706 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . 0.483 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 0.3 OUTLIER -67.35 152.86 95.75 Favored Pre-proline 0 CA--C 1.512 -0.505 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.026 177.248 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . 0.483 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 23.6 Cg_endo -59.45 -13.17 19.6 Favored 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 121.452 1.435 . . . . 0.0 110.574 171.486 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -93.78 -50.0 5.57 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.424 -1.262 . . . . 0.0 111.823 175.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.898 HD21 ' HB2' ' X' ' 14' ' ' LEU . 89.5 mt -94.68 -17.02 22.62 Favored 'General case' 0 C--O 1.217 -0.608 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -169.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.534 HD12 HG21 ' X' ' 11' ' ' ILE . 0.2 OUTLIER -65.91 -25.23 35.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 175.471 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -94.87 -42.58 8.62 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.508 174.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 4.0 t -94.97 -36.98 11.36 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 -166.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.898 ' HB2' HD21 ' X' ' 10' ' ' LEU . 8.4 tt -94.63 -42.82 8.59 Favored 'General case' 0 CA--C 1.51 -0.558 0 CA-C-O 121.51 0.671 . . . . 0.0 109.209 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.512 ' HB2' ' O ' ' X' ' 11' ' ' ILE . 46.3 m -64.8 -17.27 64.07 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.123 -179.299 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . 0.403 ' OE1' ' HE3' ' X' ' 17' ' ' MET . 8.4 tm0? -58.46 -63.04 1.42 Allowed 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.116 175.705 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.824 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 0.9 OUTLIER -76.13 -25.24 55.15 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.799 -0.361 . . . . 0.0 111.172 179.884 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . 0.506 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 37.2 tp -61.54 -34.8 76.18 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.817 0.342 . . . . 0.0 110.865 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 29.9 p -89.07 -42.21 11.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.574 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' X' X ' 20' ' ' MET . . . . . 0.434 ' HE1' ' HB3' ' X' ' 20' ' ' MET . 91.4 mmm -66.53 -32.81 74.4 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -176.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 109.83 46.37 0.9 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.218 -0.991 . . . . 0.0 111.931 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.824 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 95.4 m-85 -130.63 172.21 12.2 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 175.679 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 50.2 m -155.27 -173.86 4.73 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.547 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 30.7 p30 -83.39 154.11 24.19 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.939 0.4 . . . . 0.0 110.125 172.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . 0.499 ' HG2' ' CD1' ' X' ' 28' ' ' TRP . 7.5 pt-20 -82.59 -7.41 59.65 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.197 -174.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -170.66 -28.91 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.713 -178.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . 0.459 ' HA2' ' OD2' ' X' ' 24' ' ' ASP . . . 148.39 31.09 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 119.983 -1.103 . . . . 0.0 112.937 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.819 ' HB2' ' HB2' ' X' ' 32' ' ' LEU . 40.4 p-90 -96.17 -13.89 23.19 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 178.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.587 HD13 HD21 ' X' ' 33' ' ' LEU . 30.4 tp -58.11 -15.2 8.65 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 122.019 -0.426 . . . . 0.0 111.584 -174.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 82.7 p -94.46 -56.35 2.84 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 121.823 -0.548 . . . . 0.0 110.614 169.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . 0.673 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -69.72 -51.4 34.65 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -174.761 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.819 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 3.4 tm? -51.05 -54.79 21.61 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.74 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 10.8 mp -54.95 -60.12 3.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.825 177.017 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -40.0 -48.98 2.49 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.868 0.73 . . . . 0.0 112.556 -179.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 7.6 m -59.57 -51.28 70.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.022 -0.536 . . . . 0.0 112.017 -174.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.57 37.4 1.2 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 40.2 t30 61.98 61.01 1.43 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.4 176.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.74 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 81.0 m-85 43.9 52.86 6.5 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.351 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . 0.586 ' O ' ' HB3' ' X' ' 43' ' ' ALA . 42.4 t0 -82.37 130.74 35.17 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.46 -173.159 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.608 ' O ' HD11 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.69 -12.2 9.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.058 169.688 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.51 -41.73 83.62 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.457 -0.877 . . . . 0.0 112.135 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -91.31 -19.57 22.82 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.339 -0.431 . . . . 0.0 110.943 177.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.586 ' HB3' ' O ' ' X' ' 39' ' ' ASP . . . -71.58 -39.69 70.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.789 178.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.761 HD12 HD13 ' X' ' 47' ' ' ILE . 7.0 mp -65.55 -37.09 85.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.886 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -54.14 -35.92 62.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.233 176.189 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 7.4 p -96.25 -22.12 17.44 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -177.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.761 HD13 HD12 ' X' ' 44' ' ' LEU . 28.0 pt -83.97 42.78 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.8 -0.562 . . . . 0.0 111.715 176.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 72.85 20.46 3.59 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.405 0.682 . . . . 0.0 112.094 174.377 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . 0.484 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 9.7 m-30 . . . . . 0 C--N 1.328 -0.369 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 173.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.442 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . 0.535 ' O ' HG12 ' X' ' 11' ' ' ILE . 23.6 t70 -80.27 154.54 74.55 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 113.35 -1.75 . . . . 0.0 107.901 178.359 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . 0.441 ' HD2' ' CG ' ' X' ' 7' ' ' ASP . 68.8 Cg_exo -49.31 -21.66 4.9 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 121.98 1.787 . . . . 0.0 112.461 177.693 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . 0.427 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 34.6 mmt180 -87.27 -26.62 23.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.35 177.31 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.451 HD11 ' HB2' ' X' ' 14' ' ' LEU . 4.4 mm? -98.01 -33.39 11.21 Favored 'General case' 0 C--O 1.222 -0.38 0 O-C-N 122.292 -0.255 . . . . 0.0 110.75 -175.653 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.535 HG12 ' O ' ' X' ' 7' ' ' ASP . 18.1 pt -68.97 -12.53 16.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 170.287 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -96.56 -66.49 0.9 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.148 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 34.6 t -83.77 -23.23 31.62 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -170.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.451 ' HB2' HD11 ' X' ' 10' ' ' LEU . 2.6 tm? -92.51 -42.53 9.66 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 177.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.507 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 43.9 t -62.75 -24.93 67.95 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.209 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . 0.48 HE21 ' HB3' ' X' ' 16' ' ' GLN . 0.0 OUTLIER -55.17 -43.57 74.41 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.908 0.385 . . . . 0.0 110.551 176.99 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.606 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 9.5 ptm -96.66 -27.78 14.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.545 -178.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . 0.438 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 35.6 tp -64.22 -40.5 96.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.942 0.401 . . . . 0.0 110.815 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 19.0 m -91.72 -4.51 54.99 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.71 -176.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 16.7 tpt -102.78 -33.24 9.45 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.379 -179.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.65 46.52 0.67 Allowed Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.211 -0.995 . . . . 0.0 112.266 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.643 ' CZ ' ' HE1' ' X' ' 49' ' ' TYR . 47.5 m-85 -125.63 163.62 22.38 Favored 'General case' 0 CA--C 1.507 -0.695 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 175.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 23' ' ' SER . . . . . 0.41 ' O ' HG23 ' X' ' 47' ' ' ILE . 41.4 m -145.82 171.09 15.3 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 120.426 -0.51 . . . . 0.0 109.95 -179.561 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.458 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.6 p30 -69.51 134.0 48.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.2 0.524 . . . . 0.0 110.628 177.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . 0.532 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 33.3 tt0 -87.18 55.54 3.6 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.546 0.688 . . . . 0.0 109.379 177.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 136.01 -95.05 0.24 Allowed Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.371 -0.832 . . . . 0.0 111.918 -176.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -166.73 29.78 0.19 Allowed Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.991 -0.623 . . . . 0.0 111.673 178.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.532 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 53.6 p-90 -92.96 -14.08 27.96 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -176.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.486 ' HA ' ' CE3' ' X' ' 28' ' ' TRP . 13.8 tp -57.1 -24.52 54.67 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -168.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 77.1 p -82.71 -48.56 10.73 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.298 170.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 31.8 mtt-85 -60.07 -57.97 10.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.977 -177.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.576 HD12 ' HB3' ' X' ' 42' ' ' ALA . 2.3 tm? -50.28 -51.12 47.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.064 -176.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.452 HD13 ' O ' ' X' ' 29' ' ' LEU . 11.0 mp -62.64 -64.31 0.96 Allowed 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.27 179.554 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -43.42 -43.11 5.06 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -178.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 28.0 m -64.65 -52.24 58.4 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -176.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . 0.592 ' HB2' ' HB2' ' X' ' 39' ' ' ASP . 0.0 OUTLIER -93.38 40.28 1.06 Allowed 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -176.638 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 5.7 p-10 44.29 51.11 7.65 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.324 0.649 . . . . 0.0 111.84 -176.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.427 ' CD2' ' HB3' ' X' ' 9' ' ' ARG . 57.8 m-85 64.37 73.39 0.43 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 114.467 -1.242 . . . . 0.0 111.003 178.147 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . 0.592 ' HB2' ' HB2' ' X' ' 36' ' ' LYS . 2.5 t0 -97.35 117.72 32.23 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.045 -0.979 . . . . 0.0 111.127 -176.379 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.639 ' O ' HD11 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.1 -18.38 7.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 121.102 0.477 . . . . 0.0 109.791 171.367 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.18 -34.12 89.08 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.543 179.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . 0.576 ' HB3' HD12 ' X' ' 32' ' ' LEU . . . -100.01 -20.61 15.99 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.729 0.3 . . . . 0.0 111.282 177.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.533 ' HB2' ' O ' ' X' ' 39' ' ' ASP . . . -72.47 -36.22 68.41 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.45 179.246 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.724 HD12 HD13 ' X' ' 47' ' ' ILE . 7.0 mp -63.68 -31.64 72.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.098 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . 0.529 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.9 t70 -55.18 -48.71 73.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.949 177.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 3.3 p -85.98 -5.61 59.19 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 -177.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.724 HD13 HD12 ' X' ' 44' ' ' LEU . 30.1 pt -106.24 43.3 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 O-C-N 121.902 -0.499 . . . . 0.0 111.272 175.151 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 1.1 mp0 85.05 22.86 0.09 Allowed 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.657 1.183 . . . . 0.0 113.308 173.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . 0.643 ' HE1' ' CZ ' ' X' ' 22' ' ' PHE . 32.2 m-85 . . . . . 0 C--N 1.327 -0.407 0 N-CA-C 110.224 -0.288 . . . . 0.0 110.224 172.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 -0.191 0 CA-C-O 121.196 0.522 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -73.14 156.8 89.15 Favored Pre-proline 0 CA--C 1.509 -0.601 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.966 177.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -55.07 -12.76 5.5 Favored 'Trans proline' 0 CA--C 1.536 0.576 0 C-N-CA 121.307 1.338 . . . . 0.0 110.987 169.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -90.99 -49.13 6.59 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.01 177.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.461 ' HB3' ' HB3' ' X' ' 14' ' ' LEU . 53.9 mt -97.85 -17.55 19.24 Favored 'General case' 0 C--O 1.22 -0.491 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -173.168 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.596 ' O ' ' HB3' ' X' ' 15' ' ' SER . 0.5 OUTLIER -66.75 -21.33 28.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.876 0.846 . . . . 0.0 108.932 174.083 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -95.15 -45.83 7.04 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.584 175.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 8.1 t -94.05 -36.3 12.18 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -169.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.507 HD13 HD22 ' X' ' 29' ' ' LEU . 42.1 tp -92.71 -43.44 9.06 Favored 'General case' 0 CA--C 1.51 -0.582 0 O-C-N 121.682 -0.636 . . . . 0.0 109.791 179.711 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.596 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 33.4 t -61.43 -25.64 67.34 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.818 -175.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . 0.48 ' NE2' ' HB3' ' X' ' 17' ' ' MET . 4.2 pp0? -73.01 -30.58 63.87 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 120.584 -0.446 . . . . 0.0 111.21 179.22 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.745 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 23.7 ptp -90.14 -27.86 19.33 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.28 177.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 27.7 tp -63.93 -28.59 69.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.795 178.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 8.9 p -93.69 -44.21 8.28 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.901 -179.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 25.0 mmt -69.99 -24.09 63.26 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -175.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.82 47.39 1.27 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.087 -1.054 . . . . 0.0 112.555 -179.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.745 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 47.5 m-85 -127.06 144.5 51.01 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 176.274 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 14.3 m -144.39 169.95 16.95 Favored 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 119.855 -0.738 . . . . 0.0 111.233 -173.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.537 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 8.4 p-10 -71.73 131.19 42.76 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.798 173.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . 0.511 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 16.0 tp10 -69.21 -69.18 0.35 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.718 -177.475 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -97.47 -20.29 22.88 Favored Glycine 0 C--N 1.316 -0.539 0 C-N-CA 120.951 -0.643 . . . . 0.0 113.169 -179.236 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.52 32.67 0.81 Allowed Glycine 0 CA--C 1.507 -0.407 0 C-N-CA 120.537 -0.839 . . . . 0.0 111.211 -176.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.541 ' HA ' ' HG3' ' X' ' 31' ' ' ARG . 23.9 p-90 -96.15 -3.79 43.86 Favored 'General case' 0 C--O 1.217 -0.647 0 CA-C-N 115.173 -0.513 . . . . 0.0 111.452 -176.695 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.537 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 11.0 tp -60.19 -32.26 70.92 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 122.176 -0.328 . . . . 0.0 111.348 -172.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 4.6 m -79.89 -15.39 57.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.965 0.412 . . . . 0.0 110.821 175.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . 0.541 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 11.3 mtm180 -96.33 -60.24 1.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.033 0.444 . . . . 0.0 111.168 -178.122 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.437 ' C ' HD11 ' X' ' 32' ' ' LEU . 2.7 tm? -49.31 -72.63 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.773 -178.065 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.492 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.9 mp -56.75 -45.77 81.82 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.787 -174.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.59 -51.76 34.98 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -176.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 2.2 m -77.64 -7.44 56.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.073 0.463 . . . . 0.0 111.107 -177.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -115.06 37.83 3.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.362 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 11.7 p30 49.74 33.04 5.73 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.02 0.928 . . . . 0.0 112.777 179.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.492 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 67.8 m-85 63.83 70.15 0.52 Allowed 'General case' 0 C--O 1.234 0.267 0 C-N-CA 122.955 0.502 . . . . 0.0 110.818 178.196 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . 0.521 ' O ' ' HB2' ' X' ' 43' ' ' ALA . 44.7 p-10 -111.42 141.04 45.49 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.683 0.754 . . . . 0.0 112.72 -178.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.437 ' O ' ' HB2' ' X' ' 44' ' ' LEU . 0.0 OUTLIER -92.6 -6.17 10.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.385 170.244 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.21 -44.19 76.83 Favored Glycine 0 CA--C 1.505 -0.565 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.435 -177.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.84 -18.49 20.33 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 120.827 0.346 . . . . 0.0 110.831 177.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.521 ' HB2' ' O ' ' X' ' 39' ' ' ASP . . . -71.63 -31.92 67.4 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.778 177.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.71 ' HA ' HD13 ' X' ' 47' ' ' ILE . 6.1 tp -65.14 -31.54 72.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.111 0.481 . . . . 0.0 110.443 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -73.94 -27.55 61.07 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.847 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 22.9 p -97.15 -31.12 12.63 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 -175.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.71 HD13 ' HA ' ' X' ' 44' ' ' LEU . 2.1 pt -64.63 -26.93 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -171.368 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -167.74 -39.09 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 120.77 0.319 . . . . 0.0 111.077 177.024 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 60.2 m-85 . . . . . 0 C--N 1.327 -0.407 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.94 -177.578 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.512 -0.482 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -102.02 150.03 37.08 Favored Pre-proline 0 C--N 1.317 -0.822 0 CA-C-N 114.191 -1.368 . . . . 0.0 108.127 -176.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -45.24 -25.87 2.15 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.33 2.02 . . . . 0.0 113.11 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 50.5 mtp85 -92.95 -35.0 13.54 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 178.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 97.1 mt -88.28 -18.03 29.43 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 116.8 -0.182 . . . . 0.0 110.81 -177.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.488 HG21 HD13 ' X' ' 11' ' ' ILE . 0.4 OUTLIER -63.83 -26.04 39.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.639 0.733 . . . . 0.0 109.272 171.318 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . 0.542 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 5.3 mm-40 -85.81 -45.24 11.77 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.368 176.596 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 11.2 p -96.09 -43.14 7.9 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 113.858 1.058 . . . . 0.0 113.858 -169.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tt -93.09 -45.44 7.9 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -176.224 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.479 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 33.1 m -68.5 -14.56 63.09 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.414 179.532 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . 0.542 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 0.7 OUTLIER -62.3 -65.95 0.61 Allowed 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 171.106 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.464 ' CB ' ' HB2' ' X' ' 22' ' ' PHE . 70.5 mtm -62.71 -39.46 94.08 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.874 -179.051 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 30.0 tp -61.09 -34.4 74.87 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -177.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 27.8 t -94.99 -8.44 36.9 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.602 0.239 . . . . 0.0 111.563 -177.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 50.5 tpp -101.74 -31.81 10.6 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.495 -178.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.26 34.31 1.64 Allowed Glycine 0 CA--C 1.511 -0.214 0 C-N-CA 120.581 -0.818 . . . . 0.0 111.501 -177.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.598 ' HD2' HD11 ' X' ' 47' ' ' ILE . 4.5 m-85 -121.76 138.77 54.23 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 176.415 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' X' X ' 23' ' ' SER . . . . . 0.497 ' O ' HG22 ' X' ' 47' ' ' ILE . 68.8 m -134.83 -128.15 0.16 Allowed 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.687 -176.268 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.585 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.6 p30 -120.98 136.96 54.86 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.751 173.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -68.46 -38.49 81.13 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.002 0.429 . . . . 0.0 110.385 -177.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -144.15 -0.14 1.07 Allowed Glycine 0 CA--C 1.519 0.33 0 C-N-CA 120.739 -0.743 . . . . 0.0 113.57 -178.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 123.09 28.67 1.33 Allowed Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.253 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.493 ' HZ2' ' CG2' ' X' ' 47' ' ' ILE . 32.9 p-90 -96.53 -8.76 31.16 Favored 'General case' 0 C--O 1.218 -0.597 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -178.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.585 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 20.3 tp -65.48 -17.39 64.52 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.069 0.461 . . . . 0.0 110.342 -176.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -93.8 -16.34 24.23 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.799 172.052 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . 0.42 ' HD3' ' HA ' ' X' ' 28' ' ' TRP . 19.8 mtp85 -97.33 -66.07 0.92 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.213 0.53 . . . . 0.0 112.106 -177.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.438 HD11 ' HD2' ' X' ' 36' ' ' LYS . 2.6 tm? -46.92 -73.47 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 114.093 -1.412 . . . . 0.0 112.682 -172.135 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.67 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.8 mp -50.49 -51.94 42.74 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-O 121.027 0.441 . . . . 0.0 111.346 -174.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 15.0 mp0 -50.67 -38.55 47.19 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.69 -178.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 5.3 m -86.46 -6.77 58.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.986 0.422 . . . . 0.0 110.993 -177.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . 0.438 ' HD2' HD11 ' X' ' 32' ' ' LEU . 93.7 mttt -125.41 38.83 4.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.891 -177.485 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 10.1 p30 56.91 22.45 7.15 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.247 1.019 . . . . 0.0 113.061 178.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.67 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 15.1 m-85 72.34 73.25 0.15 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.608 0.763 . . . . 0.0 110.11 177.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . 0.442 ' O ' ' HB2' ' X' ' 43' ' ' ALA . 45.4 p-10 -115.11 142.92 45.99 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.558 0.694 . . . . 0.0 112.581 -177.32 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.488 ' O ' HD12 ' X' ' 44' ' ' LEU . 0.1 OUTLIER -91.54 -19.5 7.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.082 173.09 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.12 -39.42 97.61 Favored Glycine 0 CA--C 1.506 -0.526 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.598 -177.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . 0.435 ' O ' ' HB3' ' X' ' 45' ' ' ASP . . . -96.39 -10.36 27.8 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.47 -0.365 . . . . 0.0 110.642 176.627 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.515 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -73.69 -47.4 39.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.039 178.11 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.488 HD12 ' O ' ' X' ' 40' ' ' ILE . 10.7 mp -58.81 -33.55 70.5 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.72 0.295 . . . . 0.0 110.616 177.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . 0.435 ' HB3' ' O ' ' X' ' 42' ' ' ALA . 15.4 t0 -55.19 -45.78 75.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.197 175.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 1.2 p -86.13 -6.04 59.09 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 114.187 1.18 . . . . 0.0 114.187 -171.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.627 ' HB ' ' NE2' ' X' ' 48' ' ' GLN . 0.1 OUTLIER -109.58 -26.78 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-N 119.371 0.987 . . . . 0.0 112.893 178.685 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . 0.627 ' NE2' ' HB ' ' X' ' 47' ' ' ILE . 1.5 mp0 -155.59 -44.75 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.83 0.347 . . . . 0.0 111.54 -176.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 . . . . . 0 C--N 1.326 -0.413 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.29 -174.664 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.426 0 CA-C-O 121.498 0.666 . . . . 0.0 109.227 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . 0.444 ' H ' ' HB2' ' X' ' 10' ' ' LEU . 0.3 OUTLIER -85.83 155.48 58.6 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-N 114.823 -1.081 . . . . 0.0 109.24 -178.924 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.65 -14.31 30.63 Favored 'Trans proline' 0 CA--C 1.533 0.434 0 C-N-CA 121.144 1.229 . . . . 0.0 110.293 170.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 80.2 mtm180 -93.73 -30.67 14.76 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.245 175.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.444 ' HB2' ' H ' ' X' ' 7' ' ' ASP . 96.5 mt -98.44 -18.43 18.25 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -174.597 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.475 ' O ' ' HB3' ' X' ' 15' ' ' SER . 44.8 mm -68.35 -16.24 20.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 170.29 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . 0.553 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 38.2 tt0 -93.4 -54.79 3.54 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.253 174.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 22.8 t -94.49 -27.94 15.72 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -169.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.516 HD23 ' HG ' ' X' ' 18' ' ' LEU . 9.3 tt -94.5 -47.6 6.48 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.475 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 35.1 t -62.87 -28.82 70.3 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.094 -179.397 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . 0.553 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 0.0 OUTLIER -50.11 -43.08 51.51 Favored 'General case' 0 N--CA 1.463 0.186 0 O-C-N 123.507 0.505 . . . . 0.0 110.993 178.326 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.786 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 18.9 ptp -99.26 -30.46 12.23 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.736 -176.05 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . 0.516 ' HG ' HD23 ' X' ' 14' ' ' LEU . 3.1 mm? -65.44 -33.91 77.06 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -176.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 57.6 p -98.78 -12.16 21.16 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -178.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 12.3 tpt -88.04 -23.84 23.64 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.046 -178.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.93 44.93 0.72 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.621 179.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.786 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 4.0 m-85 -116.77 -174.26 2.54 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 176.36 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' X' X ' 23' ' ' SER . . . . . 0.457 ' O ' HG22 ' X' ' 47' ' ' ILE . 50.6 m -150.47 -161.03 1.25 Allowed 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.126 -0.63 . . . . 0.0 111.143 178.143 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.426 ' HA ' ' HE1' ' X' ' 28' ' ' TRP . 7.6 t70 -116.63 123.99 48.68 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 177.056 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -119.24 78.98 1.35 Allowed 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 120.829 0.347 . . . . 0.0 110.493 -177.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 124.74 -6.79 8.38 Favored Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.524 -0.846 . . . . 0.0 113.831 176.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.37 12.16 63.43 Favored Glycine 0 C--O 1.23 -0.13 0 C-N-CA 120.61 -0.805 . . . . 0.0 111.663 -177.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.705 ' HE3' ' HB3' ' X' ' 32' ' ' LEU . 31.2 p-90 -65.1 -34.52 78.6 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-N 115.127 -0.537 . . . . 0.0 111.572 -179.116 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . . . . . . . . . 51.8 tp -55.11 -22.5 16.78 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -165.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 51.2 p -94.66 -32.52 13.35 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.697 -0.627 . . . . 0.0 111.774 175.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . 0.425 ' CG ' ' HA ' ' X' ' 28' ' ' TRP . 31.8 ptt180 -94.22 -40.1 10.18 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -173.286 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.705 ' HB3' ' HE3' ' X' ' 28' ' ' TRP . 2.9 tm? -61.91 -56.27 21.04 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 123.401 0.68 . . . . 0.0 110.24 -178.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 10.5 mp -55.06 -50.4 69.21 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.504 177.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -47.35 -53.24 14.26 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.421 -177.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 19.7 m -73.62 -23.98 59.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.918 0.39 . . . . 0.0 110.966 -178.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . 0.494 ' HB3' ' HB3' ' X' ' 39' ' ' ASP . 14.7 mptt -95.33 33.67 1.54 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.515 178.27 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 15.0 p30 46.73 35.5 3.15 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.519 0.728 . . . . 0.0 112.446 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.417 ' CD1' HD22 ' X' ' 10' ' ' LEU . 72.3 m-85 66.94 69.9 0.39 Allowed 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.364 0.666 . . . . 0.0 110.038 -178.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . 0.587 ' O ' ' HB2' ' X' ' 43' ' ' ALA . 30.2 t70 -121.9 137.6 54.72 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.449 -173.272 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.602 ' O ' HD11 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.43 -8.5 10.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.735 173.096 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.85 -48.35 81.61 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.124 -177.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -93.48 -10.56 34.56 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.898 -0.651 . . . . 0.0 110.818 175.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.587 ' HB2' ' O ' ' X' ' 39' ' ' ASP . . . -68.29 -47.55 67.32 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.674 -179.245 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.602 HD11 ' O ' ' X' ' 40' ' ' ILE . 10.3 mp -71.57 -20.2 62.04 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.119 -178.408 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -70.45 -23.05 62.64 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.431 -178.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 33.0 p -95.3 -23.55 17.16 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -174.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.635 HD12 ' HD2' ' X' ' 22' ' ' PHE . 1.7 pt -102.8 -26.75 3.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -172.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.7 mt-30 -157.31 -53.36 0.07 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 118.351 0.523 . . . . 0.0 111.412 -176.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 . . . . . 0 C--N 1.322 -0.588 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 176.573 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.516 -0.362 0 CA-C-O 121.807 0.813 . . . . 0.0 109.987 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . 0.443 ' O ' HG22 ' X' ' 11' ' ' ILE . 13.3 t70 -94.28 149.47 36.78 Favored Pre-proline 0 C--N 1.315 -0.904 0 CA-C-N 114.606 -1.179 . . . . 0.0 108.237 -178.485 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . 0.738 ' O ' ' HB2' ' X' ' 12' ' ' GLU . 63.2 Cg_exo -48.28 -13.37 0.23 Allowed 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.022 2.482 . . . . 0.0 113.033 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . 0.439 ' HB3' ' CD1' ' X' ' 38' ' ' TYR . 10.4 mmt-85 -71.5 -48.81 46.61 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.394 173.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.705 HD22 HD12 ' X' ' 14' ' ' LEU . 24.3 mt -100.08 -41.16 7.26 Favored 'General case' 0 C--O 1.222 -0.366 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -178.2 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.606 ' O ' ' HB3' ' X' ' 15' ' ' SER . 11.2 tt -63.01 -22.3 30.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.1 0.476 . . . . 0.0 110.112 -179.057 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . 0.738 ' HB2' ' O ' ' X' ' 8' ' ' PRO . 0.4 OUTLIER -94.26 -59.58 1.92 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.809 172.378 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' X' X ' 13' ' ' SER . . . . . 0.439 ' HB2' ' O ' ' X' ' 9' ' ' ARG . 49.4 m -85.62 -25.72 26.48 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -169.24 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.705 HD12 HD22 ' X' ' 10' ' ' LEU . 10.4 tt -93.0 -40.7 10.4 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 178.637 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.606 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 32.1 t -68.08 -16.65 64.11 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.867 177.211 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . 0.523 ' O ' ' HB2' ' X' ' 20' ' ' MET . 0.0 OUTLIER -55.24 -45.4 76.04 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.067 0.461 . . . . 0.0 110.316 174.464 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.645 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 15.0 ptm -99.9 -20.29 16.21 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.668 -176.305 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . 0.405 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 46.0 tp -60.12 -49.34 78.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.772 0.32 . . . . 0.0 111.005 -179.459 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 16.0 p -98.86 9.26 43.83 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -178.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' X' X ' 20' ' ' MET . . . . . 0.523 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 27.4 ttt -91.43 -28.33 17.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.035 0.445 . . . . 0.0 111.022 -178.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.35 34.55 1.59 Allowed Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.572 -0.823 . . . . 0.0 111.179 -174.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.645 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 14.9 m-30 -117.83 -174.72 2.69 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 175.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 71.7 p -161.38 -163.35 0.99 Allowed 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 119.621 -0.832 . . . . 0.0 111.043 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.626 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 0.7 OUTLIER -112.64 115.18 28.17 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 166.882 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . 0.496 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 62.9 tt0 -51.65 -34.88 39.88 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.007 -175.607 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -124.16 -68.65 0.21 Allowed Glycine 0 C--N 1.318 -0.465 0 N-CA-C 111.24 -0.744 . . . . 0.0 111.24 173.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -176.31 29.97 0.08 OUTLIER Glycine 0 CA--C 1.508 -0.379 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 177.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.651 ' CZ2' HG22 ' X' ' 47' ' ' ILE . 45.7 p-90 -97.33 -9.73 26.95 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -172.281 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.626 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 12.5 tp -52.52 -25.71 11.07 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -169.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 30' ' ' THR . . . . . 0.461 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 32.1 p -84.44 -55.9 3.91 Favored 'General case' 0 C--N 1.322 -0.604 0 O-C-N 121.876 -0.515 . . . . 0.0 110.421 170.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.4 -51.9 50.63 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.785 -177.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.417 HD13 ' C ' ' X' ' 32' ' ' LEU . 3.0 tm? -51.26 -60.36 3.21 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 123.266 0.626 . . . . 0.0 111.114 -177.319 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.483 HD13 ' O ' ' X' ' 29' ' ' LEU . 8.8 mp -62.86 -44.83 95.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.134 -179.114 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . 0.461 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.8 OUTLIER -49.47 -47.06 48.68 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -178.45 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 4.7 m -80.8 -23.92 38.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.957 0.408 . . . . 0.0 111.25 -176.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -102.5 39.72 1.47 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -175.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . 0.405 ' O ' ' HB2' ' X' ' 38' ' ' TYR . 12.2 p30 50.4 29.32 3.81 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.728 0.811 . . . . 0.0 112.512 179.422 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.445 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 92.6 m-85 71.27 71.46 0.18 Allowed 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.825 177.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . 0.4 ' O ' ' HB3' ' X' ' 43' ' ' ALA . 36.0 t0 -114.52 130.16 56.72 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.891 -174.327 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.649 ' O ' HD11 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.92 -17.9 7.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.077 169.87 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.26 -34.78 90.28 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.219 179.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.82 -15.68 19.16 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.38 -0.41 . . . . 0.0 111.002 176.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' X' ' 39' ' ' ASP . . . -72.48 -38.94 68.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.939 0.4 . . . . 0.0 110.777 178.623 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.649 HD11 ' O ' ' X' ' 40' ' ' ILE . 9.0 mp -76.75 -18.3 58.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.486 178.2 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -69.29 -34.73 75.16 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.547 175.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 7.1 p -95.75 -6.04 40.65 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -174.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.651 HG22 ' CZ2' ' X' ' 28' ' ' TRP . 6.6 pt -100.2 -30.22 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 119.613 -0.835 . . . . 0.0 113.205 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . 0.56 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.9 mp0 -165.79 -48.01 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.256 0.55 . . . . 0.0 110.595 -177.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . 0.401 ' HD2' ' HB3' ' X' ' 44' ' ' LEU . 27.0 m-85 . . . . . 0 C--N 1.325 -0.495 0 CA-C-N 114.977 -1.01 . . . . 0.0 110.53 -172.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.228 0 CA-C-O 121.973 0.892 . . . . 0.0 108.841 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . 0.6 ' HB3' HD13 ' X' ' 10' ' ' LEU . 5.5 t70 -84.4 144.97 44.23 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 114.31 -1.313 . . . . 0.0 107.893 177.169 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -41.6 -26.77 0.42 Allowed 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 123.253 2.635 . . . . 0.0 113.764 -178.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . 0.52 ' HD2' ' CE2' ' X' ' 38' ' ' TYR . 83.9 mtm180 -83.45 -42.58 16.77 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 178.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.6 HD13 ' HB3' ' X' ' 7' ' ' ASP . 3.9 mp -97.28 -17.08 20.02 Favored 'General case' 0 C--O 1.216 -0.659 0 O-C-N 122.277 -0.264 . . . . 0.0 111.55 -174.65 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.548 ' O ' ' HB3' ' X' ' 15' ' ' SER . 10.5 tt -73.93 -12.95 15.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 170.484 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -93.81 -50.23 5.45 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 114.396 -1.275 . . . . 0.0 110.761 174.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' X' X ' 13' ' ' SER . . . . . 0.757 ' HA ' HG22 ' X' ' 40' ' ' ILE . 44.1 p -95.01 -34.09 12.47 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -171.236 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.532 ' HG ' HD13 ' X' ' 29' ' ' LEU . 6.4 tt -93.36 -44.54 8.23 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 -178.284 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.548 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 16.1 t -66.72 -21.72 66.07 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.924 -178.392 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 7.0 tm0? -56.54 -55.39 34.44 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.341 174.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.747 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 23.6 ptp -80.37 -26.91 38.36 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.926 -178.268 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 33.5 tp -64.83 -29.38 70.34 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.03 0.443 . . . . 0.0 110.613 178.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 14.1 t -94.64 -14.23 25.1 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.892 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 35.9 tpp -96.05 -32.22 12.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.154 -176.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.27 38.0 1.16 Allowed Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.706 -0.759 . . . . 0.0 111.876 -179.163 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.747 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 51.8 m-85 -136.05 160.88 37.29 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 50.7 m -151.6 -161.95 1.43 Allowed 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.148 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.949 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 11.3 p-10 -69.17 120.63 15.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.926 0.394 . . . . 0.0 109.997 173.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -102.64 58.25 0.79 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.447 0.641 . . . . 0.0 109.305 179.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 145.29 -8.1 1.63 Allowed Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.404 -176.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 96.82 15.48 39.5 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 121.193 -0.527 . . . . 0.0 111.847 -178.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.452 ' CH2' HG22 ' X' ' 47' ' ' ILE . 46.9 p-90 -95.7 -7.05 38.45 Favored 'General case' 0 C--O 1.221 -0.437 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -174.871 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.949 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 6.1 tp -59.06 -24.92 63.3 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.686 0.675 . . . . 0.0 111.11 -175.011 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 38.5 p -93.59 -40.2 10.41 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 121.853 -0.529 . . . . 0.0 110.855 170.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 15.8 mmm180 -60.61 -64.41 0.96 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.076 0.465 . . . . 0.0 111.339 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.522 HD13 ' C ' ' X' ' 32' ' ' LEU . 2.2 tm? -53.22 -60.46 3.26 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.903 -178.295 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 10.9 mp -54.08 -68.01 0.22 Allowed 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.352 -174.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -47.71 -46.46 29.67 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -176.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 23.4 m -66.89 -33.02 74.69 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.7 0.286 . . . . 0.0 111.616 -178.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . 0.525 ' O ' ' HB2' ' X' ' 39' ' ' ASP . 5.6 mptp? -95.43 26.44 3.86 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 178.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 39.0 t30 62.82 50.1 3.43 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 121.238 0.542 . . . . 0.0 110.832 179.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.52 ' CE2' ' HD2' ' X' ' 9' ' ' ARG . 92.0 m-85 48.23 53.91 11.09 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.862 -179.623 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . 0.525 ' HB2' ' O ' ' X' ' 36' ' ' LYS . 1.8 t0 -93.27 128.78 39.4 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.394 -173.086 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.757 HG22 ' HA ' ' X' ' 13' ' ' SER . 0.0 OUTLIER -89.61 -12.01 9.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.413 171.829 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.97 -36.51 93.16 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.603 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.02 -24.7 14.82 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.875 0.369 . . . . 0.0 110.988 177.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.569 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -64.84 -37.99 89.47 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.154 178.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.693 ' HA ' ' CG1' ' X' ' 47' ' ' ILE . 7.2 mp -68.28 -37.35 80.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.292 -178.319 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . 0.593 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.0 t70 -55.18 -37.32 66.91 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.832 0.349 . . . . 0.0 110.828 179.274 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 14.3 p -88.73 -29.05 20.11 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.693 ' CG1' ' HA ' ' X' ' 44' ' ' LEU . 24.6 pt -79.93 43.91 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 O-C-N 121.644 -0.66 . . . . 0.0 112.084 175.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 78.79 8.7 1.99 Allowed 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 172.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . 0.593 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 14.0 m-85 . . . . . 0 C--N 1.328 -0.362 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 170.97 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 -0.277 0 CA-C-O 121.179 0.514 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -86.0 145.91 41.94 Favored Pre-proline 0 C--N 1.32 -0.675 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 173.74 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -43.08 -26.79 0.83 Allowed 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.189 2.593 . . . . 0.0 113.191 -179.119 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . 0.496 ' HD3' ' CE1' ' X' ' 38' ' ' TYR . 69.1 mtt85 -80.03 -44.22 20.52 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.927 177.992 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.767 HD22 ' HB2' ' X' ' 14' ' ' LEU . 86.1 mt -98.07 -15.43 20.01 Favored 'General case' 0 C--O 1.217 -0.652 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -172.367 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.512 ' O ' ' HB2' ' X' ' 15' ' ' SER . 11.7 tt -71.8 -17.09 19.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 169.348 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 46.5 tp10 -94.46 -58.63 2.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.4 -1.273 . . . . 0.0 111.191 175.412 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' X' X ' 13' ' ' SER . . . . . 0.428 ' HA ' HG21 ' X' ' 40' ' ' ILE . 14.1 m -91.89 -22.66 19.95 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -170.251 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.767 ' HB2' HD22 ' X' ' 10' ' ' LEU . 53.4 tp -94.3 -48.03 6.35 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 177.679 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.512 ' HB2' ' O ' ' X' ' 11' ' ' ILE . 45.0 m -66.89 -18.87 65.59 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.689 -176.345 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . 0.446 ' OE1' HG23 ' X' ' 40' ' ' ILE . 5.0 tm0? -60.39 -49.19 78.55 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.161 0.505 . . . . 0.0 110.333 173.944 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.616 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 4.5 ppp? -91.31 -21.07 21.23 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.325 -177.04 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 28.6 tp -69.62 -39.56 77.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.835 -179.985 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 21.0 p -72.7 -41.95 64.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.637 -179.571 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 15.5 tpt -71.61 -29.53 64.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.475 -176.198 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.48 47.23 1.7 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.041 -1.076 . . . . 0.0 112.066 -178.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.616 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 31.5 m-85 -106.96 172.2 6.95 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 174.345 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 10.7 m -148.24 169.95 18.96 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 119.976 -0.69 . . . . 0.0 110.254 179.187 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.59 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 8.2 p-10 -71.24 140.92 50.58 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 170.98 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -116.35 65.85 0.71 Allowed 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.87 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 139.1 -3.56 2.78 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.662 -175.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 83.13 26.23 45.25 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.978 -179.575 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.567 ' HA ' ' HG3' ' X' ' 31' ' ' ARG . 55.0 p-90 -96.94 -17.93 19.79 Favored 'General case' 0 C--O 1.216 -0.683 0 CA-C-O 119.081 -0.485 . . . . 0.0 112.152 -176.353 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.59 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 35.3 tp -47.46 -45.55 26.01 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -168.303 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 30.2 p -69.05 -49.16 59.97 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.746 0.307 . . . . 0.0 110.878 176.017 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . 0.567 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 4.2 mtm180 -57.47 -60.59 3.42 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.617 -178.647 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.465 ' O ' ' HB2' ' X' ' 36' ' ' LYS . 2.1 tm? -48.67 -55.03 12.46 Favored 'General case' 0 C--O 1.23 0.079 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.25 -178.543 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 92.6 mt -59.88 -67.7 0.36 Allowed 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.751 -178.373 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -43.19 -56.15 3.58 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -175.166 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 32.3 p -67.12 -27.54 67.41 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -175.917 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . 0.465 ' HB2' ' O ' ' X' ' 32' ' ' LEU . 1.9 tttm -97.45 37.55 1.35 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.171 179.951 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 43.1 45.83 4.75 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.483 0.713 . . . . 0.0 112.119 -176.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.496 ' CE1' ' HD3' ' X' ' 9' ' ' ARG . 24.4 m-85 56.84 68.28 0.88 Allowed 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.987 178.924 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -106.92 122.53 46.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.1 -178.651 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.634 ' O ' HD12 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.85 -8.14 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.95 173.614 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.38 -43.0 97.73 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.214 177.666 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -94.45 -22.28 18.38 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.473 -0.364 . . . . 0.0 111.212 177.776 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.514 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -68.0 -38.83 83.1 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.792 178.741 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.955 HD13 HD12 ' X' ' 47' ' ' ILE . 6.9 mp -62.83 -33.26 74.86 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.654 -179.076 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . 0.461 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 18.9 t70 -53.15 -45.44 68.43 Favored 'General case' 0 C--N 1.33 -0.245 0 O-C-N 123.333 0.396 . . . . 0.0 111.468 178.272 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 3.2 p -96.45 -5.23 40.11 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 -176.124 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.955 HD12 HD13 ' X' ' 44' ' ' LEU . 23.6 pt -96.75 42.28 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 O-C-N 121.572 -0.705 . . . . 0.0 111.322 173.547 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 80.94 30.82 0.16 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.034 0.933 . . . . 0.0 112.634 174.453 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . 0.519 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 33.3 m-85 . . . . . 0 C--N 1.327 -0.402 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 170.49 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.452 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . 0.658 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 54.5 t0 -80.19 133.44 57.31 Favored Pre-proline 0 CA--C 1.506 -0.732 0 CA-C-N 113.693 -1.594 . . . . 0.0 107.521 177.916 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . 0.658 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 80.6 Cg_exo -40.56 -26.14 0.21 Allowed 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.908 2.405 . . . . 0.0 112.818 179.814 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 77.9 mtm180 -72.48 -53.03 13.26 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.41 175.263 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.471 ' HA ' ' HB3' ' X' ' 13' ' ' SER . 4.5 mp -95.72 -23.77 16.83 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -174.318 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.589 ' HA ' ' HB2' ' X' ' 15' ' ' SER . 0.0 OUTLIER -62.73 -28.01 44.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.76 0.79 . . . . 0.0 109.016 177.086 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . 0.424 ' N ' HG23 ' X' ' 11' ' ' ILE . 81.9 mt-10 -93.9 -22.09 18.83 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.576 174.937 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' X' X ' 13' ' ' SER . . . . . 0.471 ' HB3' ' HA ' ' X' ' 10' ' ' LEU . 29.7 t -98.56 -61.03 1.43 Allowed 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -175.824 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.442 HD21 ' HB2' ' X' ' 18' ' ' LEU . 8.3 tt -92.58 -40.26 10.88 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-O 121.074 0.464 . . . . 0.0 109.749 -174.09 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.589 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 23.2 m -66.5 -26.91 67.39 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.009 -176.031 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . 0.415 ' NE2' ' HB3' ' X' ' 17' ' ' MET . 5.3 pp0? -69.3 -30.22 68.25 Favored 'General case' 0 C--O 1.228 -0.067 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.046 -179.425 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.936 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 18.9 ptm -96.39 -32.95 12.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.25 -179.517 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . 0.442 ' HB2' HD21 ' X' ' 14' ' ' LEU . 61.1 tp -55.13 -43.65 74.33 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 123.427 0.454 . . . . 0.0 111.592 -178.215 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 16.3 p -98.93 9.74 42.86 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -177.157 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 35.0 ttp -111.22 -12.85 14.07 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.63 -176.413 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 115.19 19.82 5.77 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.336 -0.935 . . . . 0.0 112.398 179.604 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.936 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 28.0 m-85 -116.63 163.11 16.6 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 107.734 -1.209 . . . . 0.0 107.734 170.892 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 47.5 m -154.65 -138.01 0.07 Allowed 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 120.201 -0.599 . . . . 0.0 109.919 179.96 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.758 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 25.0 p-10 -110.75 116.29 31.03 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.238 0.542 . . . . 0.0 110.907 176.298 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . 0.79 ' HG3' ' HA ' ' X' ' 47' ' ' ILE . 1.9 mm-40 -83.76 54.18 2.8 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.218 0.532 . . . . 0.0 110.9 177.631 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 136.08 2.65 2.67 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.561 -179.188 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . 0.453 ' HA2' ' OD2' ' X' ' 24' ' ' ASP . . . 87.86 13.6 64.35 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.645 179.39 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.673 ' CH2' HG21 ' X' ' 47' ' ' ILE . 42.4 p-90 -85.49 -13.24 49.72 Favored 'General case' 0 C--O 1.217 -0.657 0 O-C-N 122.629 -0.336 . . . . 0.0 111.046 179.64 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.758 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 54.5 tp -56.06 -24.26 38.63 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.366 -175.723 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 53.2 p -93.86 -21.81 19.02 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.793 -0.185 . . . . 0.0 111.43 176.339 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . 0.63 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 0.2 OUTLIER -95.02 -56.36 2.77 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 120.568 0.223 . . . . 0.0 111.528 -177.339 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -44.97 -68.85 0.16 Allowed 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 124.046 0.938 . . . . 0.0 112.063 -174.507 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.76 ' HB2' ' HA ' ' X' ' 38' ' ' TYR . 0.9 OUTLIER -67.59 -25.61 65.85 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.873 -0.331 . . . . 0.0 111.785 -176.153 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . 0.462 ' N ' HD13 ' X' ' 33' ' ' LEU . 0.8 OUTLIER -63.7 -31.43 72.6 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 122.21 -0.307 . . . . 0.0 111.685 179.481 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 4.9 t -99.26 -10.77 21.97 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 122.229 -0.294 . . . . 0.0 111.701 -179.214 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -114.39 39.92 2.66 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -174.868 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 16.3 p30 50.29 34.84 9.45 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.666 0.786 . . . . 0.0 112.025 -178.129 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.76 ' HA ' ' HB2' ' X' ' 33' ' ' LEU . 68.8 m-85 64.69 69.39 0.5 Allowed 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.786 178.512 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . 0.587 ' O ' ' HB2' ' X' ' 43' ' ' ALA . 4.1 t70 -93.26 107.21 19.07 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 113.972 -1.467 . . . . 0.0 111.176 -172.698 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.615 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.5 OUTLIER -92.24 -4.07 10.75 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.432 172.671 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -74.64 -34.23 54.15 Favored Glycine 0 N--CA 1.441 -1.014 0 C-N-CA 120.003 -1.094 . . . . 0.0 111.027 175.391 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.73 -25.0 15.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.778 -0.711 . . . . 0.0 110.979 177.327 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.681 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -64.52 -42.72 95.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.234 179.859 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.615 HD13 ' O ' ' X' ' 40' ' ' ILE . 10.9 mp -67.03 -27.68 67.6 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.909 179.614 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -66.82 -58.01 5.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.193 174.798 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 21.2 p -61.9 -20.15 63.45 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 -174.064 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.79 ' HA ' ' HG3' ' X' ' 25' ' ' GLU . 1.8 pt -89.62 -30.05 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 C-N-CA 119.395 -0.922 . . . . 0.0 112.635 179.438 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . 0.648 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.5 mt-30 -163.28 -43.65 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 117.671 0.214 . . . . 0.0 111.542 -177.924 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 . . . . . 0 N--CA 1.464 0.253 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -172.737 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . 0.401 ' HA ' ' HB ' ' X' ' 11' ' ' ILE . . . . . . . . 0 CA--C 1.515 -0.377 0 CA-C-O 121.251 0.548 . . . . 0.0 110.038 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . 0.745 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 37.3 t0 -71.37 136.54 83.96 Favored Pre-proline 0 C--N 1.318 -0.77 0 N-CA-C 106.948 -1.501 . . . . 0.0 106.948 174.88 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . 0.745 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 78.5 Cg_exo -38.78 -28.48 0.14 Allowed 'Trans proline' 0 CA--C 1.534 0.507 0 C-N-CA 123.507 2.805 . . . . 0.0 113.186 -177.81 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 28.9 mmm180 -90.44 -50.55 5.89 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.958 176.15 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.881 HD22 ' HB2' ' X' ' 14' ' ' LEU . 96.0 mt -79.09 -15.22 58.48 Favored 'General case' 0 C--O 1.221 -0.446 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -173.284 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.54 ' O ' ' HB3' ' X' ' 15' ' ' SER . 11.8 tt -69.59 -25.92 29.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 174.033 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . 0.539 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 48.4 mt-10 -95.9 -45.91 6.76 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.531 174.307 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 20.4 m -89.67 -34.14 16.37 Favored 'General case' 0 C--O 1.222 -0.373 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -168.757 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.881 ' HB2' HD22 ' X' ' 10' ' ' LEU . 8.7 tt -95.94 -41.78 8.62 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.745 0.783 . . . . 0.0 109.017 -179.676 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.54 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 9.4 t -71.24 -16.08 62.47 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 114.73 -1.123 . . . . 0.0 111.243 -176.935 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . 0.539 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 3.8 tm0? -57.58 -58.77 6.84 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-O 120.786 0.327 . . . . 0.0 110.224 177.028 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.978 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 0.9 OUTLIER -82.91 -22.09 33.99 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.089 -179.298 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . 0.442 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 29.4 tp -66.41 -34.79 78.75 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.773 0.32 . . . . 0.0 110.775 -179.376 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 10.7 m -98.63 -36.16 9.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.546 -176.811 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 26.6 ttt -68.33 -31.81 71.48 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -176.209 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.79 46.58 0.6 Allowed Glycine 0 CA--C 1.508 -0.38 0 C-N-CA 119.938 -1.125 . . . . 0.0 113.196 178.617 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.978 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 8.9 m-30 -111.97 -174.48 2.47 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 170.758 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 49.9 m -144.66 -161.28 1.26 Allowed 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 119.7 -0.8 . . . . 0.0 111.401 -179.109 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.542 ' HA ' ' CD1' ' X' ' 28' ' ' TRP . 10.5 t0 -115.28 121.23 42.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.422 -177.946 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . 0.528 ' OE2' ' HB ' ' X' ' 46' ' ' THR . 4.5 pt-20 -61.61 -25.02 67.08 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -178.214 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 148.63 30.91 0.06 OUTLIER Glycine 0 CA--C 1.519 0.311 0 C-N-CA 120.351 -0.928 . . . . 0.0 113.665 178.948 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . 0.552 ' O ' ' HB3' ' X' ' 31' ' ' ARG . . . 126.21 33.91 0.65 Allowed Glycine 0 N--CA 1.446 -0.7 0 C-N-CA 121.026 -0.606 . . . . 0.0 111.674 178.742 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.597 ' HE3' ' HB3' ' X' ' 32' ' ' LEU . 8.5 p-90 -97.67 -39.97 8.82 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-O 120.666 0.269 . . . . 0.0 110.98 -178.263 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.642 HD11 HD13 ' X' ' 33' ' ' LEU . 46.1 tp -69.83 -19.15 63.47 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 121.767 -0.583 . . . . 0.0 110.986 -166.45 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 1.7 t -95.0 -31.01 13.82 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.992 170.796 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . 0.552 ' HB3' ' O ' ' X' ' 27' ' ' GLY . 40.8 ttt180 -96.36 -62.26 1.3 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -173.191 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.597 ' HB3' ' HE3' ' X' ' 28' ' ' TRP . 2.8 tm? -50.62 -63.25 1.18 Allowed 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.441 0.696 . . . . 0.0 111.563 -176.472 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.642 HD13 HD11 ' X' ' 29' ' ' LEU . 31.4 mt -45.77 -58.86 3.15 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.574 0.546 . . . . 0.0 111.739 -177.439 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -46.71 -58.78 3.53 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 123.83 0.707 . . . . 0.0 112.542 -178.947 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 60.9 p -62.5 -28.57 69.93 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.547 -176.889 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . 0.488 ' HB3' ' HB2' ' X' ' 39' ' ' ASP . 5.4 mptp? -94.63 39.3 1.1 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.548 176.606 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 31.82 53.12 0.24 Allowed 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.862 1.265 . . . . 0.0 113.744 -174.358 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 60.0 56.11 3.53 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.276 178.142 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . 0.488 ' HB2' ' HB3' ' X' ' 36' ' ' LYS . 24.5 m-20 -107.14 128.01 54.02 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.277 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.701 ' HA ' ' HB2' ' X' ' 43' ' ' ALA . 0.1 OUTLIER -84.36 -3.13 7.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.732 169.239 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -69.67 -36.44 75.62 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.289 179.248 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.11 -12.49 20.45 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.951 0.405 . . . . 0.0 110.214 175.088 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.701 ' HB2' ' HA ' ' X' ' 40' ' ' ILE . . . -57.2 -53.22 60.52 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.821 -179.666 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.5 ' HG ' ' HE2' ' X' ' 22' ' ' PHE . 10.2 mp -61.35 -38.77 88.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.619 -179.258 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -52.16 -46.05 65.3 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.252 -179.654 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' X' X ' 46' ' ' THR . . . . . 0.593 HG23 ' HG ' ' X' ' 32' ' ' LEU . 36.7 p -78.12 -35.11 49.53 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -171.44 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.541 HG12 ' O ' ' X' ' 43' ' ' ALA . 6.7 pt -96.25 -25.19 4.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 -168.999 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . 0.448 HE21 ' HB2' ' X' ' 48' ' ' GLN . 0.0 OUTLIER -153.64 -26.68 0.14 Allowed 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -178.207 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 . . . . . 0 C--N 1.324 -0.523 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -178.284 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.468 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 -70.38 155.49 93.35 Favored Pre-proline 0 CA--C 1.507 -0.703 0 CA-C-N 114.605 -1.18 . . . . 0.0 109.179 179.564 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -53.0 -18.37 9.45 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 122.134 1.889 . . . . 0.0 111.438 172.086 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 15.1 mmm180 -93.71 -35.82 12.61 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.353 179.744 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.613 HD21 ' HG ' ' X' ' 14' ' ' LEU . 63.9 mt -98.26 -25.33 14.9 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.792 -171.671 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.526 ' HA ' ' HB2' ' X' ' 15' ' ' SER . 10.6 tt -70.48 -14.53 18.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 171.032 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -96.58 -52.29 4.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.673 -1.148 . . . . 0.0 111.2 175.341 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 7.7 t -94.46 -32.71 13.4 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -168.963 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.613 ' HG ' HD21 ' X' ' 10' ' ' LEU . 32.3 mt -92.51 -39.16 11.54 Favored 'General case' 0 CA--C 1.506 -0.721 0 O-C-N 121.556 -0.715 . . . . 0.0 109.63 178.481 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.526 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 8.2 t -63.3 -22.31 66.8 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.519 -175.905 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . 0.404 HE21 ' HG3' ' X' ' 17' ' ' MET . 3.7 pp0? -72.73 -29.17 63.13 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 120.411 -0.516 . . . . 0.0 109.997 176.919 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.445 ' HE1' HG12 ' X' ' 47' ' ' ILE . 26.2 mtt -72.21 -40.13 68.06 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.325 171.886 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . 0.429 HD13 ' O ' ' X' ' 14' ' ' LEU . 11.1 mp -68.43 -14.13 62.79 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.453 178.911 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 2.8 t -98.92 -40.98 7.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.934 -178.389 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 83.8 mtp -83.92 -32.4 25.13 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -176.986 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.32 46.91 0.67 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.384 -0.912 . . . . 0.0 112.396 -179.548 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -117.14 160.94 20.23 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 174.134 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 13.8 m -140.9 -136.71 0.11 Allowed 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 120.196 -0.602 . . . . 0.0 110.145 -179.659 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.537 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 7.9 p-10 -121.77 122.3 39.2 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.164 173.001 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . 0.715 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 40.1 tt0 -67.68 -48.02 67.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.36 0.6 . . . . 0.0 110.377 -179.325 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -129.02 19.88 5.43 Favored Glycine 0 C--N 1.32 -0.326 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.992 -178.838 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 87.93 4.87 78.16 Favored Glycine 0 C--O 1.228 -0.256 0 C-N-CA 120.539 -0.839 . . . . 0.0 112.688 178.462 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.715 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 36.3 p-90 -75.04 -9.16 58.28 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -178.985 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.537 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 59.0 tp -53.85 -23.56 12.85 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 -171.316 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' X' X ' 30' ' ' THR . . . . . 0.633 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 43.9 p -84.59 -63.82 1.27 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.646 170.79 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . 0.573 ' CG ' ' HA ' ' X' ' 28' ' ' TRP . 12.1 ptm180 -57.07 -45.72 83.05 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -175.434 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.624 HD12 HD13 ' X' ' 33' ' ' LEU . 3.2 tm? -53.23 -64.4 0.83 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.782 0.325 . . . . 0.0 110.653 -178.347 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.624 HD13 HD12 ' X' ' 32' ' ' LEU . 6.7 mp -65.76 -43.69 88.11 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.891 -175.671 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . 0.633 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.0 OUTLIER -54.81 -38.92 67.94 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -178.293 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 19.3 m -85.05 -12.31 53.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.304 0.574 . . . . 0.0 110.892 -178.681 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . 0.586 ' HD2' HD11 ' X' ' 32' ' ' LEU . 90.7 mttt -112.37 37.9 2.89 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.354 179.768 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 43.37 40.62 2.72 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.648 0.779 . . . . 0.0 112.733 -178.345 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.527 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 64.4 m-85 64.04 67.89 0.59 Allowed 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.688 177.771 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . 0.571 ' O ' ' HB2' ' X' ' 43' ' ' ALA . 42.9 t0 -105.67 120.1 40.81 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.13 -176.443 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.688 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -91.26 -9.54 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 CA-C-O 121.033 0.444 . . . . 0.0 110.198 170.771 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.23 -34.65 81.14 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.394 -0.907 . . . . 0.0 111.517 176.978 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.27 -14.86 19.07 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.947 -0.626 . . . . 0.0 110.987 176.062 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.571 ' HB2' ' O ' ' X' ' 39' ' ' ASP . . . -75.84 -33.57 60.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.242 -179.16 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.688 HD13 ' O ' ' X' ' 40' ' ' ILE . 10.9 mp -72.89 -23.56 60.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.946 0.403 . . . . 0.0 110.053 177.359 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -68.62 -29.07 67.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.009 174.981 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 13.3 p -96.84 -14.96 21.51 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 -172.669 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.701 HG21 ' CH2' ' X' ' 28' ' ' TRP . 1.2 pp -97.84 -28.77 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 119.715 1.143 . . . . 0.0 113.104 -179.41 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . 0.498 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 2.0 mp0 -161.19 -59.35 0.05 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.014 0.435 . . . . 0.0 110.573 179.853 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.919 -175.668 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.215 0 CA-C-O 121.63 0.729 . . . . 0.0 109.929 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -91.44 147.29 35.05 Favored Pre-proline 0 C--N 1.317 -0.812 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 179.211 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . 0.5 ' HA ' HG22 ' X' ' 11' ' ' ILE . 79.0 Cg_exo -42.07 -23.77 0.27 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.115 2.543 . . . . 0.0 113.169 179.824 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . 0.429 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 63.5 mtp180 -64.53 -55.59 19.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.946 173.792 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.441 ' HA ' ' OG ' ' X' ' 13' ' ' SER . 5.1 mp -99.41 -26.26 14.19 Favored 'General case' 0 C--O 1.22 -0.465 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -176.739 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.541 ' HA ' ' CB ' ' X' ' 15' ' ' SER . 11.6 tt -64.64 -21.23 28.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.337 0.589 . . . . 0.0 109.467 178.751 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -93.63 -33.82 13.54 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.041 175.683 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' X' X ' 13' ' ' SER . . . . . 0.471 ' HA ' HG22 ' X' ' 40' ' ' ILE . 56.6 p -96.54 -48.62 5.47 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -173.402 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.431 ' HG ' HD11 ' X' ' 29' ' ' LEU . 8.2 tt -93.49 -42.18 9.38 Favored 'General case' 0 CA--C 1.507 -0.706 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -175.798 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.541 ' CB ' ' HA ' ' X' ' 11' ' ' ILE . 7.3 t -69.78 -22.69 63.32 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.754 -178.497 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . 0.532 ' OE1' HG21 ' X' ' 40' ' ' ILE . 4.5 tm0? -56.33 -59.95 4.22 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.21 0.529 . . . . 0.0 109.993 173.694 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.737 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 11.8 ptm -77.09 -22.52 52.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.457 -176.303 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 20.8 tp -68.4 -39.42 81.68 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.912 0.387 . . . . 0.0 110.382 176.715 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 15.7 t -83.69 -31.35 26.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.186 -179.603 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 37.9 tpp -69.26 -29.23 67.09 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.886 0.374 . . . . 0.0 111.249 -177.259 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.21 38.48 1.23 Allowed Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.339 -0.934 . . . . 0.0 112.15 -178.858 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.737 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 14.2 m-30 -117.4 -173.61 2.45 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 176.595 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 60.2 m -159.28 -135.28 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 176.63 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.603 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.2 p30 -121.67 133.75 54.97 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.854 0.359 . . . . 0.0 110.036 171.804 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . 0.444 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 21.7 tt0 -87.37 48.47 1.65 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.043 0.449 . . . . 0.0 110.038 178.233 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 148.97 -8.21 0.93 Allowed Glycine 0 CA--C 1.518 0.278 0 C-N-CA 120.281 -0.961 . . . . 0.0 113.646 179.849 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 101.05 15.54 28.08 Favored Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.008 -179.126 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.671 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 43.2 p-90 -91.67 -5.11 54.35 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -176.438 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.603 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 28.4 tp -56.83 -34.14 67.46 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.543 -172.293 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 70.5 p -89.32 -10.54 46.38 Favored 'General case' 0 C--N 1.321 -0.637 0 O-C-N 122.164 -0.335 . . . . 0.0 111.293 176.491 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . 0.446 ' HG2' ' HA ' ' X' ' 28' ' ' TRP . 22.6 mmm-85 -94.89 -53.04 3.99 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.021 0.439 . . . . 0.0 111.241 -177.545 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.404 HD22 ' HD3' ' X' ' 36' ' ' LYS . 3.2 tm? -54.71 -67.21 0.29 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.656 -177.727 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.549 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.8 mp -54.88 -52.45 62.8 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.531 -177.299 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -41.78 -60.0 1.5 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -177.743 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 2.9 m -66.59 -31.3 71.92 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.242 -176.622 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . 0.583 ' HE3' ' OD2' ' X' ' 39' ' ' ASP . 24.4 mtpp -96.56 39.38 1.16 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.968 -176.433 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 45.96 39.95 6.24 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.209 1.003 . . . . 0.0 113.086 179.859 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.549 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 43.5 m-85 59.89 74.12 0.46 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.599 175.69 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . 0.583 ' OD2' ' HE3' ' X' ' 36' ' ' LYS . 41.4 p-10 -112.45 138.91 48.52 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.756 0.789 . . . . 0.0 112.437 178.763 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.532 HG21 ' OE1' ' X' ' 16' ' ' GLN . 0.0 OUTLIER -90.46 -13.42 9.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.084 175.025 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.5 -50.91 61.63 Favored Glycine 0 N--CA 1.444 -0.813 0 CA-C-N 115.517 -0.765 . . . . 0.0 112.511 -176.774 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -88.5 -16.97 31.32 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.216 -0.492 . . . . 0.0 111.137 178.054 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.429 ' HB2' ' O ' ' X' ' 39' ' ' ASP . . . -67.66 -46.24 72.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.388 -179.781 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.495 ' O ' HD11 ' X' ' 47' ' ' ILE . 37.5 mt -72.11 -25.54 61.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.985 0.421 . . . . 0.0 110.524 -179.189 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . 0.645 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 9.6 t70 -61.64 -36.86 82.0 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.729 178.507 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 10.7 p -96.03 -3.71 44.38 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 -172.486 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.671 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 1.5 pp -99.78 -27.36 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 C-N-CA 118.379 -1.328 . . . . 0.0 112.614 -177.942 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . 0.46 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 2.5 mp0 -158.74 -58.32 0.07 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.753 0.311 . . . . 0.0 110.801 178.701 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . 0.645 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 1.3 p90 . . . . . 0 C--N 1.326 -0.453 0 CA-C-O 121.055 0.455 . . . . 0.0 112.226 -175.303 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.516 -0.338 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . 0.573 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 39.2 t70 -107.22 149.72 39.04 Favored Pre-proline 0 C--N 1.315 -0.906 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 -177.88 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . 0.573 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 72.2 Cg_exo -47.4 -22.24 2.51 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 122.167 1.911 . . . . 0.0 112.5 179.58 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . 0.708 ' HB3' ' HB2' ' X' ' 38' ' ' TYR . 66.1 mtt85 -87.1 -28.82 22.3 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.272 178.185 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.834 HD22 ' HB2' ' X' ' 14' ' ' LEU . 95.7 mt -97.78 -27.58 14.25 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 122.218 -0.301 . . . . 0.0 110.696 -175.569 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.45 ' O ' ' HB3' ' X' ' 15' ' ' SER . 61.1 mt -61.88 -25.37 37.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 174.518 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . 0.543 ' HG3' ' H ' ' X' ' 13' ' ' SER . 6.3 pt-20 -96.39 -58.75 1.99 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.828 171.494 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 13' ' ' SER . . . . . 0.543 ' H ' ' HG3' ' X' ' 12' ' ' GLU . 30.8 m -81.18 -26.73 35.78 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -168.275 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.834 ' HB2' HD22 ' X' ' 10' ' ' LEU . 30.6 tp -93.13 -40.29 10.57 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.169 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.45 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 24.4 t -65.16 -26.33 68.12 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.825 -177.762 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 4.6 pp0? -74.35 -26.96 60.45 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.461 -179.211 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.777 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 20.8 ptm -93.73 -28.1 16.13 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.614 177.878 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . 0.655 HD11 ' HG ' ' X' ' 14' ' ' LEU . 4.2 mp -66.89 -35.63 80.45 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.176 179.374 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 22.4 p -87.49 -27.62 22.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.62 -0.263 . . . . 0.0 111.648 -179.263 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 46.9 tpp -80.84 -32.57 35.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.578 -176.163 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 106.35 47.83 1.03 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.047 -1.073 . . . . 0.0 112.178 -179.4 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.777 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 20.3 m-30 -108.92 168.28 9.47 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 108.083 -1.081 . . . . 0.0 108.083 176.454 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 23' ' ' SER . . . . . 0.538 ' H ' HE22 ' X' ' 48' ' ' GLN . 20.3 m -146.33 -179.33 6.67 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 119.895 -0.722 . . . . 0.0 110.832 179.45 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -77.95 132.3 37.81 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 172.125 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . 0.859 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 50.2 tt0 -76.76 -16.12 59.57 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.331 -0.548 . . . . 0.0 110.035 179.916 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -159.77 -80.11 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 111.505 -0.638 . . . . 0.0 111.505 176.637 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -162.12 32.63 0.33 Allowed Glycine 0 CA--C 1.508 -0.379 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 175.516 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.859 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 56.9 p-90 -98.37 -16.23 19.39 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -175.325 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.613 HD13 ' SD ' ' X' ' 17' ' ' MET . 60.0 tp -51.16 -48.67 61.83 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -164.762 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 30' ' ' THR . . . . . 0.522 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 40.8 p -75.86 -10.85 59.77 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.823 -0.548 . . . . 0.0 111.536 178.421 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 30.9 ttt180 -94.6 -54.87 3.34 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.37 0.268 . . . . 0.0 111.677 -179.688 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -52.47 -49.9 63.76 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.385 0.674 . . . . 0.0 110.4 179.671 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.9 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 73.1 mt -62.59 -53.68 50.99 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.564 179.25 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . 0.522 ' HB2' ' O ' ' X' ' 30' ' ' THR . 2.4 tp-100 -39.29 -56.81 1.47 Allowed 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.99 1.107 . . . . 0.0 113.99 -174.958 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 34.7 p -65.81 -17.12 64.41 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -174.859 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . 0.427 ' O ' ' HB3' ' X' ' 37' ' ' ASN . 50.9 mttm -114.33 30.32 7.38 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -176.568 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . 0.427 ' HB3' ' O ' ' X' ' 36' ' ' LYS . 32.2 t30 65.71 28.12 11.13 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.463 0.649 . . . . 0.0 110.311 179.438 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.9 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 50.1 m-85 60.8 68.25 0.76 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.525 -173.205 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . 0.476 ' O ' ' HB3' ' X' ' 43' ' ' ALA . 31.5 t70 -103.35 133.01 49.13 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.565 -174.362 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.648 ' HB ' HD12 ' X' ' 44' ' ' LEU . 0.1 OUTLIER -90.21 -3.99 10.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.136 175.805 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.41 -41.18 99.78 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 120.32 -0.943 . . . . 0.0 111.815 179.201 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -100.47 -14.88 18.09 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.949 -0.626 . . . . 0.0 111.015 175.391 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.665 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -72.26 -41.03 67.21 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.591 178.569 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.648 HD12 ' HB ' ' X' ' 40' ' ' ILE . 6.4 mp -56.06 -32.11 63.79 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 123.537 0.523 . . . . 0.0 111.202 179.794 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -51.76 -48.35 63.76 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.093 176.206 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 16.9 p -96.08 -20.15 18.88 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -175.453 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.665 HG12 ' O ' ' X' ' 43' ' ' ALA . 7.2 pt -83.78 43.67 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 O-C-N 121.607 -0.683 . . . . 0.0 112.025 177.729 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . 0.538 HE22 ' H ' ' X' ' 23' ' ' SER . 2.4 mp0 82.14 34.07 0.08 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.347 1.059 . . . . 0.0 112.874 173.158 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 . . . . . 0 C--N 1.327 -0.373 0 CA-C-O 121.227 0.537 . . . . 0.0 110.768 173.307 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.289 0 CA-C-O 121.418 0.628 . . . . 0.0 109.731 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . 0.521 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 35.8 t70 -77.31 148.11 77.09 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 114.932 -1.031 . . . . 0.0 108.284 177.975 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . 0.521 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 86.4 Cg_exo -41.54 -34.97 2.26 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.645 2.23 . . . . 0.0 112.33 179.312 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 31.1 mmt-85 -77.97 -56.17 4.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.587 174.83 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.573 HD21 ' HB2' ' X' ' 14' ' ' LEU . 77.4 mt -73.0 -29.78 63.28 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-N 115.348 -0.842 . . . . 0.0 112.604 -169.034 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.497 ' O ' ' HB2' ' X' ' 15' ' ' SER . 12.1 tt -64.25 -20.82 27.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.656 0.741 . . . . 0.0 109.613 175.476 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . 0.442 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 40.1 tt0 -96.26 -58.48 2.06 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.388 175.246 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 16.4 t -91.93 -23.19 19.68 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -168.56 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.573 ' HB2' HD21 ' X' ' 10' ' ' LEU . 16.1 tp -92.18 -45.72 8.11 Favored 'General case' 0 CA--C 1.504 -0.802 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 177.145 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.549 ' HA ' ' HB2' ' X' ' 18' ' ' LEU . 48.8 m -64.97 -18.38 65.22 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.158 178.017 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . 0.6 HE21 ' HG2' ' X' ' 17' ' ' MET . 0.0 OUTLIER -57.44 -42.07 81.7 Favored 'General case' 0 CA--C 1.521 -0.151 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 173.276 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.6 ' HG2' HE21 ' X' ' 16' ' ' GLN . 1.9 mtp -86.98 -35.7 18.69 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.722 -176.957 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . 0.549 ' HB2' ' HA ' ' X' ' 15' ' ' SER . 3.8 mm? -62.38 -44.98 95.19 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.667 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 50.6 p -86.92 -24.55 24.78 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 -175.023 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 51.0 ttm -78.77 -32.26 46.47 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.755 0.312 . . . . 0.0 110.88 -177.674 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 112.75 47.45 0.67 Allowed Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.215 -0.993 . . . . 0.0 112.081 -179.506 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.484 ' HB2' ' HB3' ' X' ' 17' ' ' MET . 12.6 m-30 -114.7 163.83 14.9 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 176.341 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 72.0 m -150.1 150.46 31.72 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.499 -179.855 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.647 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 0.6 OUTLIER -71.07 129.05 37.97 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.389 0.614 . . . . 0.0 111.688 178.869 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . 0.751 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 30.8 tt0 -56.76 -30.04 63.2 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.71 178.581 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -146.3 -19.22 0.13 Allowed Glycine 0 CA--C 1.521 0.448 0 C-N-CA 120.351 -0.928 . . . . 0.0 114.113 -178.389 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.72 27.15 1.07 Allowed Glycine 0 C--O 1.228 -0.234 0 C-N-CA 120.409 -0.901 . . . . 0.0 112.224 -177.781 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.751 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 38.8 p-90 -96.36 -4.62 41.63 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 123.127 0.571 . . . . 0.0 111.57 -178.472 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.647 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 63.5 tp -47.87 -32.65 6.47 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -167.885 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 60.8 p -90.36 -40.13 12.28 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 121.917 -0.489 . . . . 0.0 111.432 175.365 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . 0.653 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -72.98 -37.27 67.1 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -173.628 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.457 ' HA ' HD21 ' X' ' 32' ' ' LEU . 3.5 tm? -61.99 -55.51 28.61 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.132 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.571 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 10.5 mp -56.6 -50.39 72.1 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.643 178.125 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -48.55 -44.43 36.48 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -179.696 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 8.6 m -72.67 -37.44 67.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.921 0.391 . . . . 0.0 110.845 179.707 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . 0.441 ' O ' ' HB2' ' X' ' 39' ' ' ASP . 5.1 mptp? -90.98 37.3 0.92 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.492 179.509 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 41.91 53.88 4.06 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.669 0.788 . . . . 0.0 112.667 -178.187 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.571 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 34.6 m-85 54.72 62.91 2.33 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.374 178.009 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' X' ' 36' ' ' LYS . 32.4 t0 -118.05 134.27 55.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.917 -176.053 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.589 ' HB ' HD11 ' X' ' 44' ' ' LEU . 0.1 OUTLIER -89.72 -7.53 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.271 170.601 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.4 -35.02 90.38 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.306 -179.731 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -100.03 -22.16 15.34 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.527 -0.336 . . . . 0.0 110.606 175.285 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.648 ' O ' HG13 ' X' ' 47' ' ' ILE . . . -68.25 -37.66 81.01 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.328 -179.924 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.589 HD11 ' HB ' ' X' ' 40' ' ' ILE . 9.2 mp -68.75 -17.84 64.11 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.735 0.302 . . . . 0.0 111.173 179.162 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -83.92 -29.99 26.69 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.96 0.41 . . . . 0.0 110.463 176.667 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 15.2 p -96.01 -21.69 17.84 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -172.29 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.648 HG13 ' O ' ' X' ' 43' ' ' ALA . 1.1 pp -67.16 -26.12 35.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 119.525 -0.87 . . . . 0.0 111.476 -173.955 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . 0.619 ' HB3' ' O ' ' X' ' 47' ' ' ILE . 0.1 OUTLIER 153.95 -5.66 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.682 1.193 . . . . 0.0 110.374 169.739 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 11.3 m-30 . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.305 174.081 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.444 0 CA-C-O 121.374 0.607 . . . . 0.0 109.568 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . 0.512 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 38.7 t70 -81.36 143.56 52.1 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 179.085 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . 0.512 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 82.9 Cg_exo -42.53 -30.92 1.73 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.662 2.242 . . . . 0.0 112.562 179.295 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . 0.475 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 39.3 mmt180 -87.76 -52.07 5.51 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.021 177.324 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.406 ' HA ' ' HB2' ' X' ' 13' ' ' SER . 91.8 mt -81.54 -14.08 57.31 Favored 'General case' 0 C--O 1.216 -0.697 0 CA-C-N 116.0 -0.546 . . . . 0.0 112.446 -171.404 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.507 ' HA ' ' HB2' ' X' ' 15' ' ' SER . 13.9 tt -66.05 -24.76 34.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.4 0.619 . . . . 0.0 109.604 175.873 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -94.47 -28.86 15.24 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.963 174.528 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' X' X ' 13' ' ' SER . . . . . 0.406 ' HB2' ' HA ' ' X' ' 10' ' ' LEU . 16.3 m -96.21 -54.33 3.33 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -171.132 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.525 ' HG ' HD21 ' X' ' 29' ' ' LEU . 9.9 tt -94.81 -46.74 6.76 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 -176.429 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.507 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 14.4 m -63.2 -25.53 68.38 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.178 -177.991 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 2.5 tm0? -61.37 -47.68 84.74 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.029 0.442 . . . . 0.0 109.901 174.703 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.659 ' HE1' ' HB3' ' X' ' 43' ' ' ALA . 42.1 mtt -77.74 -39.8 43.13 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.046 -177.473 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 35.6 tp -64.47 -37.77 88.69 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.235 -177.723 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 3.7 t -85.7 -22.23 27.93 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.628 0.251 . . . . 0.0 110.932 -178.633 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 15.4 tpt -78.01 -32.42 51.1 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.925 0.393 . . . . 0.0 110.887 -178.733 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.6 34.53 1.55 Allowed Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.836 -177.89 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.494 ' CD2' HD12 ' X' ' 47' ' ' ILE . 14.8 m-30 -110.33 -177.31 3.21 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 174.284 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -151.13 -178.33 6.56 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.113 178.54 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -94.35 144.16 25.78 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 173.973 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . 0.453 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 29.4 tt0 -107.5 57.3 0.63 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.151 0.5 . . . . 0.0 110.189 179.65 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.38 -29.31 2.29 Favored Glycine 0 CA--C 1.517 0.191 0 C-N-CA 120.65 -0.786 . . . . 0.0 113.076 179.407 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 120.03 16.16 4.95 Favored Glycine 0 CA--C 1.506 -0.528 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 -177.931 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.871 ' HB2' ' HB2' ' X' ' 32' ' ' LEU . 60.9 p-90 -84.97 -11.85 54.59 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.132 -0.534 . . . . 0.0 111.347 -177.91 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.537 ' O ' HD11 ' X' ' 33' ' ' LEU . 30.7 tp -66.17 -19.59 65.88 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.393 -0.817 . . . . 0.0 110.018 -176.914 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' X' X ' 30' ' ' THR . . . . . 0.46 ' O ' ' HG3' ' X' ' 34' ' ' GLN . 0.1 OUTLIER -95.74 -31.54 13.16 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.921 167.814 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . 0.718 ' HB3' ' HA ' ' X' ' 28' ' ' TRP . 50.0 ttt-85 -87.27 -65.88 0.97 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 -174.256 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.871 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 3.3 tm? -41.67 -59.83 1.53 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.022 0.929 . . . . 0.0 111.39 179.307 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.537 HD11 ' O ' ' X' ' 29' ' ' LEU . 65.9 mt -47.36 -68.88 0.15 Allowed 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.281 -175.754 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . 0.46 ' HG3' ' O ' ' X' ' 30' ' ' THR . 5.3 mt-30 -57.4 -27.37 62.28 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -171.531 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 15.4 m -71.96 -21.74 61.55 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.952 0.406 . . . . 0.0 111.034 179.22 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 18.5 mtpp -121.28 37.38 4.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.953 -175.661 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 50.6 t30 63.72 39.03 8.9 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.377 0.608 . . . . 0.0 110.737 178.818 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.475 ' CD2' ' HB3' ' X' ' 9' ' ' ARG . 11.4 m-85 55.57 66.35 1.24 Allowed 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.425 -176.784 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . 0.523 ' O ' ' HB1' ' X' ' 43' ' ' ALA . 17.8 t70 -88.86 124.59 34.34 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.034 -0.984 . . . . 0.0 112.177 -169.499 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.693 ' O ' HD12 ' X' ' 44' ' ' LEU . 1.5 mm -89.7 -24.32 5.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.131 175.838 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.19 -33.08 84.14 Favored Glycine 0 N--CA 1.441 -1.027 0 CA-C-N 115.264 -0.88 . . . . 0.0 112.762 -177.701 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -100.16 -21.88 15.38 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.873 0.368 . . . . 0.0 111.387 -178.632 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.659 ' HB3' ' HE1' ' X' ' 17' ' ' MET . . . -70.89 -32.66 69.7 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.655 178.557 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.905 HD13 HD13 ' X' ' 47' ' ' ILE . 6.3 mp -64.65 -35.25 80.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.757 -178.99 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -52.83 -38.92 61.98 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.174 0.296 . . . . 0.0 111.683 179.779 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 2.0 p -96.07 -22.15 17.52 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -176.95 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.905 HD13 HD13 ' X' ' 44' ' ' LEU . 16.8 pt -83.34 42.64 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-N 118.478 0.581 . . . . 0.0 112.145 176.915 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 74.74 13.51 3.5 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.359 0.664 . . . . 0.0 112.383 173.912 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 . . . . . 0 N--CA 1.468 0.44 0 CA-C-O 120.655 0.264 . . . . 0.0 110.501 176.161 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.077 0 CA-C-O 121.152 0.501 . . . . 0.0 110.073 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . 0.463 ' O ' HG23 ' X' ' 11' ' ' ILE . 57.6 p30 -83.67 156.18 65.05 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.252 179.465 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -47.19 -14.6 0.19 Allowed 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.07 2.513 . . . . 0.0 114.244 -176.064 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 68.8 mtm180 -94.37 -42.71 8.75 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 111.987 0.365 . . . . 0.0 111.987 179.506 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.425 HD23 ' HB2' ' X' ' 14' ' ' LEU . 53.1 mt -97.64 -26.08 14.89 Favored 'General case' 0 C--O 1.221 -0.446 0 O-C-N 122.213 -0.305 . . . . 0.0 111.458 -177.153 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.626 ' O ' ' HB3' ' X' ' 15' ' ' SER . 7.8 tt -70.68 -15.2 18.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 169.536 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -93.73 -59.06 2.08 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.33 174.267 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 36.7 m -82.91 -33.86 26.76 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.315 0.857 . . . . 0.0 113.315 -172.411 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.505 HD21 HD23 ' X' ' 18' ' ' LEU . 9.4 tt -93.92 -39.25 10.78 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-O 121.393 0.616 . . . . 0.0 109.444 -177.421 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.626 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 6.4 t -73.67 -21.21 60.33 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.374 -176.667 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . 0.569 HE21 ' CG ' ' X' ' 17' ' ' MET . 2.4 pp0? -69.61 -26.16 64.3 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 120.134 -0.627 . . . . 0.0 109.311 173.863 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.569 ' CG ' HE21 ' X' ' 16' ' ' GLN . 77.4 mtp -73.28 -46.35 50.36 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.649 175.642 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . 0.505 HD23 HD21 ' X' ' 14' ' ' LEU . 4.3 mm? -63.32 -41.87 98.94 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.889 179.19 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 16.1 m -70.05 -17.25 63.24 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -178.936 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 30.4 ttm -101.84 -30.23 11.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.864 0.364 . . . . 0.0 111.136 -176.41 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.48 45.74 0.65 Allowed Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.659 -0.782 . . . . 0.0 111.627 -178.785 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.46 ' HB3' HD11 ' X' ' 47' ' ' ILE . 41.0 m-85 -133.74 166.27 23.02 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 177.771 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 70.2 m -158.72 -123.51 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -178.601 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.639 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.3 p30 -118.78 130.98 56.09 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 169.485 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . 1.047 ' HG3' ' HE1' ' X' ' 28' ' ' TRP . 3.0 pp20? -78.73 1.62 22.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.051 0.453 . . . . 0.0 110.5 -178.534 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -152.02 -73.49 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.98 172.38 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -175.34 28.25 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.479 0 N-CA-C 110.896 -0.882 . . . . 0.0 110.896 175.486 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 1.047 ' HE1' ' HG3' ' X' ' 25' ' ' GLU . 53.3 p-90 -98.31 -19.87 17.53 Favored 'General case' 0 C--O 1.212 -0.898 0 CA-C-O 118.557 -0.735 . . . . 0.0 112.227 -175.035 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.639 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 28.5 tp -40.35 -53.21 2.62 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -168.917 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' X' X ' 30' ' ' THR . . . . . 0.404 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 60.2 p -72.78 -17.66 61.56 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -178.773 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -94.59 -48.88 5.9 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.673 -174.944 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.659 ' O ' ' HD3' ' X' ' 36' ' ' LYS . 3.4 tm? -50.12 -71.99 0.06 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 123.72 0.808 . . . . 0.0 111.381 -178.166 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.683 ' HB2' ' HA ' ' X' ' 38' ' ' TYR . 0.5 OUTLIER -62.83 -25.06 68.07 Favored 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -175.292 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . 0.487 ' NE2' ' HE1' ' X' ' 38' ' ' TYR . 5.9 tp-100 -57.65 -36.21 71.56 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 -179.118 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 7.1 m -96.03 -11.48 26.37 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.927 0.394 . . . . 0.0 110.939 -178.789 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . 0.659 ' HD3' ' O ' ' X' ' 32' ' ' LEU . 4.3 mptp? -108.17 36.55 2.75 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -177.505 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 41.6 t30 59.21 37.17 23.93 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.534 0.683 . . . . 0.0 111.084 178.169 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.683 ' HA ' ' HB2' ' X' ' 33' ' ' LEU . 54.8 m-85 54.34 59.12 4.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.256 179.48 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . 0.481 ' HB2' ' O ' ' X' ' 36' ' ' LYS . 2.4 t0 -91.72 128.9 37.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.667 -1.151 . . . . 0.0 111.428 -172.415 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.538 ' O ' HD11 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.12 -7.6 10.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.346 170.416 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -70.76 -42.23 62.03 Favored Glycine 0 N--CA 1.442 -0.964 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.077 -178.977 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -91.26 -22.6 20.5 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.16 -0.52 . . . . 0.0 111.216 178.444 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.488 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -69.04 -41.16 78.04 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.418 -179.387 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.538 HD11 ' O ' ' X' ' 40' ' ' ILE . 10.9 mp -75.14 -33.86 61.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.727 0.299 . . . . 0.0 110.362 178.839 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -57.32 -35.14 69.49 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.291 179.425 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 1.5 p -86.12 -44.03 12.58 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -176.206 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.643 HG22 ' CH2' ' X' ' 28' ' ' TRP . 4.5 pt -67.1 -30.35 49.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 -170.85 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -165.61 -32.07 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 111.606 0.224 . . . . 0.0 111.606 -177.488 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . 0.442 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 13.3 m-85 . . . . . 0 N--CA 1.467 0.403 0 CA-C-O 120.765 0.316 . . . . 0.0 110.834 -179.27 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.515 -0.399 0 CA-C-O 121.608 0.718 . . . . 0.0 109.453 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' X' X ' 7' ' ' ASP . . . . . 0.611 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 25.0 t70 -75.87 146.07 78.84 Favored Pre-proline 0 C--N 1.319 -0.751 0 CA-C-N 114.367 -1.288 . . . . 0.0 108.172 175.965 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' X' X ' 8' ' ' PRO . . . . . 0.611 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 80.2 Cg_exo -42.97 -25.61 0.57 Allowed 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.062 2.508 . . . . 0.0 112.982 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' X' X ' 9' ' ' ARG . . . . . 0.48 ' HB3' ' CG ' ' X' ' 38' ' ' TYR . 64.3 mmt-85 -93.41 -39.1 11.1 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.537 179.844 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' X' X ' 10' ' ' LEU . . . . . 0.689 HD22 ' HB2' ' X' ' 14' ' ' LEU . 79.3 mt -95.66 -19.55 19.63 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 122.137 -0.352 . . . . 0.0 111.631 -170.764 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' X' X ' 11' ' ' ILE . . . . . 0.503 ' O ' ' HB3' ' X' ' 15' ' ' SER . 0.0 OUTLIER -66.39 -24.62 33.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 171.635 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -95.91 -62.29 1.31 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.613 173.625 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 35.9 m -81.07 -21.25 40.18 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -169.445 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' X' X ' 14' ' ' LEU . . . . . 0.689 ' HB2' HD22 ' X' ' 10' ' ' LEU . 8.8 tp -92.97 -45.83 7.76 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.798 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' X' X ' 15' ' ' SER . . . . . 0.503 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 19.3 t -67.6 -26.24 66.16 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 114.004 -1.453 . . . . 0.0 111.528 -178.031 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 3.9 tm0? -52.25 -52.09 54.57 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.058 0.456 . . . . 0.0 110.944 177.485 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' X' X ' 17' ' ' MET . . . . . 0.631 ' SD ' HD13 ' X' ' 29' ' ' LEU . 8.4 ptm -89.06 -26.71 21.26 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.116 -175.619 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' X' X ' 18' ' ' LEU . . . . . 0.584 HD11 ' HG ' ' X' ' 14' ' ' LEU . 28.8 mt -72.08 -17.69 61.98 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 119.961 -0.696 . . . . 0.0 112.126 -179.474 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 32.4 p -94.52 -21.72 18.69 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 121.059 -0.256 . . . . 0.0 111.383 178.584 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 86.6 mtp -87.08 -31.66 20.35 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.702 0.287 . . . . 0.0 111.321 -179.13 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 108.31 35.56 2.47 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.487 -175.329 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' X' X ' 22' ' ' PHE . . . . . 0.457 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 15.0 m-30 -112.82 146.72 38.36 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 175.295 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 62.6 m -136.72 -177.56 4.79 Favored 'General case' 0 C--N 1.308 -1.211 0 C-N-CA 119.903 -0.719 . . . . 0.0 110.779 -174.878 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' X' X ' 24' ' ' ASP . . . . . 0.872 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 1.3 p30 -79.55 123.13 27.3 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.213 0.53 . . . . 0.0 110.117 175.251 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' X' X ' 25' ' ' GLU . . . . . 0.494 ' CB ' ' HE1' ' X' ' 28' ' ' TRP . 18.4 tp10 -68.57 -35.29 77.19 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.264 -177.089 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -139.92 20.28 2.88 Favored Glycine 0 C--N 1.32 -0.334 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.787 178.101 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' X' X ' 27' ' ' GLY . . . . . 0.564 ' O ' ' HG2' ' X' ' 31' ' ' ARG . . . 91.31 23.18 29.93 Favored Glycine 0 C--O 1.225 -0.424 0 C-N-CA 120.509 -0.853 . . . . 0.0 112.309 -179.736 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' X' X ' 28' ' ' TRP . . . . . 0.715 ' HB2' ' HB2' ' X' ' 32' ' ' LEU . 47.8 p-90 -89.83 -13.7 35.98 Favored 'General case' 0 C--O 1.217 -0.644 0 O-C-N 122.887 -0.184 . . . . 0.0 111.311 -178.385 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' X' X ' 29' ' ' LEU . . . . . 0.872 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 11.4 tp -63.0 -20.96 65.8 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 121.791 -0.568 . . . . 0.0 109.898 -179.259 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.5 -25.7 17.49 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.266 171.224 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' X' X ' 31' ' ' ARG . . . . . 0.564 ' HG2' ' O ' ' X' ' 27' ' ' GLY . 15.7 mmm180 -95.92 -65.47 0.97 Allowed 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -175.433 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' X' X ' 32' ' ' LEU . . . . . 0.715 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 2.8 tm? -39.12 -54.94 1.7 Allowed 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.853 1.261 . . . . 0.0 112.533 -176.197 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' X' X ' 33' ' ' LEU . . . . . 0.727 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 93.4 mt -54.63 -61.85 2.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.497 -176.796 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -38.1 -55.89 1.23 Allowed 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -175.653 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 6.4 p -76.46 -2.44 32.13 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -169.179 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -112.79 -27.31 8.19 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 119.995 -0.682 . . . . 0.0 111.971 -179.009 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 20.7 p30 136.87 15.86 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 125.931 1.693 . . . . 0.0 109.979 178.214 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' X' X ' 38' ' ' TYR . . . . . 0.727 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 26.0 m-85 72.42 56.25 0.15 Allowed 'General case' 0 C--N 1.341 0.217 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 -170.102 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -100.72 125.94 47.22 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.766 -171.265 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' X' X ' 40' ' ' ILE . . . . . 0.665 ' O ' HD11 ' X' ' 44' ' ' LEU . 0.1 OUTLIER -89.58 -8.6 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.123 173.664 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.97 -37.27 92.42 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.355 -0.926 . . . . 0.0 111.915 177.279 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.08 -21.39 16.21 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.506 -0.347 . . . . 0.0 110.74 175.904 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' X' X ' 43' ' ' ALA . . . . . 0.637 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -67.23 -33.78 76.08 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.018 178.049 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' X' X ' 44' ' ' LEU . . . . . 0.692 ' HA ' ' CG1' ' X' ' 47' ' ' ILE . 7.1 mp -63.98 -30.42 71.5 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.153 179.429 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' X' X ' 45' ' ' ASP . . . . . 0.561 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 21.1 t70 -57.37 -39.55 76.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.19 0.519 . . . . 0.0 110.812 174.749 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 11.7 p -94.46 -5.53 46.01 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -175.626 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' X' X ' 47' ' ' ILE . . . . . 0.692 ' CG1' ' HA ' ' X' ' 44' ' ' LEU . 2.0 pt -102.63 43.91 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 O-C-N 121.999 -0.438 . . . . 0.0 111.666 173.804 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 82.0 33.45 0.09 Allowed 'General case' 0 N--CA 1.474 0.744 0 O-C-N 124.276 0.985 . . . . 0.0 112.549 173.009 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' X' X ' 49' ' ' TYR . . . . . 0.561 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 63.8 m-85 . . . . . 0 C--N 1.33 -0.263 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 173.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.851 0 N-CA-C 112.187 -0.365 . . . . 0.0 112.187 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' X' X ' 2' ' ' SER . . . . . 0.464 ' HB2' ' OD2' ' X' ' 7' ' ' ASP . 19.3 m -95.06 158.54 34.72 Favored Pre-proline 0 C--N 1.325 -0.487 0 C-N-CA 122.151 0.18 . . . . 0.0 110.693 -178.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.447 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 56.9 Cg_exo -54.11 127.08 24.25 Favored 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 122.856 2.371 . . . . 0.0 112.457 -178.076 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 7.6 Cg_exo -75.08 41.18 0.72 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 123.25 2.633 . . . . 0.0 113.389 -176.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -158.12 12.59 0.19 Allowed 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 178.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -173.19 26.64 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.444 0 CA-C-O 121.186 0.517 . . . . 0.0 109.78 -177.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . 0.464 ' OD2' ' HB2' ' X' ' 2' ' ' SER . 7.9 t70 -74.85 148.84 85.19 Favored Pre-proline 0 C--N 1.319 -0.749 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 174.061 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . 0.447 ' O ' ' HB2' ' X' ' 12' ' ' GLU . 86.9 Cg_exo -46.85 -24.18 2.94 Favored 'Trans proline' 0 CA--C 1.535 0.563 0 C-N-CA 122.158 1.905 . . . . 0.0 112.555 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 27.3 mmm180 -93.38 -23.49 18.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.881 -0.6 . . . . 0.0 112.512 179.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 43.5 mt -98.37 -28.3 13.71 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.633 0.254 . . . . 0.0 110.883 -176.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.583 ' O ' ' HB3' ' X' ' 15' ' ' SER . 11.2 tp -75.82 -17.39 15.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 171.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . 0.447 ' HB2' ' O ' ' X' ' 8' ' ' PRO . 0.3 OUTLIER -91.12 -53.7 4.26 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.894 175.643 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 4.3 m -95.31 -26.19 16.02 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -170.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -94.86 -41.94 8.95 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.583 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 23.2 t -67.2 -25.72 66.27 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.984 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . 0.426 ' OE1' HG21 ' X' ' 40' ' ' ILE . 4.2 tm0? -63.66 -54.88 28.84 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 121.174 0.511 . . . . 0.0 110.308 176.055 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.69 ' SD ' HD12 ' X' ' 29' ' ' LEU . 14.2 ptp -71.69 -33.62 68.96 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.459 -177.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 28.1 tp -67.61 -36.46 80.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.881 0.372 . . . . 0.0 110.81 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 20.7 t -79.75 -38.24 33.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.243 -178.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 42.2 tpp -75.75 -31.52 59.59 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.617 0.228 . . . . 0.0 111.617 -175.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.88 47.27 0.62 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.145 -1.026 . . . . 0.0 112.754 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.619 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 50.4 m-85 -119.41 169.15 10.27 Favored 'General case' 0 CA--C 1.509 -0.603 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 175.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 42.0 m -151.31 -148.71 0.27 Allowed 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.113 -0.635 . . . . 0.0 110.369 -179.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.531 ' OD1' HD22 ' X' ' 29' ' ' LEU . 2.3 m-20 -92.46 115.81 28.43 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 174.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . 0.585 ' HG3' ' HA ' ' X' ' 47' ' ' ILE . 48.0 mm-40 -82.9 43.26 0.84 Allowed 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.715 177.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 143.05 -14.33 2.36 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.581 -178.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.58 7.38 36.92 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.834 -0.698 . . . . 0.0 111.902 -178.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.538 ' CE3' ' HA ' ' X' ' 29' ' ' LEU . 55.9 p-90 -86.51 -13.85 44.78 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 119.046 -0.502 . . . . 0.0 111.3 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.69 HD12 ' SD ' ' X' ' 17' ' ' MET . 36.9 tp -48.21 -51.0 27.21 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -167.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 25.5 p -65.43 -47.83 74.86 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.739 0.304 . . . . 0.0 111.019 177.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . 0.501 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 10.0 mtm180 -54.97 -52.48 62.92 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.903 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.441 ' HB2' ' HE3' ' X' ' 28' ' ' TRP . 2.6 tm? -55.94 -55.25 34.9 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 123.034 0.533 . . . . 0.0 110.808 178.129 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.47 HD13 ' HG ' ' X' ' 29' ' ' LEU . 84.2 mt -56.91 -65.17 0.66 Allowed 'General case' 0 C--O 1.225 -0.214 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.195 -176.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -54.76 -38.7 67.54 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -172.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 42.8 p -71.88 -13.24 61.61 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -177.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -120.15 38.91 3.83 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.7 -0.227 . . . . 0.0 110.537 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 43.54 46.83 6.07 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.916 0.887 . . . . 0.0 112.029 -175.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 63.18 76.62 0.36 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.247 178.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -111.88 123.63 50.66 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.299 -174.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.53 ' HB ' HD11 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.87 -8.76 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.454 174.2 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.46 -44.04 95.81 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.53 -0.843 . . . . 0.0 112.338 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -93.47 -18.91 21.77 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.698 0.285 . . . . 0.0 110.865 178.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.584 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -71.05 -51.05 27.51 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.487 177.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.791 HD12 HD11 ' X' ' 47' ' ' ILE . 10.3 mp -62.45 -28.9 70.13 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.509 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . 0.503 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 17.0 t70 -51.59 -44.77 62.93 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.474 0.484 . . . . 0.0 111.691 178.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 2.0 p -96.48 -23.68 16.45 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -177.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.791 HD11 HD12 ' X' ' 44' ' ' LEU . 25.3 pt -81.94 45.44 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 N-CA-C 112.935 0.716 . . . . 0.0 112.935 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . 0.469 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 3.0 mt-30 88.33 15.63 0.07 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.05 0.94 . . . . 0.0 113.342 173.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . 0.503 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 32.9 m-85 -129.17 77.46 1.79 Allowed 'General case' 0 C--N 1.328 -0.365 0 O-C-N 121.985 -0.447 . . . . 0.0 110.219 171.463 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 8.0 t -76.29 20.96 0.19 Allowed 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.815 0.34 . . . . 0.0 111.632 -177.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . 0.421 ' H ' ' C ' ' X' ' 49' ' ' TYR . 52.4 tttp -167.91 118.54 0.82 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 176.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 2.8 m80 . . . . . 0 C--O 1.244 0.796 0 CA-C-O 118.468 -0.777 . . . . 0.0 111.069 -179.89 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.979 0 N-CA-C 111.967 -0.453 . . . . 0.0 111.967 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' X' X ' 2' ' ' SER . . . . . 0.455 ' HG ' ' HA ' ' X' ' 7' ' ' ASP . 22.6 t -81.51 130.28 62.45 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.756 0.278 . . . . 0.0 110.316 179.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.402 ' C ' ' H ' ' X' ' 5' ' ' GLU . 31.8 Cg_endo -64.49 141.78 75.37 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.639 2.226 . . . . 0.0 112.283 179.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_exo -72.87 33.87 0.31 Allowed 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 123.069 2.513 . . . . 0.0 113.298 -178.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . 0.402 ' H ' ' C ' ' X' ' 3' ' ' PRO . 27.5 tt0 -139.27 12.19 2.58 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.624 0.726 . . . . 0.0 109.215 177.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -173.58 26.8 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.439 0 CA-C-N 114.779 -1.101 . . . . 0.0 108.757 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . 0.768 ' OD2' ' HD3' ' X' ' 9' ' ' ARG . 29.5 t70 -81.7 145.82 55.2 Favored Pre-proline 0 C--N 1.321 -0.672 0 CA-C-N 114.138 -1.392 . . . . 0.0 108.18 178.502 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . 0.564 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 92.9 Cg_exo -42.64 -26.0 0.57 Allowed 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 123.004 2.469 . . . . 0.0 113.879 -177.355 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . 0.768 ' HD3' ' OD2' ' X' ' 7' ' ' ASP . 3.6 mpp_? -92.89 -38.61 11.63 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.402 HD23 ' HB2' ' X' ' 14' ' ' LEU . 87.9 mt -97.03 -15.57 20.98 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 -172.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.454 ' O ' ' HB3' ' X' ' 15' ' ' SER . 15.2 tt -72.48 -19.59 19.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 172.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -94.44 -51.03 4.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.317 174.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 13' ' ' SER . . . . . 0.41 ' O ' ' HG2' ' X' ' 17' ' ' MET . 34.5 m -94.73 -29.63 14.69 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -169.005 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.647 HD22 HD22 ' X' ' 18' ' ' LEU . 10.0 tt -94.24 -40.62 9.9 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.454 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 5.6 t -67.53 -26.1 66.16 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.708 -179.03 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . 0.421 ' HA ' ' OG ' ' X' ' 19' ' ' SER . 1.1 pp0? -73.64 -28.48 61.8 Favored 'General case' 0 C--O 1.224 -0.263 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 175.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.566 ' HG3' HD12 ' X' ' 29' ' ' LEU . 91.0 mmm -65.46 -42.29 92.48 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 174.232 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . 0.647 HD22 HD22 ' X' ' 14' ' ' LEU . 4.4 mm? -67.38 -34.64 77.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.067 179.005 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 19' ' ' SER . . . . . 0.421 ' OG ' ' HA ' ' X' ' 16' ' ' GLN . 5.1 p -84.83 -34.79 22.62 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -175.595 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 20' ' ' MET . . . . . 0.507 ' HA ' ' HE3' ' X' ' 20' ' ' MET . 21.2 mmt -78.44 -15.2 58.9 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 121.141 -0.224 . . . . 0.0 111.486 -178.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 98.68 44.57 2.45 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.499 178.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -125.6 -177.78 4.02 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 176.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 42.5 m -156.96 -134.86 0.04 OUTLIER 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 175.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.57 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 2.8 p30 -122.15 131.43 53.95 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 169.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -97.61 55.11 1.21 Allowed 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.099 -0.64 . . . . 0.0 109.868 178.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 144.31 -0.22 1.08 Allowed Glycine 0 CA--C 1.518 0.227 0 C-N-CA 120.279 -0.963 . . . . 0.0 113.632 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.0 11.22 63.58 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.004 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.702 ' CZ2' HG21 ' X' ' 47' ' ' ILE . 42.0 p-90 -87.21 -5.62 58.89 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -176.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.57 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 53.7 tp -59.83 -26.59 65.92 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 122.075 -0.39 . . . . 0.0 111.35 -175.083 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 80.5 p -93.73 -11.47 31.37 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.816 0.341 . . . . 0.0 111.082 175.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . 0.487 ' CG ' ' HA ' ' X' ' 28' ' ' TRP . 13.3 mmm180 -94.99 -61.98 1.39 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.25 0.548 . . . . 0.0 110.746 -178.458 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.473 ' C ' HD11 ' X' ' 32' ' ' LEU . 2.9 tm? -47.16 -72.37 0.05 Allowed 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 114.345 -1.298 . . . . 0.0 111.408 -177.136 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.503 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.3 mp -53.79 -50.0 67.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.579 -175.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.22 -34.06 14.01 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -176.154 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 2.7 m -99.05 -2.86 36.11 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 111.732 0.271 . . . . 0.0 111.732 -174.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -123.86 37.75 4.34 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -177.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 47.8 t30 69.48 26.33 5.18 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.38 0.61 . . . . 0.0 110.73 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.503 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 29.4 m-85 54.54 64.9 1.66 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.268 178.254 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . 0.424 ' O ' ' HG ' ' X' ' 33' ' ' LEU . 33.7 p-10 -103.79 133.8 48.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.013 -0.994 . . . . 0.0 112.551 -173.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.487 ' O ' HD11 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -91.45 -3.92 10.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.95 170.285 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.96 -36.32 81.18 Favored Glycine 0 N--CA 1.444 -0.807 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.736 177.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -96.88 -17.66 20.02 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.304 -0.448 . . . . 0.0 110.783 176.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.475 ' O ' HG13 ' X' ' 47' ' ' ILE . . . -68.44 -45.99 71.05 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.217 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.532 ' O ' HD11 ' X' ' 47' ' ' ILE . 10.2 mp -63.41 -34.01 76.8 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.788 0.328 . . . . 0.0 110.754 178.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -58.85 -38.31 78.44 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.743 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 9.6 p -96.48 -5.93 38.38 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -172.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.702 HG21 ' CZ2' ' X' ' 28' ' ' TRP . 1.4 pp -98.81 -27.07 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 CA-C-N 119.565 1.075 . . . . 0.0 112.502 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . 0.509 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.6 mp0 -159.8 -35.92 0.06 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.784 0.326 . . . . 0.0 110.949 -179.11 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -80.9 34.96 0.36 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.426 -177.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 8.4 t -81.54 -2.61 50.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.742 0.782 . . . . 0.0 109.894 178.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -120.11 20.21 12.11 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.602 176.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 79.3 t60 . . . . . 0 C--O 1.246 0.896 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.438 -177.456 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.866 0 N-CA-C 112.165 -0.374 . . . . 0.0 112.165 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 46.1 m -91.01 127.42 51.77 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-O 120.67 0.271 . . . . 0.0 110.506 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.412 ' C ' ' H ' ' X' ' 5' ' ' GLU . 58.8 Cg_endo -74.98 162.48 37.1 Favored 'Trans proline' 0 CA--C 1.53 0.28 0 C-N-CA 122.516 2.144 . . . . 0.0 112.133 -178.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -76.46 14.74 1.13 Allowed 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.859 2.373 . . . . 0.0 112.438 -179.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . 0.439 ' O ' ' HB3' ' X' ' 6' ' ' ALA . 4.1 tm-20 -153.55 112.9 3.79 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 176.525 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . 0.439 ' HB3' ' O ' ' X' ' 5' ' ' GLU . . . 81.73 48.93 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.48 0 O-C-N 124.115 0.885 . . . . 0.0 109.837 -171.121 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -89.68 150.08 43.44 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 172.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -46.36 -25.27 3.12 Favored 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 122.339 2.026 . . . . 0.0 113.05 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 66.0 mtt85 -87.59 -38.59 15.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.661 178.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.554 HD22 ' HD2' ' X' ' 38' ' ' TYR . 98.0 mt -81.95 -26.61 33.85 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.498 -176.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.542 ' O ' HD13 ' X' ' 11' ' ' ILE . 0.3 OUTLIER -69.48 -20.18 23.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 174.188 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -88.34 -63.99 1.21 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.186 -0.915 . . . . 0.0 111.668 173.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 11.5 m -89.67 -26.7 20.57 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -167.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.528 ' HG ' HD12 ' X' ' 29' ' ' LEU . 7.8 tt -93.4 -42.74 9.12 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.496 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 15.3 t -67.12 -31.13 71.39 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.789 -175.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . 0.442 ' NE2' HG21 ' X' ' 40' ' ' ILE . 4.7 pp0? -65.91 -33.35 75.63 Favored 'General case' 0 C--O 1.227 -0.103 0 C-N-CA 120.501 -0.48 . . . . 0.0 111.022 -179.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.772 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 14.7 ptm -89.03 -30.31 18.81 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.046 177.597 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 53.3 tp -59.71 -41.5 90.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.935 0.398 . . . . 0.0 110.665 177.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 14.6 m -87.69 -40.1 14.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.228 -175.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 20' ' ' MET . . . . . 0.462 ' HB3' ' HE1' ' X' ' 20' ' ' MET . 86.3 mmm -72.28 -27.18 62.31 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -175.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.25 46.87 0.62 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 119.901 -1.142 . . . . 0.0 113.172 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.772 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 39.7 m-85 -122.69 160.24 26.27 Favored 'General case' 0 CA--C 1.511 -0.552 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 171.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 5.0 m -147.87 178.11 8.77 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.095 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.589 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.3 p30 -85.07 130.03 34.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.201 0.524 . . . . 0.0 110.082 173.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . 0.673 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 51.7 tp10 -69.67 -25.08 63.72 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.212 -176.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -145.66 15.25 1.8 Allowed Glycine 0 C--O 1.228 -0.238 0 C-N-CA 120.336 -0.935 . . . . 0.0 113.597 -178.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . 0.416 ' O ' ' HD3' ' X' ' 31' ' ' ARG . . . 90.91 22.89 31.72 Favored Glycine 0 CA--C 1.509 -0.337 0 C-N-CA 120.468 -0.872 . . . . 0.0 111.92 179.616 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.673 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 38.8 p-90 -96.12 -5.0 41.75 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -176.343 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.589 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 3.2 tp -51.37 -38.73 54.81 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -170.226 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 30' ' ' THR . . . . . 0.764 ' O ' ' HG3' ' X' ' 34' ' ' GLN . 70.5 p -79.72 -46.2 17.5 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 119.928 -0.709 . . . . 0.0 110.195 173.185 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . 0.618 ' HD2' ' H ' ' X' ' 31' ' ' ARG . 1.4 mpt_? -53.34 -66.19 0.43 Allowed 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.422 0.689 . . . . 0.0 112.398 -179.065 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.605 HD21 ' HE2' ' X' ' 36' ' ' LYS . 3.5 tm? -50.91 -60.5 3.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.437 -177.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.507 HD11 ' O ' ' X' ' 29' ' ' LEU . 11.0 mp -52.51 -47.8 66.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.405 -175.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . 0.764 ' HG3' ' O ' ' X' ' 30' ' ' THR . 33.2 mt-30 -64.88 -26.07 68.16 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -173.325 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 70.4 p -74.02 -16.68 61.05 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.315 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . 0.605 ' HE2' HD21 ' X' ' 32' ' ' LEU . 2.8 mptp? -121.33 37.08 4.43 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 121.266 -0.173 . . . . 0.0 111.462 177.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 37.9 t30 66.25 52.72 1.1 Allowed 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.161 0.505 . . . . 0.0 111.357 177.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.554 ' HD2' HD22 ' X' ' 10' ' ' LEU . 1.2 m-85 44.71 58.61 3.82 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.131 177.164 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . 0.482 ' O ' ' HG ' ' X' ' 33' ' ' LEU . 24.9 p-10 -111.15 151.49 28.1 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 119.167 -1.013 . . . . 0.0 113.523 -172.141 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.442 HG21 ' NE2' ' X' ' 16' ' ' GLN . 0.0 OUTLIER -90.66 -2.88 10.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 114.11 -1.405 . . . . 0.0 110.119 172.245 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.31 -37.06 85.89 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.851 -0.69 . . . . 0.0 111.797 -178.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.21 -21.0 17.54 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.251 -0.474 . . . . 0.0 110.532 175.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.62 -47.26 82.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.303 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . . . . . . . . . 1.1 tp -62.68 -26.35 68.61 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.355 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -67.28 -45.64 76.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.057 -179.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 27.5 p -97.31 -20.7 17.68 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -170.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.484 HG23 ' HE2' ' X' ' 17' ' ' MET . 4.6 pt -64.58 -30.37 50.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 118.959 0.799 . . . . 0.0 112.586 -171.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -166.42 -41.56 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.201 0.524 . . . . 0.0 109.923 177.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 -75.7 -158.48 0.09 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.007 -175.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 20.6 t -160.88 21.83 0.13 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.126 178.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -153.73 151.19 29.34 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.555 -179.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 67.7 t60 . . . . . 0 C--O 1.245 0.866 0 CA-C-O 118.443 -0.789 . . . . 0.0 109.484 175.966 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.718 0 N-CA-C 112.035 -0.426 . . . . 0.0 112.035 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 30.5 m -88.09 129.27 50.59 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-O 120.709 0.29 . . . . 0.0 110.876 -178.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -55.34 126.34 22.18 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.277 2.651 . . . . 0.0 112.589 -179.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -75.25 25.91 0.38 Allowed 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.794 2.329 . . . . 0.0 113.597 -178.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 72.53 4.06 4.87 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.551 0.741 . . . . 0.0 110.518 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -134.53 22.09 3.66 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.372 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.01 154.22 41.76 Favored Pre-proline 0 C--O 1.218 -0.59 0 CA-C-N 114.785 -1.098 . . . . 0.0 108.322 174.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . 0.459 ' HA ' HG22 ' X' ' 11' ' ' ILE . 57.4 Cg_exo -45.7 -22.46 1.19 Allowed 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 123.305 2.67 . . . . 0.0 114.55 -174.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -83.99 -42.17 16.5 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 122.055 -0.403 . . . . 0.0 112.045 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.424 HD23 ' CE1' ' X' ' 38' ' ' TYR . 67.9 mt -99.25 -19.45 17.09 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -175.578 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.591 ' O ' ' HB3' ' X' ' 15' ' ' SER . 0.1 OUTLIER -69.4 -22.73 25.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 175.653 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -93.78 -37.58 11.71 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.765 176.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 13' ' ' SER . . . . . 0.521 ' HB3' HD21 ' X' ' 33' ' ' LEU . 7.4 m -95.83 -40.72 9.19 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -171.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.428 HD13 ' C ' ' X' ' 14' ' ' LEU . 3.3 tm? -94.58 -48.41 6.11 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -178.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.591 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 22.9 t -64.49 -27.11 68.75 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.053 -176.344 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . 0.425 HE21 ' HB3' ' X' ' 16' ' ' GLN . 0.0 OUTLIER -62.56 -46.65 87.38 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.206 0.527 . . . . 0.0 109.812 174.801 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.429 ' HE1' HG21 ' X' ' 47' ' ' ILE . 77.2 mtp -71.36 -43.62 66.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.723 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 29.1 tp -62.58 -32.48 73.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.953 -176.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 8.0 t -96.33 -11.04 26.41 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.749 0.278 . . . . 0.0 111.749 -175.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 14.0 tpt -102.0 -31.71 10.53 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.777 -0.369 . . . . 0.0 111.372 -178.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.28 44.91 0.7 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.547 -0.835 . . . . 0.0 111.607 -177.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -128.99 146.58 50.94 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 177.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 14.9 m -146.22 -164.03 1.88 Allowed 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.899 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 9.1 p-10 -76.33 116.68 17.25 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 172.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 58.9 tt0 -100.96 65.17 1.09 Allowed 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 177.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 140.64 -6.07 2.64 Favored Glycine 0 N--CA 1.449 -0.478 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.268 -174.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.79 16.75 55.96 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 121.089 -0.577 . . . . 0.0 112.124 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.548 ' CZ2' HG22 ' X' ' 47' ' ' ILE . 58.6 p-90 -93.32 -13.33 28.28 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -174.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.899 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 3.7 tp -57.01 -33.62 67.35 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.648 -0.658 . . . . 0.0 112.135 -170.35 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 30' ' ' THR . . . . . 0.482 ' O ' ' HG2' ' X' ' 34' ' ' GLN . 10.4 p -87.89 -10.41 50.77 Favored 'General case' 0 C--O 1.218 -0.599 0 C-N-CA 120.185 -0.606 . . . . 0.0 111.034 175.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . 0.524 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 20.0 mtp180 -95.6 -56.4 2.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.337 0.589 . . . . 0.0 110.868 -178.328 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.408 ' HA ' HD23 ' X' ' 32' ' ' LEU . 2.8 tm? -50.46 -53.31 30.69 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.948 -177.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.701 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 9.6 mp -68.31 -47.08 68.53 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -170.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' X' ' 30' ' ' THR . 3.5 mm100 -37.98 -71.27 0.08 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 -172.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 33.3 p -60.81 -29.91 69.75 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.802 0.334 . . . . 0.0 111.84 -173.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -88.01 37.07 0.79 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.409 177.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 15.2 p30 46.37 34.32 2.23 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.352 1.061 . . . . 0.0 112.56 179.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.701 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 31.9 m-85 68.57 73.9 0.27 Allowed 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.869 -176.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . 0.449 ' O ' ' HB3' ' X' ' 43' ' ' ALA . 35.2 t0 -100.47 125.5 46.78 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.975 -175.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.709 ' O ' HD11 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.95 -13.79 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.625 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.662 169.856 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.63 -37.93 95.58 Favored Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.564 -0.827 . . . . 0.0 112.352 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.08 -18.75 19.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.436 -0.382 . . . . 0.0 111.065 176.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.569 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -70.47 -36.36 73.84 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.498 178.46 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.872 HD12 HD11 ' X' ' 47' ' ' ILE . 7.1 mp -60.7 -36.88 79.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.188 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . 0.534 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.1 t70 -51.93 -41.72 62.25 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 123.48 0.487 . . . . 0.0 111.354 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 5.1 p -96.23 -5.81 39.53 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -177.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.872 HD11 HD12 ' X' ' 44' ' ' LEU . 14.1 pt -101.95 44.33 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 CA-C-N 118.164 0.438 . . . . 0.0 111.63 174.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 79.04 27.1 0.43 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.94 0.896 . . . . 0.0 112.367 174.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . 0.534 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 62.3 m-85 -133.46 62.08 1.66 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.882 0.372 . . . . 0.0 110.173 173.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 22.7 m -82.15 47.65 1.15 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.129 0.49 . . . . 0.0 111.248 -178.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -165.38 78.71 0.3 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.346 177.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . 0.441 ' NE2' ' HB2' ' X' ' 45' ' ' ASP . 21.9 p80 . . . . . 0 C--O 1.245 0.828 0 CA-C-O 118.457 -0.782 . . . . 0.0 110.582 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.881 0 N-CA-C 112.155 -0.378 . . . . 0.0 112.155 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' X' X ' 2' ' ' SER . . . . . 0.594 ' HB3' ' HA ' ' X' ' 7' ' ' ASP . 21.3 t -118.42 152.25 50.66 Favored Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 -178.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.421 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 52.4 Cg_exo -52.86 146.02 37.89 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.534 2.156 . . . . 0.0 111.948 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 21.1 Cg_exo -69.88 37.5 0.25 Allowed 'Trans proline' 0 CA--C 1.532 0.402 0 C-N-CA 123.172 2.581 . . . . 0.0 114.063 -175.352 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -146.93 13.11 1.13 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.589 0.233 . . . . 0.0 110.64 176.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . 0.561 ' HA ' HG23 ' X' ' 11' ' ' ILE . . . -179.17 41.62 0.0 OUTLIER 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.554 0.692 . . . . 0.0 109.935 -178.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . 0.594 ' HA ' ' HB3' ' X' ' 2' ' ' SER . 7.6 t70 -93.94 147.96 34.41 Favored Pre-proline 0 C--N 1.314 -0.974 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 175.133 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . 0.406 ' HD2' ' CG ' ' X' ' 7' ' ' ASP . 85.0 Cg_exo -44.18 -30.32 3.41 Favored 'Trans proline' 0 CA--C 1.532 0.421 0 C-N-CA 122.903 2.402 . . . . 0.0 112.709 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . 0.457 ' HB3' ' HD2' ' X' ' 38' ' ' TYR . 80.3 mtm-85 -84.15 -29.49 26.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.514 178.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.421 ' CD1' ' HA ' ' X' ' 4' ' ' PRO . 88.1 mt -97.88 -20.71 17.32 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -174.704 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.561 HG23 ' HA ' ' X' ' 6' ' ' ALA . 10.7 pt -73.64 -13.41 16.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 168.535 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -95.21 -53.13 3.9 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.629 174.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 23.7 t -93.29 -32.22 14.4 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -169.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . . . . . . . . . 8.3 tt -93.28 -40.33 10.48 Favored 'General case' 0 CA--C 1.51 -0.592 0 O-C-N 121.395 -0.816 . . . . 0.0 109.002 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.456 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 10.5 t -70.03 -23.1 63.06 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.494 -176.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 4.4 pp0? -65.3 -26.78 68.21 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.249 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.668 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 15.9 ptm -99.14 -24.74 14.77 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 121.033 -0.267 . . . . 0.0 110.504 175.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 35.7 tp -62.22 -40.73 97.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.752 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 40.3 p -91.4 -25.81 19.18 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.487 -178.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 44.5 ttm -73.89 -31.26 63.04 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.499 -0.318 . . . . 0.0 111.148 -176.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 104.54 47.12 1.23 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.081 -1.057 . . . . 0.0 112.685 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.668 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 13.9 m-30 -114.27 175.92 5.27 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 175.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 23' ' ' SER . . . . . 0.502 ' O ' HG22 ' X' ' 47' ' ' ILE . 12.3 m -145.9 158.64 43.85 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 119.812 -0.755 . . . . 0.0 111.407 -178.174 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -68.68 133.74 48.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.464 173.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . 0.754 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 2.3 tm-20 -91.28 -16.95 26.74 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -175.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -170.25 21.1 0.08 OUTLIER Glycine 0 CA--C 1.519 0.32 0 C-N-CA 119.221 -1.466 . . . . 0.0 114.49 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 87.19 24.0 38.77 Favored Glycine 0 C--N 1.32 -0.311 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.402 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.754 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 59.1 p-90 -96.86 -14.65 21.69 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 119.157 -0.449 . . . . 0.0 112.179 -178.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.568 HD11 ' SD ' ' X' ' 17' ' ' MET . 26.0 tp -52.33 -24.31 7.34 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -169.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 21.8 p -88.65 -61.59 1.68 Allowed 'General case' 0 C--N 1.32 -0.683 0 O-C-N 121.826 -0.546 . . . . 0.0 110.469 169.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . 0.703 ' HG2' ' HA ' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -49.37 -56.74 8.56 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -177.482 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.591 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 2.5 tm? -54.12 -46.46 72.19 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 122.642 0.377 . . . . 0.0 110.842 -178.243 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.584 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 11.2 mp -70.04 -51.38 32.55 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.454 -178.259 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -44.37 -56.22 4.38 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -176.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 61.9 p -75.92 -2.7 31.55 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -175.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 53.7 mttp -120.59 28.27 8.07 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 40.7 t30 64.02 30.86 13.92 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.737 0.779 . . . . 0.0 110.262 178.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.584 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 8.6 m-30 59.43 63.55 1.53 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.874 -174.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . 0.56 ' O ' ' HB2' ' X' ' 43' ' ' ALA . 32.2 t70 -95.86 124.83 40.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.871 -173.153 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.578 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.44 -6.25 10.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.396 171.769 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.29 -40.81 99.5 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.442 -0.885 . . . . 0.0 111.982 177.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.5 -20.98 16.14 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.173 -0.514 . . . . 0.0 110.906 176.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.567 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -66.88 -39.15 87.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.646 178.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.909 HD11 HD13 ' X' ' 47' ' ' ILE . 5.7 mp -57.85 -37.02 73.13 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.149 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -49.78 -46.34 50.68 Favored 'General case' 0 CA--C 1.532 0.269 0 O-C-N 123.696 0.623 . . . . 0.0 111.499 178.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -88.21 -21.69 24.41 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -177.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.909 HD13 HD11 ' X' ' 44' ' ' LEU . 8.1 pt -88.05 43.3 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 O-C-N 121.757 -0.589 . . . . 0.0 111.639 174.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . 0.453 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 1.5 mp0 85.88 38.13 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.526 1.13 . . . . 0.0 112.982 174.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . 0.563 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 26.6 m-85 -134.61 39.85 3.0 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 170.012 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 6.9 p -80.09 4.47 17.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.318 0.58 . . . . 0.0 111.589 -176.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 27.0 mmtp -111.68 14.56 21.2 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.09 178.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 26.4 t-80 . . . . . 0 C--O 1.246 0.868 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.309 -177.062 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.734 0 N-CA-C 112.213 -0.355 . . . . 0.0 112.213 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 62.5 m -116.63 149.32 43.66 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 122.723 -0.281 . . . . 0.0 110.578 179.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -68.68 151.06 74.94 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.611 2.208 . . . . 0.0 111.466 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_exo -72.19 40.77 0.46 Allowed 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 123.207 2.605 . . . . 0.0 112.846 -179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -151.73 13.06 0.62 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.322 176.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -157.09 21.38 0.31 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.252 -178.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . 0.401 ' O ' HG23 ' X' ' 11' ' ' ILE . 8.3 m-20 -77.75 154.78 80.93 Favored Pre-proline 0 C--O 1.216 -0.669 0 CA-C-N 115.448 -0.797 . . . . 0.0 109.298 176.158 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -46.04 -26.2 3.39 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 122.911 2.407 . . . . 0.0 112.675 177.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 56.0 mtm-85 -92.02 -33.96 14.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.188 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 93.7 mt -98.4 -19.52 17.68 Favored 'General case' 0 C--O 1.219 -0.519 0 O-C-N 122.223 -0.298 . . . . 0.0 111.578 -173.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.558 ' O ' ' HB3' ' X' ' 15' ' ' SER . 10.6 tt -74.08 -15.36 16.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 169.477 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . 0.508 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 4.7 tm-20 -94.77 -60.74 1.63 Allowed 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 114.754 -1.112 . . . . 0.0 110.277 175.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 36.7 m -89.77 -26.43 20.6 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -170.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . . . . . . . . . 7.5 tt -92.88 -40.41 10.63 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.558 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 28.1 t -70.18 -17.09 63.15 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.908 178.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . 0.508 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 0.0 OUTLIER -55.24 -50.73 68.71 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.509 178.383 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.984 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 0.5 OUTLIER -91.18 -23.66 20.17 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.012 179.405 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . 0.499 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 24.2 tp -63.49 -40.95 98.43 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.798 0.332 . . . . 0.0 110.805 -178.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 12.2 t -99.55 9.38 43.3 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.211 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 20' ' ' MET . . . . . 0.457 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 55.1 tpp -104.5 -31.2 9.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.836 0.351 . . . . 0.0 110.874 -179.31 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 108.9 45.75 1.01 Allowed Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.313 -0.946 . . . . 0.0 111.831 -177.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.984 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 46.0 m-85 -125.79 178.78 5.51 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 175.162 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 44.8 m -161.39 160.23 29.22 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 176.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.632 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 50.2 p-10 -78.39 160.52 27.73 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.374 -0.53 . . . . 0.0 109.89 172.157 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . 0.739 ' HG2' ' CD1' ' X' ' 28' ' ' TRP . 18.1 pt-20 -64.05 -20.39 65.9 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.407 178.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 144.24 42.56 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.217 -0.992 . . . . 0.0 114.324 174.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 154.95 -16.85 0.54 Allowed Glycine 0 C--N 1.333 0.403 0 C-N-CA 118.39 -1.862 . . . . 0.0 115.389 171.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.739 ' CD1' ' HG2' ' X' ' 25' ' ' GLU . 43.2 p-90 -87.03 -20.03 27.78 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 118.459 1.13 . . . . 0.0 113.033 -173.807 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.632 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 42.3 tp -55.79 -21.32 18.7 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.15 0.886 . . . . 0.0 111.401 -176.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.88 -31.67 17.22 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 175.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . 0.664 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -95.15 -52.05 4.37 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 -178.678 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.551 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 3.2 tm? -49.83 -51.56 39.05 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.49 0.716 . . . . 0.0 111.535 -177.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.706 ' O ' ' HA ' ' X' ' 38' ' ' TYR . 8.0 mp -71.99 -9.03 57.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.751 -177.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.7 -38.5 10.78 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.714 0.293 . . . . 0.0 110.775 -179.134 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 9.3 p -75.21 -39.49 60.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.44 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -78.3 37.92 0.28 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.956 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 41.9 45.92 3.34 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.851 0.86 . . . . 0.0 112.151 -177.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.706 ' HA ' ' O ' ' X' ' 33' ' ' LEU . 67.7 m-85 59.78 77.86 0.3 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.312 177.227 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -134.84 138.69 44.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.931 -175.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.603 ' O ' HD11 ' X' ' 44' ' ' LEU . 0.1 OUTLIER -90.14 -9.72 10.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.919 169.294 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.57 -34.41 89.44 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.203 178.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.01 -15.29 19.12 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.334 -0.433 . . . . 0.0 110.612 176.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.513 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -76.56 -35.84 57.97 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.163 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.603 HD11 ' O ' ' X' ' 40' ' ' ILE . 9.5 mp -69.7 -32.65 71.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.275 177.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -60.92 -31.85 71.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.157 177.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 21.8 p -98.01 -33.91 11.0 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -174.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.559 HG21 ' CH2' ' X' ' 28' ' ' TRP . 1.8 pt -65.71 -35.04 74.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 C-N-CA 119.337 -0.945 . . . . 0.0 112.837 -169.688 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . 0.431 ' OE1' ' HD1' ' X' ' 22' ' ' PHE . 1.0 OUTLIER -166.89 -34.95 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 120.735 0.302 . . . . 0.0 110.382 179.075 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . 0.511 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 52.7 m-85 -74.69 -173.19 1.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.978 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 20.6 p -153.06 16.77 0.56 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.835 0.35 . . . . 0.0 111.343 178.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . 0.415 ' HZ2' ' HB3' ' X' ' 51' ' ' LYS . 0.4 OUTLIER -150.44 160.83 43.47 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 178.036 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 74.7 t60 . . . . . 0 C--O 1.244 0.79 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.376 175.744 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.894 0 N-CA-C 112.061 -0.416 . . . . 0.0 112.061 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' X' X ' 2' ' ' SER . . . . . 0.439 ' HA ' ' HD3' ' X' ' 3' ' ' PRO . 50.9 m -69.64 128.26 92.17 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 120.868 0.366 . . . . 0.0 110.964 -179.138 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' X' ' 2' ' ' SER . 14.4 Cg_exo -67.42 163.73 33.51 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.751 2.301 . . . . 0.0 111.484 178.313 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -73.02 37.77 0.39 Allowed 'Trans proline' 0 CA--C 1.533 0.436 0 C-N-CA 122.963 2.442 . . . . 0.0 112.527 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . 0.429 ' H ' ' C ' ' X' ' 3' ' ' PRO . 57.5 mm-40 -124.1 7.59 8.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.784 177.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -177.09 35.85 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.724 -1.125 . . . . 0.0 109.149 -178.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . 0.419 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 32.3 t70 -93.85 144.53 28.28 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 114.86 -1.064 . . . . 0.0 108.34 178.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . 0.419 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 93.0 Cg_exo -42.36 -23.66 0.3 Allowed 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.362 2.708 . . . . 0.0 114.054 -178.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . 0.458 ' HD3' ' CE2' ' X' ' 38' ' ' TYR . 60.1 mtt85 -87.73 -46.07 9.8 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.772 HD22 ' HB2' ' X' ' 14' ' ' LEU . 74.3 mt -99.41 -11.89 20.73 Favored 'General case' 0 C--O 1.219 -0.504 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -175.463 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.646 ' O ' ' HB3' ' X' ' 15' ' ' SER . 11.2 tt -69.25 -25.65 29.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 121.552 0.691 . . . . 0.0 109.202 176.087 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -96.61 -38.11 10.09 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.661 176.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 32.5 m -96.01 -33.0 12.3 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -172.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.772 ' HB2' HD22 ' X' ' 10' ' ' LEU . 10.1 tt -95.33 -49.0 5.65 Favored 'General case' 0 CA--C 1.508 -0.657 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.646 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 37.2 t -61.42 -31.4 71.33 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 114.426 -1.261 . . . . 0.0 111.403 -177.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -53.47 -55.0 29.04 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.871 0.367 . . . . 0.0 110.22 176.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.727 ' HB3' ' HB2' ' X' ' 22' ' ' PHE . 68.8 mtm -69.23 -39.91 78.24 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.493 -178.419 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . 0.48 HD22 ' O ' ' X' ' 14' ' ' LEU . 4.3 mm? -64.91 -32.5 74.23 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -177.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 20.7 p -86.13 -37.35 18.87 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.852 0.315 . . . . 0.0 111.852 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 13.4 tpt -69.99 -24.95 63.39 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.362 -176.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.9 34.54 1.5 Allowed Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.434 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.727 ' HB2' ' HB3' ' X' ' 17' ' ' MET . 5.6 m-85 -110.58 -176.13 2.9 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 173.056 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 15.3 m -152.47 -149.28 0.29 Allowed 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.392 178.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.424 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 12.2 p-10 -122.88 131.78 53.89 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 170.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -115.69 68.05 0.71 Allowed 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.097 -0.641 . . . . 0.0 111.012 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 136.9 5.51 1.89 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.378 -0.915 . . . . 0.0 113.136 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 79.38 7.63 88.34 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.173 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.53 ' HB2' ' HB2' ' X' ' 32' ' ' LEU . 46.0 p-90 -79.65 -10.1 59.74 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 111.556 0.206 . . . . 0.0 111.556 -178.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.616 HD12 ' HG ' ' X' ' 14' ' ' LEU . 14.5 tp -55.97 -24.65 39.76 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 122.015 -0.428 . . . . 0.0 111.283 -174.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 30' ' ' THR . . . . . 0.633 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 20.5 p -94.41 -47.47 6.57 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 122.072 -0.393 . . . . 0.0 110.706 169.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 15.6 mmm180 -55.65 -59.78 4.37 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.303 0.641 . . . . 0.0 112.012 -178.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.53 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 2.8 tm? -55.97 -60.53 3.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.934 -1.03 . . . . 0.0 111.128 -176.118 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.432 HD13 ' O ' ' X' ' 29' ' ' LEU . 9.8 mp -57.32 -45.61 84.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.387 -176.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . 0.633 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.3 OUTLIER -49.82 -48.43 50.86 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 123.217 0.323 . . . . 0.0 111.436 179.685 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 14.1 m -67.15 -46.21 74.74 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.171 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -81.74 37.14 0.46 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.682 -179.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 5.5 p-10 40.33 49.92 2.6 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.806 0.842 . . . . 0.0 112.387 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.458 ' CE2' ' HD3' ' X' ' 9' ' ' ARG . 79.2 m-85 61.72 67.93 0.73 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.143 177.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -120.6 137.94 54.15 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.82 -177.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.606 ' O ' HD11 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.9 -9.8 10.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.432 171.826 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -60.78 -38.43 95.23 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.587 -178.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . 0.454 ' HB2' HD13 ' X' ' 32' ' ' LEU . . . -99.51 -15.4 18.68 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.486 -0.357 . . . . 0.0 110.594 175.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.461 ' CB ' ' HA ' ' X' ' 40' ' ' ILE . . . -68.41 -51.33 45.12 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.357 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.606 HD11 ' O ' ' X' ' 40' ' ' ILE . 11.1 mp -59.52 -28.69 67.29 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.886 0.374 . . . . 0.0 110.913 178.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . 0.439 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 37.1 t70 -65.36 -33.09 75.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.797 -179.095 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 5.0 p -95.87 -5.81 40.77 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 -172.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.679 HD13 ' HD2' ' X' ' 22' ' ' PHE . 0.0 OUTLIER -105.03 -27.39 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-N 119.005 0.821 . . . . 0.0 112.522 -179.047 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . 0.622 ' NE2' ' HB ' ' X' ' 47' ' ' ILE . 3.0 mp0 -157.49 -48.84 0.07 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.282 0.563 . . . . 0.0 110.279 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . 0.439 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 48.1 m-85 -82.18 58.47 4.02 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.781 -173.33 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 50.6 m -83.09 -0.64 50.01 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.962 0.887 . . . . 0.0 109.13 171.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . 0.464 ' HD3' ' N ' ' X' ' 51' ' ' LYS . 0.2 OUTLIER -141.84 64.62 1.39 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 113.972 -1.467 . . . . 0.0 108.919 175.687 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 28.0 t-80 . . . . . 0 C--O 1.244 0.814 0 CA-C-O 118.351 -0.833 . . . . 0.0 110.76 -173.984 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.888 0 N-CA-C 112.284 -0.326 . . . . 0.0 112.284 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' X' X ' 2' ' ' SER . . . . . 0.504 ' HA ' ' HD3' ' X' ' 3' ' ' PRO . 12.3 m -76.47 120.63 82.5 Favored Pre-proline 0 C--N 1.326 -0.437 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.504 ' HD3' ' HA ' ' X' ' 2' ' ' SER . 1.1 Cg_endo -86.83 166.44 8.62 Favored 'Trans proline' 0 N--CA 1.455 -0.751 0 C-N-CA 122.976 2.451 . . . . 0.0 111.358 -179.222 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . 0.73 ' HB2' ' HB2' ' X' ' 7' ' ' ASP . 44.3 Cg_exo -56.55 155.27 26.75 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.503 2.135 . . . . 0.0 111.947 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -73.91 96.37 2.61 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.015 -173.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . 60.64 59.81 2.09 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.707 0.765 . . . . 0.0 109.376 -175.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . 0.73 ' HB2' ' HB2' ' X' ' 4' ' ' PRO . 21.5 t70 -75.75 154.32 85.24 Favored Pre-proline 0 C--N 1.318 -0.764 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 176.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . 0.582 ' HD2' ' CG ' ' X' ' 7' ' ' ASP . 71.1 Cg_exo -39.07 -25.41 0.1 Allowed 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 123.233 2.622 . . . . 0.0 113.627 -178.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . 0.518 ' HD3' ' OD2' ' X' ' 7' ' ' ASP . 5.6 mtp180 -77.11 -48.11 18.64 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 176.054 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.458 ' HA ' HD21 ' X' ' 10' ' ' LEU . 79.6 mt -92.05 -26.4 18.34 Favored 'General case' 0 C--O 1.217 -0.608 0 O-C-N 122.254 -0.279 . . . . 0.0 111.672 -175.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.509 ' O ' ' HB3' ' X' ' 15' ' ' SER . 12.7 tt -69.69 -15.32 19.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 173.065 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -91.8 -58.4 2.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.001 174.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 50.2 m -90.86 -29.96 17.22 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -169.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.415 HD22 ' O ' ' X' ' 14' ' ' LEU . 5.2 tt -94.52 -45.05 7.58 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 -179.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.509 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 19.3 t -64.77 -25.73 68.05 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.8 -175.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . 0.653 ' O ' ' HB2' ' X' ' 20' ' ' MET . 5.2 pp0? -65.96 -24.31 66.78 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 120.952 -0.299 . . . . 0.0 111.562 -179.549 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.489 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 4.6 ppp? -101.52 -27.38 13.14 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.775 0.322 . . . . 0.0 110.564 176.19 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 24.7 tp -65.93 -43.29 88.52 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.983 -179.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 29.6 t -96.84 8.82 43.5 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.09 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 20' ' ' MET . . . . . 0.653 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 10.3 tpt -100.36 -31.42 11.34 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.972 0.415 . . . . 0.0 110.561 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.11 42.1 2.88 Favored Glycine 0 N--CA 1.447 -0.611 0 N-CA-C 111.058 -0.817 . . . . 0.0 111.058 -174.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.489 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 11.4 m-30 -115.76 171.23 7.88 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 32.4 m -153.35 161.95 41.79 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.605 177.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.487 ' OD2' ' HA2' ' X' ' 27' ' ' GLY . 15.6 p30 -68.54 136.95 53.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.124 0.487 . . . . 0.0 110.389 174.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . 0.629 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 38.5 tt0 -61.54 -19.45 62.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.366 -0.833 . . . . 0.0 111.22 -176.166 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -149.69 -64.68 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.677 176.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . 0.487 ' HA2' ' OD2' ' X' ' 24' ' ' ASP . . . 179.52 32.9 0.06 OUTLIER Glycine 0 CA--C 1.506 -0.531 0 N-CA-C 110.755 -0.938 . . . . 0.0 110.755 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.629 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 40.5 p-90 -96.83 -4.02 41.09 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -172.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.473 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 20.9 tp -59.11 -24.08 62.67 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.746 -0.596 . . . . 0.0 112.058 -170.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 6.7 m -95.05 -11.88 27.57 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 121.368 0.604 . . . . 0.0 111.074 174.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -95.66 -54.84 3.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.727 -177.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.423 ' C ' HD12 ' X' ' 32' ' ' LEU . 2.7 tm? -61.37 -61.04 2.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.105 -177.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.609 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 7.8 mp -60.37 -60.75 3.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.254 -172.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 12.2 mp0 -46.45 -43.01 16.21 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -173.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 40.2 p -76.9 -12.17 59.92 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 -176.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -118.69 32.97 5.85 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.624 0.231 . . . . 0.0 111.624 -177.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 45.9 t30 60.37 40.71 17.14 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.43 0.634 . . . . 0.0 110.513 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.609 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 18.1 m-85 55.86 61.03 2.96 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.649 -179.293 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . 0.589 ' O ' ' HB2' ' X' ' 43' ' ' ALA . 22.2 t70 -86.06 118.19 25.37 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.471 -173.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.422 ' H ' HG12 ' X' ' 40' ' ' ILE . 0.3 OUTLIER -90.53 -4.34 10.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.37 173.72 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.92 -39.96 93.43 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 120.589 -0.815 . . . . 0.0 111.73 176.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.16 -25.86 14.39 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.07 -0.565 . . . . 0.0 111.11 178.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.589 ' HB2' ' O ' ' X' ' 39' ' ' ASP . . . -65.01 -41.81 95.02 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.899 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.673 ' HA ' HG12 ' X' ' 47' ' ' ILE . 7.1 mp -65.34 -33.73 76.67 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.381 -178.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . 0.634 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.4 t70 -58.43 -39.34 79.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.018 0.437 . . . . 0.0 110.554 178.053 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 8.8 p -94.83 -6.38 42.96 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -177.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.673 HG12 ' HA ' ' X' ' 44' ' ' LEU . 13.0 pt -100.72 42.93 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 O-C-N 121.703 -0.623 . . . . 0.0 111.382 174.138 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . 0.447 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 2.1 mt-30 89.49 -6.93 0.41 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.798 1.239 . . . . 0.0 113.318 173.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . 0.634 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 6.9 m-85 -112.26 73.33 0.81 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.944 -0.472 . . . . 0.0 111.59 178.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 21.3 m -78.72 11.29 2.66 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.072 0.463 . . . . 0.0 111.344 177.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -121.95 79.39 1.57 Allowed 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 172.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 13.5 t-160 . . . . . 0 C--O 1.241 0.626 0 CA-C-O 118.498 -0.763 . . . . 0.0 109.773 -176.64 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.815 0 N-CA-C 112.176 -0.37 . . . . 0.0 112.176 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 66.5 m -86.31 123.02 72.02 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 122.785 -0.244 . . . . 0.0 110.427 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.456 ' C ' ' H ' ' X' ' 5' ' ' GLU . 28.1 Cg_endo -63.08 145.39 93.93 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.325 2.016 . . . . 0.0 111.913 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.7 34.23 0.38 Allowed 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.812 2.341 . . . . 0.0 112.438 179.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . 0.456 ' H ' ' C ' ' X' ' 3' ' ' PRO . 48.2 mt-10 -146.39 15.2 1.28 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.525 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -169.55 51.05 0.04 OUTLIER 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . 0.472 ' O ' HG12 ' X' ' 11' ' ' ILE . 9.0 t70 -108.34 150.22 40.29 Favored Pre-proline 0 C--N 1.316 -0.871 0 CA-C-N 114.15 -1.387 . . . . 0.0 107.416 -177.399 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . 0.449 ' HD2' ' CG ' ' X' ' 7' ' ' ASP . 94.8 Cg_exo -42.76 -31.99 2.32 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.906 2.404 . . . . 0.0 113.25 -177.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . 0.491 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 69.1 mtp180 -78.08 -26.56 48.21 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 178.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.575 HD22 ' CE1' ' X' ' 38' ' ' TYR . 56.5 mt -97.67 -22.3 16.54 Favored 'General case' 0 C--O 1.221 -0.421 0 C-N-CA 122.283 0.233 . . . . 0.0 110.788 177.706 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.541 ' O ' ' HB3' ' X' ' 15' ' ' SER . 43.5 mm -66.86 -13.86 17.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 108.617 -0.882 . . . . 0.0 108.617 171.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -93.73 -64.19 1.11 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.66 -1.155 . . . . 0.0 111.1 171.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 13' ' ' SER . . . . . 0.557 ' O ' ' HE3' ' X' ' 17' ' ' MET . 15.9 m -86.92 -25.65 24.29 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -168.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . . . . . . . . . 60.5 tp -93.37 -43.96 8.52 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.541 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 46.3 t -63.23 -26.75 68.93 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.173 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.05 -47.92 79.78 Favored 'General case' 0 N--CA 1.461 0.089 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 174.399 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.607 ' HB3' ' O ' ' X' ' 22' ' ' PHE . 59.1 mtm -75.79 -43.99 43.59 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.204 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 28.9 tp -57.72 -32.86 67.83 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 123.4 0.437 . . . . 0.0 111.578 -177.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 46.8 t -88.07 -30.93 19.53 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.576 -178.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 20' ' ' MET . . . . . 0.446 ' HB3' ' CE1' ' X' ' 22' ' ' PHE . 15.0 tpt -80.6 -31.51 36.69 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -176.319 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.43 24.57 4.37 Favored Glycine 0 CA--C 1.52 0.371 0 C-N-CA 119.976 -1.107 . . . . 0.0 113.939 176.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.607 ' O ' ' HB3' ' X' ' 17' ' ' MET . 0.0 OUTLIER -138.61 167.09 22.7 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 171.136 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 36.6 m -158.59 -91.57 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 119.971 -0.692 . . . . 0.0 111.926 -175.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.566 ' HB2' HD22 ' X' ' 29' ' ' LEU . 56.2 t0 -119.17 122.92 43.11 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.297 -176.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . 0.741 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 54.8 tt0 -61.44 -29.45 69.95 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.249 176.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 155.84 40.33 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 119.567 -1.301 . . . . 0.0 115.294 173.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . 0.443 ' H ' ' CG ' ' X' ' 24' ' ' ASP . . . 146.09 -14.81 1.7 Allowed Glycine 0 C--N 1.332 0.342 0 C-N-CA 119.178 -1.487 . . . . 0.0 114.724 171.037 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.741 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 56.8 p-90 -96.2 -14.73 22.51 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 117.81 0.805 . . . . 0.0 113.041 -173.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.566 HD22 ' HB2' ' X' ' 24' ' ' ASP . 38.8 tp -54.76 -34.72 62.94 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.864 -0.523 . . . . 0.0 112.392 -170.261 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 30' ' ' THR . . . . . 0.533 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 80.3 p -85.5 -16.45 39.52 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 122.167 -0.333 . . . . 0.0 111.273 177.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 13.7 mtm105 -95.37 -52.6 4.09 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.971 0.415 . . . . 0.0 111.216 -176.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.635 HD12 ' HD3' ' X' ' 36' ' ' LYS . 2.4 tm? -52.07 -70.34 0.09 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.241 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.579 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 7.0 mp -58.43 -45.51 88.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.992 -175.425 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . 0.533 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.0 OUTLIER -53.23 -38.99 63.44 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -174.231 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 40.5 p -94.37 -2.34 52.23 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.837 0.351 . . . . 0.0 111.938 -177.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . 0.635 ' HD3' HD12 ' X' ' 32' ' ' LEU . 24.7 mtpp -118.29 38.05 3.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.9 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 41.64 45.12 2.86 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.744 0.817 . . . . 0.0 111.928 -176.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.579 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 53.1 m-85 60.05 78.01 0.29 Allowed 'General case' 0 C--O 1.233 0.209 0 CA-C-N 114.873 -1.058 . . . . 0.0 111.382 178.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . 0.506 ' O ' ' HB3' ' X' ' 43' ' ' ALA . 2.9 t0 -97.86 120.96 39.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.704 -177.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.644 ' O ' HD11 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.12 -19.96 7.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 172.029 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.18 -46.37 91.15 Favored Glycine 0 N--CA 1.441 -0.973 0 C-N-CA 120.493 -0.86 . . . . 0.0 112.277 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -83.81 -22.05 31.91 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.475 -0.362 . . . . 0.0 111.002 178.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.696 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -68.91 -47.4 65.9 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.944 178.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.644 HD11 ' O ' ' X' ' 40' ' ' ILE . 10.8 mp -67.36 -29.12 68.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.03 -179.417 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . 0.741 ' OD1' ' HA ' ' X' ' 50' ' ' SER . 47.7 t0 -65.13 -28.45 69.43 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 121.284 0.564 . . . . 0.0 110.897 178.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 7.6 p -96.08 -32.69 12.41 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -175.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.696 HG12 ' O ' ' X' ' 43' ' ' ALA . 0.9 OUTLIER -83.36 -29.43 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -173.137 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . 0.584 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.3 mt-30 -164.04 -35.9 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 -177.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . 0.513 ' CE2' ' HE2' ' X' ' 22' ' ' PHE . 37.4 m-85 -91.73 -167.44 1.78 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.809 0.338 . . . . 0.0 110.707 -177.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 50' ' ' SER . . . . . 0.741 ' HA ' ' OD1' ' X' ' 45' ' ' ASP . 68.3 m -155.28 35.54 0.38 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.731 178.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -126.49 89.51 3.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.263 178.475 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.246 0.88 0 CA-C-O 118.57 -0.729 . . . . 0.0 111.004 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.004 0 N-CA-C 112.128 -0.389 . . . . 0.0 112.128 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 18.0 m -80.21 135.39 54.36 Favored Pre-proline 0 C--N 1.326 -0.422 0 N-CA-C 110.448 -0.205 . . . . 0.0 110.448 179.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.448 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 33.8 Cg_exo -60.56 118.38 5.24 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.571 2.181 . . . . 0.0 112.119 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 3.1 Cg_exo -77.18 42.64 1.16 Allowed 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 123.162 2.574 . . . . 0.0 112.911 -177.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -142.56 10.99 1.87 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.707 0.289 . . . . 0.0 110.949 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -174.29 44.0 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -178.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -106.94 142.19 24.47 Favored Pre-proline 0 C--N 1.314 -0.955 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 -179.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -44.96 -20.88 0.43 Allowed 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.152 2.568 . . . . 0.0 113.325 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 87.8 mtm-85 -92.56 -37.73 12.31 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 122.901 0.48 . . . . 0.0 112.11 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.425 ' HA ' ' HB2' ' X' ' 13' ' ' SER . 36.7 mt -98.84 -10.66 22.63 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -175.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.695 ' O ' ' HB2' ' X' ' 15' ' ' SER . 12.6 tt -68.1 -21.91 27.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 175.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -95.62 -26.22 15.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.847 170.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 13' ' ' SER . . . . . 0.425 ' HB2' ' HA ' ' X' ' 10' ' ' LEU . 20.3 m -96.65 -48.51 5.48 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -171.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.428 HD21 HD23 ' X' ' 29' ' ' LEU . 2.4 tm? -93.11 -44.13 8.52 Favored 'General case' 0 CA--C 1.507 -0.709 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 -179.508 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.695 ' HB2' ' O ' ' X' ' 11' ' ' ILE . 18.9 m -64.67 -17.83 64.42 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.277 -176.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . 0.525 ' NE2' ' HB3' ' X' ' 17' ' ' MET . 4.7 pp0? -78.28 -28.44 47.6 Favored 'General case' 0 N--CA 1.461 0.117 0 C-N-CA 120.557 -0.457 . . . . 0.0 111.091 177.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 1.064 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 23.0 ptp -94.16 -26.53 16.65 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.588 178.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 36.8 tp -57.46 -40.18 77.94 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.459 -179.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 25.6 m -70.8 -37.76 73.28 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -177.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -84.66 -26.24 27.93 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 111.895 0.331 . . . . 0.0 111.895 -174.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.69 46.15 0.86 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.318 -0.944 . . . . 0.0 112.277 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 1.064 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 6.5 m-85 -127.36 146.46 50.45 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 175.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 58.6 m -151.51 -116.89 0.04 OUTLIER 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.784 -175.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.675 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.4 p30 -122.47 142.89 50.09 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.182 172.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . 0.714 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 29.5 tt0 -67.58 -50.61 57.53 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.582 0.706 . . . . 0.0 110.054 177.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -133.77 -3.61 3.25 Favored Glycine 0 C--N 1.319 -0.372 0 CA-C-N 114.978 -1.01 . . . . 0.0 112.855 -178.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.05 12.16 3.66 Favored Glycine 0 C--N 1.33 0.205 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.739 178.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.715 ' CZ2' HG22 ' X' ' 47' ' ' ILE . 28.2 p-90 -80.35 -6.96 58.82 Favored 'General case' 0 C--O 1.22 -0.453 0 N-CA-C 111.998 0.369 . . . . 0.0 111.998 -178.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.675 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 15.0 tp -56.6 -32.37 65.19 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.934 0.397 . . . . 0.0 111.627 -173.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 30' ' ' THR . . . . . 0.48 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 35.1 p -82.3 -19.97 38.38 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.341 176.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . 0.602 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 8.8 mtm180 -95.24 -57.03 2.53 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.694 -175.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -51.35 -62.35 1.67 Allowed 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.608 0.763 . . . . 0.0 111.157 -177.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.831 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 7.3 mp -60.62 -45.48 93.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.243 -176.558 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . 0.48 ' HB2' ' O ' ' X' ' 30' ' ' THR . 3.7 tp-100 -39.15 -61.21 0.79 Allowed 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -175.489 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 26.7 p -85.3 -2.82 58.49 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -174.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -108.3 28.73 8.03 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 122.202 -0.311 . . . . 0.0 111.274 177.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 48.0 t30 60.31 42.7 14.57 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.09 0.471 . . . . 0.0 110.866 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.831 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 89.4 m-85 53.55 58.61 5.01 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.562 0.696 . . . . 0.0 110.177 -178.067 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . 0.62 ' O ' ' HB1' ' X' ' 43' ' ' ALA . 38.0 t0 -77.01 117.1 18.26 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.448 -1.251 . . . . 0.0 111.428 -172.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.61 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.78 -5.11 10.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.109 0.481 . . . . 0.0 110.291 170.958 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -80.28 -36.48 23.91 Favored Glycine 0 N--CA 1.439 -1.117 0 C-N-CA 120.476 -0.869 . . . . 0.0 111.52 178.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.56 -20.49 18.96 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.182 -0.509 . . . . 0.0 111.273 178.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.658 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -65.27 -45.01 86.19 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.019 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.61 HD13 ' O ' ' X' ' 40' ' ' ILE . 11.0 mp -66.26 -29.34 69.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.644 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . 0.557 ' OD1' ' HA ' ' X' ' 50' ' ' SER . 17.6 t70 -63.66 -29.5 70.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.281 176.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 3.6 p -98.04 -16.16 19.73 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -175.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.715 HG22 ' CZ2' ' X' ' 28' ' ' TRP . 0.4 OUTLIER -94.06 -30.61 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 119.431 -0.908 . . . . 0.0 113.17 -176.292 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . 0.478 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.7 mp0 -161.22 -42.58 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.968 0.413 . . . . 0.0 110.966 -178.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . 0.435 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 60.0 m-85 -73.16 -175.08 1.73 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.639 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 50' ' ' SER . . . . . 0.557 ' HA ' ' OD1' ' X' ' 45' ' ' ASP . 0.4 OUTLIER -169.29 86.43 0.15 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.76 175.384 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' X' ' 50' ' ' SER . 74.4 mmtt 83.82 62.57 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 O-C-N 124.339 1.024 . . . . 0.0 110.338 -177.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 . . . . . 0 C--O 1.245 0.829 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.852 179.721 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . 0.466 ' O ' ' HD3' ' X' ' 3' ' ' PRO . . . . . . . . 0 N--CA 1.484 1.835 0 N-CA-C 112.022 -0.431 . . . . 0.0 112.022 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' X' X ' 2' ' ' SER . . . . . 0.446 ' HB3' ' OD1' ' X' ' 7' ' ' ASP . 14.2 m -107.24 98.24 21.9 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-O 120.6 0.238 . . . . 0.0 110.388 178.562 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.466 ' HD3' ' O ' ' X' ' 1' ' ' GLY . 3.9 Cg_exo -77.36 144.95 23.46 Favored 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 122.664 2.243 . . . . 0.0 111.853 -178.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.42 35.65 0.4 Allowed 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 122.819 2.346 . . . . 0.0 112.793 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . 0.429 ' H ' ' C ' ' X' ' 3' ' ' PRO . 21.7 tt0 -162.32 23.45 0.1 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.19 178.908 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . 179.11 28.63 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.457 -178.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . 0.517 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 28.9 t70 -81.7 147.22 58.42 Favored Pre-proline 0 C--N 1.318 -0.771 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 176.535 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . 0.517 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 83.9 Cg_exo -47.06 -24.92 3.68 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.07 1.847 . . . . 0.0 112.849 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 77.8 mtm-85 -94.17 -28.46 15.64 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.518 HD21 ' HB2' ' X' ' 14' ' ' LEU . 50.2 mt -97.95 -16.97 19.48 Favored 'General case' 0 CA--C 1.514 -0.42 0 O-C-N 122.14 -0.35 . . . . 0.0 111.284 -177.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.517 ' HA ' ' HB2' ' X' ' 15' ' ' SER . 14.2 tt -73.02 -8.77 12.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 172.492 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . 0.528 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 45.8 mt-10 -93.65 -62.61 1.33 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.637 -1.165 . . . . 0.0 110.754 173.318 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 11.0 m -90.05 -27.93 19.38 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -168.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.518 ' HB2' HD21 ' X' ' 10' ' ' LEU . 9.5 tt -94.28 -44.39 7.97 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.517 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 12.9 t -66.71 -18.95 65.64 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.125 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . 0.528 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 0.0 OUTLIER -64.03 -44.27 93.03 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 175.239 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.554 ' SD ' HD12 ' X' ' 29' ' ' LEU . 62.1 mtt -69.86 -38.35 76.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.606 178.139 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . 0.403 ' HB2' ' HA ' ' X' ' 15' ' ' SER . 7.9 mp -62.12 -32.5 73.08 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.499 178.233 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 37.2 t -80.6 -44.35 19.08 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.331 -178.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 26.2 mmt -78.66 -32.21 47.07 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -175.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.6 46.86 0.82 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.363 -0.922 . . . . 0.0 112.124 -178.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -128.52 162.97 25.98 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 177.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 44.8 m -139.78 -143.25 0.16 Allowed 'General case' 0 C--N 1.315 -0.91 0 C-N-CA 120.576 -0.45 . . . . 0.0 109.789 178.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.713 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 21.8 p-10 -99.72 128.23 45.82 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.94 0.4 . . . . 0.0 110.272 173.395 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . 0.784 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 42.9 tp10 -83.71 56.99 3.86 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.751 0.786 . . . . 0.0 109.223 176.229 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 133.31 -87.33 0.27 Allowed Glycine 0 N--CA 1.446 -0.686 0 CA-C-N 114.827 -1.079 . . . . 0.0 111.476 -174.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -172.27 29.28 0.11 Allowed Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 121.041 -0.599 . . . . 0.0 111.741 177.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.784 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 53.3 p-90 -95.92 -9.66 30.74 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 -176.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.713 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 10.6 tp -59.69 -19.96 53.15 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 121.826 -0.546 . . . . 0.0 110.761 -175.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 30' ' ' THR . . . . . 0.641 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 38.7 p -93.83 -48.03 6.48 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 121.993 -0.442 . . . . 0.0 110.624 169.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 42.7 mmm-85 -63.71 -61.22 2.45 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.287 -176.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.634 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 2.0 tm? -50.33 -52.38 37.31 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.84 -178.276 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.418 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 62.3 mt -61.06 -62.01 2.16 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.305 -179.514 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . 0.641 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.0 OUTLIER -42.8 -54.69 4.0 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -175.966 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 29.6 p -68.39 -24.74 64.81 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -175.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 61.0 mttm -105.19 37.4 2.2 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.978 178.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 42.05 41.86 2.16 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.715 0.806 . . . . 0.0 112.841 -178.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.455 ' CD1' HD23 ' X' ' 10' ' ' LEU . 74.3 m-85 65.96 66.22 0.5 Allowed 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.033 177.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . 0.474 ' O ' ' HB2' ' X' ' 43' ' ' ALA . 38.9 t70 -104.25 120.18 40.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.257 -179.238 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.541 ' HB ' HD11 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.26 -3.6 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.155 173.719 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.8 -41.01 97.76 Favored Glycine 0 N--CA 1.443 -0.878 0 C-N-CA 120.402 -0.904 . . . . 0.0 111.961 177.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.99 -20.27 16.84 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.156 -0.522 . . . . 0.0 111.18 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.474 ' HB2' ' O ' ' X' ' 39' ' ' ASP . . . -74.33 -31.71 62.54 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.011 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.748 ' HA ' HG13 ' X' ' 47' ' ' ILE . 6.5 mp -75.43 -19.15 59.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.199 179.428 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . 0.543 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.5 t70 -70.33 -27.14 64.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.87 0.367 . . . . 0.0 110.502 177.287 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 17.9 p -95.83 -23.44 16.92 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.748 HG13 ' HA ' ' X' ' 44' ' ' LEU . 2.4 pp -84.09 42.55 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 178.336 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . 0.406 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 1.5 mt-30 84.67 7.55 0.5 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.164 0.985 . . . . 0.0 112.801 172.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . 0.543 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 15.9 m-85 -122.36 68.57 0.95 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.082 0.468 . . . . 0.0 110.944 176.051 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 14.2 m -81.13 43.63 0.72 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.147 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -127.14 92.06 3.45 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 . . . . . 0 C--O 1.244 0.774 0 CA-C-O 118.584 -0.722 . . . . 0.0 109.82 -177.529 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.959 0 N-CA-C 112.013 -0.435 . . . . 0.0 112.013 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 27.2 m -81.13 115.58 57.11 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.742 0.306 . . . . 0.0 110.974 -178.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.413 ' C ' ' H ' ' X' ' 5' ' ' GLU . 2.9 Cg_exo -78.13 151.97 27.33 Favored 'Trans proline' 0 N--CA 1.463 -0.272 0 C-N-CA 123.106 2.537 . . . . 0.0 112.296 -178.241 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -75.63 38.12 0.55 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.825 2.35 . . . . 0.0 112.313 177.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . 0.413 ' H ' ' C ' ' X' ' 3' ' ' PRO . 8.0 pt-20 -153.48 15.24 0.51 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.106 -179.224 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -162.78 24.72 0.1 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.868 -179.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -78.36 147.3 72.05 Favored Pre-proline 0 C--O 1.216 -0.678 0 CA-C-N 114.462 -1.245 . . . . 0.0 108.17 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -44.99 -23.14 0.85 Allowed 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 122.728 2.285 . . . . 0.0 113.272 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . 0.638 ' HD2' ' CE2' ' X' ' 38' ' ' TYR . 78.3 mtm180 -93.2 -33.93 13.8 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.996 -0.547 . . . . 0.0 112.315 -179.583 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.452 ' HA ' HD22 ' X' ' 10' ' ' LEU . 83.8 mt -97.82 -19.02 18.41 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 122.212 -0.305 . . . . 0.0 111.019 -176.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.57 ' O ' HD13 ' X' ' 11' ' ' ILE . 0.3 OUTLIER -75.54 -9.9 13.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 170.826 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -96.44 -58.28 2.1 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.549 171.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 45.9 t -96.35 -24.9 15.95 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 -167.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.423 ' HB3' ' HB3' ' X' ' 10' ' ' LEU . 9.8 tt -95.77 -43.87 7.68 Favored 'General case' 0 CA--C 1.508 -0.659 0 CA-C-N 118.997 0.817 . . . . 0.0 109.823 -176.566 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.545 ' HA ' ' HB3' ' X' ' 18' ' ' LEU . 61.4 p -74.91 -9.78 58.87 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.968 -178.476 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . 0.461 ' OE1' HG22 ' X' ' 40' ' ' ILE . 5.1 tm0? -57.45 -60.54 3.5 Favored 'General case' 0 C--N 1.339 0.111 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 174.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.801 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 0.6 OUTLIER -73.77 -29.08 61.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.654 178.614 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . 0.545 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 26.4 tp -61.77 -30.97 71.15 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.504 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 23.1 t -97.42 -34.18 11.13 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 120.586 0.231 . . . . 0.0 111.254 -177.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' X' X ' 20' ' ' MET . . . . . 0.454 ' HE1' ' HB3' ' X' ' 20' ' ' MET . 81.1 mtp -79.61 -12.88 59.82 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -176.373 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.68 42.1 3.21 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.272 -0.966 . . . . 0.0 113.264 176.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.801 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 46.0 m-85 -129.16 161.13 30.81 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 174.448 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 55.0 m -139.77 -177.83 5.14 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.707 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.522 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 6.2 p-10 -77.12 115.85 17.26 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.293 0.568 . . . . 0.0 109.983 175.347 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -86.11 59.68 5.78 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.117 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.73 -4.68 2.21 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.27 -0.967 . . . . 0.0 113.189 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . 0.404 ' HA2' ' OD2' ' X' ' 24' ' ' ASP . . . 86.09 21.04 53.95 Favored Glycine 0 N--CA 1.445 -0.744 0 C-N-CA 120.44 -0.886 . . . . 0.0 111.546 -177.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.554 ' HA ' ' HG3' ' X' ' 31' ' ' ARG . 46.2 p-90 -84.85 -10.74 56.84 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-O 119.625 -0.226 . . . . 0.0 111.432 -179.309 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.578 ' O ' HD13 ' X' ' 33' ' ' LEU . 48.5 tp -59.01 -28.27 66.24 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.896 -0.503 . . . . 0.0 111.785 -170.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 28.9 m -94.37 -11.08 30.66 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 120.948 0.404 . . . . 0.0 111.118 174.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . 0.554 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 5.0 mtp-105 -96.04 -53.12 3.77 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.148 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 8.8 tp -64.85 -77.54 0.06 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.867 0.692 . . . . 0.0 112.867 -172.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.724 ' HA ' ' HB2' ' X' ' 36' ' ' LYS . 1.6 pp -69.4 -16.93 63.61 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -171.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -64.33 -33.75 76.57 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.5 0.191 . . . . 0.0 110.98 178.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 78.1 p -95.69 -16.88 21.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.972 0.415 . . . . 0.0 110.383 175.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . 0.724 ' HB2' ' HA ' ' X' ' 33' ' ' LEU . 43.9 mttp -87.81 38.71 0.85 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.603 177.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 43.73 40.08 2.85 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.842 0.857 . . . . 0.0 112.953 -178.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.638 ' CE2' ' HD2' ' X' ' 9' ' ' ARG . 72.8 m-85 58.74 71.35 0.59 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.713 173.368 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -125.59 142.43 51.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.736 0.779 . . . . 0.0 112.705 -179.168 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.475 ' O ' ' HB2' ' X' ' 44' ' ' LEU . 0.1 OUTLIER -91.39 -3.98 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.27 173.594 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.12 -42.96 97.85 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.967 -178.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -94.17 -23.73 17.8 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.272 -0.464 . . . . 0.0 110.549 175.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.502 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -66.53 -32.57 74.0 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.093 178.355 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.759 HD11 HD13 ' X' ' 47' ' ' ILE . 3.3 tp -66.24 -35.87 81.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.236 0.541 . . . . 0.0 110.616 -179.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . 0.54 ' OD1' ' HA ' ' X' ' 50' ' ' SER . 18.9 t70 -69.1 -34.27 74.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.019 178.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 44.9 p -91.63 -24.31 19.58 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -174.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.759 HD13 HD11 ' X' ' 44' ' ' LEU . 5.7 pt -72.19 -26.14 24.49 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 119.886 -0.726 . . . . 0.0 111.504 -176.444 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . 0.449 HE21 ' HB2' ' X' ' 48' ' ' GLN . 0.0 OUTLIER -173.94 -45.37 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 O-C-N 123.12 0.262 . . . . 0.0 111.081 178.679 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . 0.533 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 51.9 m-85 -84.47 76.25 10.17 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -173.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 50' ' ' SER . . . . . 0.54 ' HA ' ' OD1' ' X' ' 45' ' ' ASP . 26.0 m -87.73 9.6 21.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.33 0.586 . . . . 0.0 110.608 175.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . 0.431 ' O ' ' HD2' ' X' ' 51' ' ' LYS . 0.0 OUTLIER -146.92 122.55 10.48 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.575 175.07 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 80.9 m-70 . . . . . 0 C--O 1.245 0.835 0 CA-C-O 118.302 -0.856 . . . . 0.0 110.469 -175.571 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.889 0 N-CA-C 112.082 -0.407 . . . . 0.0 112.082 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 29.6 m -125.33 110.15 26.46 Favored Pre-proline 0 C--N 1.328 -0.334 0 O-C-N 122.68 -0.306 . . . . 0.0 111.445 -179.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.459 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 7.5 Cg_exo -69.04 137.24 37.06 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.695 2.264 . . . . 0.0 110.95 175.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 16.4 Cg_exo -71.07 17.2 0.27 Allowed 'Trans proline' 0 N--CA 1.475 0.411 0 C-N-CA 122.935 2.423 . . . . 0.0 114.081 -175.017 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . 0.424 ' H ' ' C ' ' X' ' 3' ' ' PRO . 50.1 mt-10 -139.31 15.93 2.59 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.476 0.655 . . . . 0.0 109.687 173.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -162.64 46.55 0.15 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.843 -1.071 . . . . 0.0 108.726 178.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . 0.523 ' HB2' ' H ' ' X' ' 10' ' ' LEU . 2.9 m-20 -71.26 156.05 92.23 Favored Pre-proline 0 CA--C 1.505 -0.77 0 CA-C-N 114.895 -1.048 . . . . 0.0 108.622 178.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -58.44 -12.26 13.27 Favored 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 121.084 1.189 . . . . 0.0 110.489 169.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 37.3 mtp85 -93.34 -43.04 8.98 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 114.784 -1.098 . . . . 0.0 111.551 174.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.657 HD23 ' HB2' ' X' ' 14' ' ' LEU . 32.0 mt -88.13 -21.94 24.37 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -173.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.481 ' O ' ' HB3' ' X' ' 15' ' ' SER . 15.1 tt -69.52 -17.12 21.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 172.528 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 50.9 mm-40 -95.05 -64.95 1.01 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.684 173.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' X' X ' 13' ' ' SER . . . . . 0.464 ' HA ' HG22 ' X' ' 40' ' ' ILE . 13.2 m -81.6 -26.55 34.8 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -169.139 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.657 ' HB2' HD23 ' X' ' 10' ' ' LEU . 0.2 OUTLIER -94.98 -49.32 5.6 Favored 'General case' 0 CA--C 1.506 -0.741 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 -179.823 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.481 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 21.9 t -62.59 -27.03 68.91 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.521 -176.639 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -51.14 -49.24 61.23 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 120.938 0.399 . . . . 0.0 110.662 176.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.755 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 10.5 ptm -97.96 -31.45 12.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.828 -176.186 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 29.2 tp -64.35 -31.94 73.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.822 0.344 . . . . 0.0 111.071 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 15.8 m -98.73 -7.52 27.56 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.443 -178.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' X' X ' 20' ' ' MET . . . . . 0.427 ' HA ' ' CE ' ' X' ' 20' ' ' MET . 0.1 OUTLIER -92.63 -31.66 15.06 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.841 0.353 . . . . 0.0 110.808 -179.122 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.58 31.49 2.14 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.671 -0.776 . . . . 0.0 111.826 -176.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.755 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 20.4 m-30 -116.46 155.97 27.66 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 175.362 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -140.04 -159.43 0.96 Allowed 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 120.101 -0.639 . . . . 0.0 110.261 -179.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.989 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 18.8 p-10 -85.93 114.73 23.07 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.396 0.617 . . . . 0.0 109.542 172.164 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . 0.458 ' HB2' ' HE1' ' X' ' 28' ' ' TRP . 5.7 mm-40 -84.01 54.42 2.92 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.571 -178.344 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 139.77 -17.23 3.03 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.405 -177.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 111.65 7.69 23.65 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.173 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.458 ' HE1' ' HB2' ' X' ' 25' ' ' GLU . 51.7 p-90 -83.55 -22.26 32.45 Favored 'General case' 0 C--O 1.208 -1.112 0 CA-C-O 119.087 -0.483 . . . . 0.0 111.992 -178.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.989 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 11.6 tp -50.13 -34.67 22.97 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 118.898 0.772 . . . . 0.0 111.577 -174.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.53 -30.24 52.71 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 175.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 16.4 mtp180 -92.36 -55.52 3.38 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -175.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.498 HD13 ' C ' ' X' ' 32' ' ' LEU . 2.8 tm? -43.15 -59.89 1.88 Allowed 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.29 1.036 . . . . 0.0 111.996 -178.267 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.764 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.8 mp -70.58 -36.67 73.72 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.569 -174.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -52.63 -46.74 67.22 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -173.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 22.5 p -77.76 -12.09 59.94 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.801 0.334 . . . . 0.0 111.694 -178.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 50.1 mttp -112.51 37.66 2.99 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.114 -178.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 41.62 39.77 1.22 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.628 0.771 . . . . 0.0 112.172 -177.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.764 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 31.2 m-85 66.94 77.76 0.27 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.907 -179.329 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -106.19 126.7 52.54 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.675 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.645 ' O ' HD12 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.22 -12.97 9.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 120.932 0.396 . . . . 0.0 110.201 172.208 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -60.22 -41.13 98.13 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.631 179.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.87 -17.43 21.11 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.751 0.31 . . . . 0.0 111.085 177.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.547 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -69.97 -42.97 72.43 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.658 177.207 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.823 HD13 HD11 ' X' ' 47' ' ' ILE . 8.9 mp -62.47 -27.34 69.06 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.085 -178.391 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . 0.466 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 33.5 t70 -55.13 -39.6 69.61 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.814 0.34 . . . . 0.0 111.709 179.026 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 1.1 p -95.99 -24.48 16.35 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 -177.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.823 HD11 HD13 ' X' ' 44' ' ' LEU . 8.3 pt -82.78 44.66 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 178.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 82.68 25.5 0.15 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.135 0.974 . . . . 0.0 113.14 171.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . 0.466 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 66.2 m-85 -141.6 63.99 1.41 Allowed 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 110.34 -0.244 . . . . 0.0 110.34 174.098 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 2.6 t -81.79 8.95 8.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.953 0.406 . . . . 0.0 112.053 -174.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -134.34 25.77 3.81 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.63 173.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 12.8 p80 . . . . . 0 C--O 1.247 0.924 0 O-C-N 124.593 1.183 . . . . 0.0 112.816 -178.406 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.735 0 N-CA-C 112.155 -0.378 . . . . 0.0 112.155 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 65.7 m -72.06 133.79 83.56 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.571 0.224 . . . . 0.0 110.787 179.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.455 ' C ' ' H ' ' X' ' 5' ' ' GLU . 66.5 Cg_endo -76.73 151.91 32.4 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.21 1.94 . . . . 0.0 111.46 177.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.64 22.94 0.24 Allowed 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.71 2.273 . . . . 0.0 113.278 -177.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . 0.455 ' H ' ' C ' ' X' ' 3' ' ' PRO . 51.6 mt-10 -108.89 -0.28 19.83 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.389 0.614 . . . . 0.0 109.929 174.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -172.98 37.95 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.472 -1.24 . . . . 0.0 109.706 -178.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . 0.483 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 0.3 OUTLIER -67.35 152.86 95.75 Favored Pre-proline 0 CA--C 1.512 -0.505 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.026 177.248 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . 0.483 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 23.6 Cg_endo -59.45 -13.17 19.6 Favored 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 121.452 1.435 . . . . 0.0 110.574 171.486 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -93.78 -50.0 5.57 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.424 -1.262 . . . . 0.0 111.823 175.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.898 HD21 ' HB2' ' X' ' 14' ' ' LEU . 89.5 mt -94.68 -17.02 22.62 Favored 'General case' 0 C--O 1.217 -0.608 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -169.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.534 HD12 HG21 ' X' ' 11' ' ' ILE . 0.2 OUTLIER -65.91 -25.23 35.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 175.471 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -94.87 -42.58 8.62 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.508 174.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 4.0 t -94.97 -36.98 11.36 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 -166.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.898 ' HB2' HD21 ' X' ' 10' ' ' LEU . 8.4 tt -94.63 -42.82 8.59 Favored 'General case' 0 CA--C 1.51 -0.558 0 CA-C-O 121.51 0.671 . . . . 0.0 109.209 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.512 ' HB2' ' O ' ' X' ' 11' ' ' ILE . 46.3 m -64.8 -17.27 64.07 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.123 -179.299 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . 0.403 ' OE1' ' HE3' ' X' ' 17' ' ' MET . 8.4 tm0? -58.46 -63.04 1.42 Allowed 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.116 175.705 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.824 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 0.9 OUTLIER -76.13 -25.24 55.15 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.799 -0.361 . . . . 0.0 111.172 179.884 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . 0.506 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 37.2 tp -61.54 -34.8 76.18 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.817 0.342 . . . . 0.0 110.865 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 29.9 p -89.07 -42.21 11.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.574 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' X' X ' 20' ' ' MET . . . . . 0.434 ' HE1' ' HB3' ' X' ' 20' ' ' MET . 91.4 mmm -66.53 -32.81 74.4 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -176.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 109.83 46.37 0.9 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.218 -0.991 . . . . 0.0 111.931 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.824 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 95.4 m-85 -130.63 172.21 12.2 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 175.679 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 50.2 m -155.27 -173.86 4.73 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.547 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 30.7 p30 -83.39 154.11 24.19 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.939 0.4 . . . . 0.0 110.125 172.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . 0.499 ' HG2' ' CD1' ' X' ' 28' ' ' TRP . 7.5 pt-20 -82.59 -7.41 59.65 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.197 -174.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -170.66 -28.91 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.713 -178.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . 0.459 ' HA2' ' OD2' ' X' ' 24' ' ' ASP . . . 148.39 31.09 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 119.983 -1.103 . . . . 0.0 112.937 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.819 ' HB2' ' HB2' ' X' ' 32' ' ' LEU . 40.4 p-90 -96.17 -13.89 23.19 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 178.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.587 HD13 HD21 ' X' ' 33' ' ' LEU . 30.4 tp -58.11 -15.2 8.65 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 122.019 -0.426 . . . . 0.0 111.584 -174.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 82.7 p -94.46 -56.35 2.84 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 121.823 -0.548 . . . . 0.0 110.614 169.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . 0.673 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -69.72 -51.4 34.65 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -174.761 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.819 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 3.4 tm? -51.05 -54.79 21.61 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.74 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 10.8 mp -54.95 -60.12 3.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.825 177.017 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -40.0 -48.98 2.49 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.868 0.73 . . . . 0.0 112.556 -179.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 7.6 m -59.57 -51.28 70.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.022 -0.536 . . . . 0.0 112.017 -174.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.57 37.4 1.2 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 40.2 t30 61.98 61.01 1.43 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.4 176.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.74 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 81.0 m-85 43.9 52.86 6.5 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.351 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . 0.586 ' O ' ' HB3' ' X' ' 43' ' ' ALA . 42.4 t0 -82.37 130.74 35.17 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.46 -173.159 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.608 ' O ' HD11 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.69 -12.2 9.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.058 169.688 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.51 -41.73 83.62 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.457 -0.877 . . . . 0.0 112.135 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -91.31 -19.57 22.82 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.339 -0.431 . . . . 0.0 110.943 177.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.586 ' HB3' ' O ' ' X' ' 39' ' ' ASP . . . -71.58 -39.69 70.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.789 178.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.761 HD12 HD13 ' X' ' 47' ' ' ILE . 7.0 mp -65.55 -37.09 85.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.886 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -54.14 -35.92 62.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.233 176.189 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 7.4 p -96.25 -22.12 17.44 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -177.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.761 HD13 HD12 ' X' ' 44' ' ' LEU . 28.0 pt -83.97 42.78 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.8 -0.562 . . . . 0.0 111.715 176.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 72.85 20.46 3.59 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.405 0.682 . . . . 0.0 112.094 174.377 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . 0.484 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 9.7 m-30 -121.74 55.81 1.09 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 173.658 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 6.8 t -83.44 3.67 31.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.353 0.596 . . . . 0.0 110.673 -178.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . 0.448 ' C ' ' HD3' ' X' ' 51' ' ' LYS . 0.5 OUTLIER -156.75 129.41 7.65 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.006 -0.997 . . . . 0.0 108.551 173.128 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 . . . . . 0 C--O 1.247 0.93 0 CA-C-O 118.331 -0.842 . . . . 0.0 110.233 -178.522 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.665 0 N-CA-C 112.044 -0.422 . . . . 0.0 112.044 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 35.1 t -111.14 107.77 57.4 Favored Pre-proline 0 C--N 1.326 -0.423 0 O-C-N 122.817 -0.226 . . . . 0.0 110.679 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.435 ' HA ' ' HB2' ' X' ' 7' ' ' ASP . 47.4 Cg_endo -71.14 117.26 5.06 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.599 2.199 . . . . 0.0 112.398 -178.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -90.03 28.64 0.43 Allowed 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 122.501 2.134 . . . . 0.0 112.679 -179.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . 0.553 ' HA ' ' HG ' ' X' ' 10' ' ' LEU . 26.0 tt0 63.84 12.77 7.0 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.871 0.843 . . . . 0.0 109.844 -173.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -138.4 30.13 2.4 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.599 -1.182 . . . . 0.0 107.995 173.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . 0.535 ' O ' HG12 ' X' ' 11' ' ' ILE . 23.6 t70 -80.27 154.54 74.55 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 113.35 -1.75 . . . . 0.0 107.901 178.359 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . 0.441 ' HD2' ' CG ' ' X' ' 7' ' ' ASP . 68.8 Cg_exo -49.31 -21.66 4.9 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 121.98 1.787 . . . . 0.0 112.461 177.693 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . 0.427 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 34.6 mmt180 -87.27 -26.62 23.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.35 177.31 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.553 ' HG ' ' HA ' ' X' ' 5' ' ' GLU . 4.4 mm? -98.01 -33.39 11.21 Favored 'General case' 0 C--O 1.222 -0.38 0 O-C-N 122.292 -0.255 . . . . 0.0 110.75 -175.653 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.535 HG12 ' O ' ' X' ' 7' ' ' ASP . 18.1 pt -68.97 -12.53 16.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 170.287 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -96.56 -66.49 0.9 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.148 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 34.6 t -83.77 -23.23 31.62 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -170.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.451 ' HB2' HD11 ' X' ' 10' ' ' LEU . 2.6 tm? -92.51 -42.53 9.66 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 177.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.507 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 43.9 t -62.75 -24.93 67.95 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.209 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . 0.48 HE21 ' HB3' ' X' ' 16' ' ' GLN . 0.0 OUTLIER -55.17 -43.57 74.41 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.908 0.385 . . . . 0.0 110.551 176.99 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.606 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 9.5 ptm -96.66 -27.78 14.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.545 -178.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . 0.438 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 35.6 tp -64.22 -40.5 96.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.942 0.401 . . . . 0.0 110.815 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 19.0 m -91.72 -4.51 54.99 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.71 -176.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 16.7 tpt -102.78 -33.24 9.45 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.379 -179.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.65 46.52 0.67 Allowed Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.211 -0.995 . . . . 0.0 112.266 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.643 ' CZ ' ' HE1' ' X' ' 49' ' ' TYR . 47.5 m-85 -125.63 163.62 22.38 Favored 'General case' 0 CA--C 1.507 -0.695 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 175.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 23' ' ' SER . . . . . 0.41 ' O ' HG23 ' X' ' 47' ' ' ILE . 41.4 m -145.82 171.09 15.3 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 120.426 -0.51 . . . . 0.0 109.95 -179.561 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.458 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.6 p30 -69.51 134.0 48.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.2 0.524 . . . . 0.0 110.628 177.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . 0.532 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 33.3 tt0 -87.18 55.54 3.6 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.546 0.688 . . . . 0.0 109.379 177.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 136.01 -95.05 0.24 Allowed Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.371 -0.832 . . . . 0.0 111.918 -176.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -166.73 29.78 0.19 Allowed Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.991 -0.623 . . . . 0.0 111.673 178.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.532 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 53.6 p-90 -92.96 -14.08 27.96 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -176.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.486 ' HA ' ' CE3' ' X' ' 28' ' ' TRP . 13.8 tp -57.1 -24.52 54.67 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -168.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 77.1 p -82.71 -48.56 10.73 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.298 170.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 31.8 mtt-85 -60.07 -57.97 10.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.977 -177.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.576 HD12 ' HB3' ' X' ' 42' ' ' ALA . 2.3 tm? -50.28 -51.12 47.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.064 -176.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.452 HD13 ' O ' ' X' ' 29' ' ' LEU . 11.0 mp -62.64 -64.31 0.96 Allowed 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.27 179.554 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -43.42 -43.11 5.06 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -178.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 28.0 m -64.65 -52.24 58.4 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -176.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . 0.592 ' HB2' ' HB2' ' X' ' 39' ' ' ASP . 0.0 OUTLIER -93.38 40.28 1.06 Allowed 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -176.638 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 5.7 p-10 44.29 51.11 7.65 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.324 0.649 . . . . 0.0 111.84 -176.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.427 ' CD2' ' HB3' ' X' ' 9' ' ' ARG . 57.8 m-85 64.37 73.39 0.43 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 114.467 -1.242 . . . . 0.0 111.003 178.147 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . 0.592 ' HB2' ' HB2' ' X' ' 36' ' ' LYS . 2.5 t0 -97.35 117.72 32.23 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.045 -0.979 . . . . 0.0 111.127 -176.379 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.639 ' O ' HD11 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.1 -18.38 7.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 121.102 0.477 . . . . 0.0 109.791 171.367 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.18 -34.12 89.08 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.543 179.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . 0.576 ' HB3' HD12 ' X' ' 32' ' ' LEU . . . -100.01 -20.61 15.99 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.729 0.3 . . . . 0.0 111.282 177.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.533 ' HB2' ' O ' ' X' ' 39' ' ' ASP . . . -72.47 -36.22 68.41 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.45 179.246 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.724 HD12 HD13 ' X' ' 47' ' ' ILE . 7.0 mp -63.68 -31.64 72.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.098 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . 0.577 ' HB2' ' HE1' ' X' ' 52' ' ' HIS . 10.9 t70 -55.18 -48.71 73.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.949 177.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 3.3 p -85.98 -5.61 59.19 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 -177.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.724 HD13 HD12 ' X' ' 44' ' ' LEU . 30.1 pt -106.24 43.3 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 O-C-N 121.902 -0.499 . . . . 0.0 111.272 175.151 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 1.1 mp0 85.05 22.86 0.09 Allowed 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.657 1.183 . . . . 0.0 113.308 173.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . 0.643 ' HE1' ' CZ ' ' X' ' 22' ' ' PHE . 32.2 m-85 -130.11 49.05 2.32 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 110.224 -0.288 . . . . 0.0 110.224 172.413 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 8.4 t -75.74 2.63 11.62 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.095 0.474 . . . . 0.0 111.611 -175.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 59.4 tttm -130.39 94.78 3.74 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.55 173.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . 0.577 ' HE1' ' HB2' ' X' ' 45' ' ' ASP . 59.2 m80 . . . . . 0 C--O 1.243 0.734 0 CA-C-O 118.321 -0.847 . . . . 0.0 110.375 -177.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.832 0 N-CA-C 112.296 -0.322 . . . . 0.0 112.296 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' X' X ' 2' ' ' SER . . . . . 0.808 ' HB2' ' HA ' ' X' ' 7' ' ' ASP . 20.1 m -122.78 158.85 55.78 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 179.517 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.423 ' HD2' ' HB3' ' X' ' 2' ' ' SER . 29.9 Cg_endo -63.46 127.34 19.67 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.077 1.852 . . . . 0.0 110.894 177.4 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . 0.613 ' O ' ' HB2' ' X' ' 5' ' ' GLU . 87.7 Cg_exo -51.92 91.18 0.03 OUTLIER 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 123.388 2.726 . . . . 0.0 113.711 -174.423 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . 0.613 ' HB2' ' O ' ' X' ' 4' ' ' PRO . 60.5 tt0 156.93 -23.82 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.756 1.222 . . . . 0.0 108.892 179.042 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -130.26 31.99 4.54 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.259 -1.337 . . . . 0.0 110.397 179.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . 0.808 ' HA ' ' HB2' ' X' ' 2' ' ' SER . 1.2 m-20 -73.14 156.8 89.15 Favored Pre-proline 0 CA--C 1.509 -0.601 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.966 177.825 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -55.07 -12.76 5.5 Favored 'Trans proline' 0 CA--C 1.536 0.576 0 C-N-CA 121.307 1.338 . . . . 0.0 110.987 169.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -90.99 -49.13 6.59 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.01 177.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.461 ' HB3' ' HB3' ' X' ' 14' ' ' LEU . 53.9 mt -97.85 -17.55 19.24 Favored 'General case' 0 C--O 1.22 -0.491 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -173.168 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.596 ' O ' ' HB3' ' X' ' 15' ' ' SER . 0.5 OUTLIER -66.75 -21.33 28.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.876 0.846 . . . . 0.0 108.932 174.083 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -95.15 -45.83 7.04 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.584 175.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 8.1 t -94.05 -36.3 12.18 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -169.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.507 HD13 HD22 ' X' ' 29' ' ' LEU . 42.1 tp -92.71 -43.44 9.06 Favored 'General case' 0 CA--C 1.51 -0.582 0 O-C-N 121.682 -0.636 . . . . 0.0 109.791 179.711 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.596 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 33.4 t -61.43 -25.64 67.34 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.818 -175.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . 0.48 ' NE2' ' HB3' ' X' ' 17' ' ' MET . 4.2 pp0? -73.01 -30.58 63.87 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 120.584 -0.446 . . . . 0.0 111.21 179.22 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.745 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 23.7 ptp -90.14 -27.86 19.33 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.28 177.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 27.7 tp -63.93 -28.59 69.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.795 178.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 8.9 p -93.69 -44.21 8.28 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.901 -179.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 25.0 mmt -69.99 -24.09 63.26 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -175.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.82 47.39 1.27 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.087 -1.054 . . . . 0.0 112.555 -179.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.745 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 47.5 m-85 -127.06 144.5 51.01 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 176.274 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 14.3 m -144.39 169.95 16.95 Favored 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 119.855 -0.738 . . . . 0.0 111.233 -173.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.537 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 8.4 p-10 -71.73 131.19 42.76 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.798 173.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . 0.511 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 16.0 tp10 -69.21 -69.18 0.35 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.718 -177.475 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -97.47 -20.29 22.88 Favored Glycine 0 C--N 1.316 -0.539 0 C-N-CA 120.951 -0.643 . . . . 0.0 113.169 -179.236 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.52 32.67 0.81 Allowed Glycine 0 CA--C 1.507 -0.407 0 C-N-CA 120.537 -0.839 . . . . 0.0 111.211 -176.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.541 ' HA ' ' HG3' ' X' ' 31' ' ' ARG . 23.9 p-90 -96.15 -3.79 43.86 Favored 'General case' 0 C--O 1.217 -0.647 0 CA-C-N 115.173 -0.513 . . . . 0.0 111.452 -176.695 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.537 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 11.0 tp -60.19 -32.26 70.92 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 122.176 -0.328 . . . . 0.0 111.348 -172.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 4.6 m -79.89 -15.39 57.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.965 0.412 . . . . 0.0 110.821 175.353 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . 0.541 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 11.3 mtm180 -96.33 -60.24 1.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.033 0.444 . . . . 0.0 111.168 -178.122 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.437 ' C ' HD11 ' X' ' 32' ' ' LEU . 2.7 tm? -49.31 -72.63 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.773 -178.065 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.492 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.9 mp -56.75 -45.77 81.82 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.787 -174.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.59 -51.76 34.98 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -176.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 2.2 m -77.64 -7.44 56.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.073 0.463 . . . . 0.0 111.107 -177.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -115.06 37.83 3.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.362 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 11.7 p30 49.74 33.04 5.73 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.02 0.928 . . . . 0.0 112.777 179.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.492 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 67.8 m-85 63.83 70.15 0.52 Allowed 'General case' 0 C--O 1.234 0.267 0 C-N-CA 122.955 0.502 . . . . 0.0 110.818 178.196 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . 0.521 ' O ' ' HB2' ' X' ' 43' ' ' ALA . 44.7 p-10 -111.42 141.04 45.49 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.683 0.754 . . . . 0.0 112.72 -178.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.437 ' O ' ' HB2' ' X' ' 44' ' ' LEU . 0.0 OUTLIER -92.6 -6.17 10.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.385 170.244 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.21 -44.19 76.83 Favored Glycine 0 CA--C 1.505 -0.565 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.435 -177.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.84 -18.49 20.33 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 120.827 0.346 . . . . 0.0 110.831 177.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.521 ' HB2' ' O ' ' X' ' 39' ' ' ASP . . . -71.63 -31.92 67.4 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.778 177.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.71 ' HA ' HD13 ' X' ' 47' ' ' ILE . 6.1 tp -65.14 -31.54 72.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.111 0.481 . . . . 0.0 110.443 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -73.94 -27.55 61.07 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.847 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 22.9 p -97.15 -31.12 12.63 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 -175.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.71 HD13 ' HA ' ' X' ' 44' ' ' LEU . 2.1 pt -64.63 -26.93 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -171.368 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -167.74 -39.09 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 120.77 0.319 . . . . 0.0 111.077 177.024 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 60.2 m-85 -78.87 -159.22 0.17 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.94 -177.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 17.1 p -178.73 41.76 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.297 -179.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -138.96 16.22 2.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.049 0.452 . . . . 0.0 110.791 -175.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 . . . . . 0 C--O 1.245 0.819 0 CA-C-O 118.281 -0.866 . . . . 0.0 111.549 179.596 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.829 0 N-CA-C 112.3 -0.32 . . . . 0.0 112.3 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 5.1 p -83.91 113.13 45.68 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 120.667 0.27 . . . . 0.0 110.613 178.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.401 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 71.8 Cg_endo -86.23 142.44 7.38 Favored 'Trans proline' 0 C--O 1.236 0.39 0 C-N-CA 122.427 2.085 . . . . 0.0 113.091 -175.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 4.5 Cg_exo -78.29 44.13 1.55 Allowed 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.455 2.77 . . . . 0.0 112.024 177.015 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -162.33 26.32 0.11 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -174.32 42.42 0.01 OUTLIER 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 -177.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -102.02 150.03 37.08 Favored Pre-proline 0 C--N 1.317 -0.822 0 CA-C-N 114.191 -1.368 . . . . 0.0 108.127 -176.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -45.24 -25.87 2.15 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.33 2.02 . . . . 0.0 113.11 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 50.5 mtp85 -92.95 -35.0 13.54 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 178.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 97.1 mt -88.28 -18.03 29.43 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 116.8 -0.182 . . . . 0.0 110.81 -177.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.488 HG21 HD13 ' X' ' 11' ' ' ILE . 0.4 OUTLIER -63.83 -26.04 39.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.639 0.733 . . . . 0.0 109.272 171.318 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . 0.542 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 5.3 mm-40 -85.81 -45.24 11.77 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.368 176.596 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 11.2 p -96.09 -43.14 7.9 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 113.858 1.058 . . . . 0.0 113.858 -169.44 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . . . . . . . . . 2.9 tt -93.09 -45.44 7.9 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -176.224 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.479 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 33.1 m -68.5 -14.56 63.09 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.414 179.532 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . 0.542 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 0.7 OUTLIER -62.3 -65.95 0.61 Allowed 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 171.106 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.464 ' CB ' ' HB2' ' X' ' 22' ' ' PHE . 70.5 mtm -62.71 -39.46 94.08 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.874 -179.051 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 30.0 tp -61.09 -34.4 74.87 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -177.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 27.8 t -94.99 -8.44 36.9 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.602 0.239 . . . . 0.0 111.563 -177.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 50.5 tpp -101.74 -31.81 10.6 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.495 -178.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.26 34.31 1.64 Allowed Glycine 0 CA--C 1.511 -0.214 0 C-N-CA 120.581 -0.818 . . . . 0.0 111.501 -177.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.598 ' HD2' HD11 ' X' ' 47' ' ' ILE . 4.5 m-85 -121.76 138.77 54.23 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 176.415 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' X' X ' 23' ' ' SER . . . . . 0.497 ' O ' HG22 ' X' ' 47' ' ' ILE . 68.8 m -134.83 -128.15 0.16 Allowed 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.687 -176.268 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.585 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.6 p30 -120.98 136.96 54.86 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.751 173.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -68.46 -38.49 81.13 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.002 0.429 . . . . 0.0 110.385 -177.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -144.15 -0.14 1.07 Allowed Glycine 0 CA--C 1.519 0.33 0 C-N-CA 120.739 -0.743 . . . . 0.0 113.57 -178.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 123.09 28.67 1.33 Allowed Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.253 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.493 ' HZ2' ' CG2' ' X' ' 47' ' ' ILE . 32.9 p-90 -96.53 -8.76 31.16 Favored 'General case' 0 C--O 1.218 -0.597 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -178.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.585 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 20.3 tp -65.48 -17.39 64.52 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.069 0.461 . . . . 0.0 110.342 -176.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -93.8 -16.34 24.23 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.799 172.052 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . 0.42 ' HD3' ' HA ' ' X' ' 28' ' ' TRP . 19.8 mtp85 -97.33 -66.07 0.92 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.213 0.53 . . . . 0.0 112.106 -177.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.438 HD11 ' HD2' ' X' ' 36' ' ' LYS . 2.6 tm? -46.92 -73.47 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 114.093 -1.412 . . . . 0.0 112.682 -172.135 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.67 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.8 mp -50.49 -51.94 42.74 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-O 121.027 0.441 . . . . 0.0 111.346 -174.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 15.0 mp0 -50.67 -38.55 47.19 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.69 -178.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 5.3 m -86.46 -6.77 58.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.986 0.422 . . . . 0.0 110.993 -177.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . 0.438 ' HD2' HD11 ' X' ' 32' ' ' LEU . 93.7 mttt -125.41 38.83 4.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.891 -177.485 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 10.1 p30 56.91 22.45 7.15 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.247 1.019 . . . . 0.0 113.061 178.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.67 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 15.1 m-85 72.34 73.25 0.15 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.608 0.763 . . . . 0.0 110.11 177.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . 0.442 ' O ' ' HB2' ' X' ' 43' ' ' ALA . 45.4 p-10 -115.11 142.92 45.99 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.558 0.694 . . . . 0.0 112.581 -177.32 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.488 ' O ' HD12 ' X' ' 44' ' ' LEU . 0.1 OUTLIER -91.54 -19.5 7.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.082 173.09 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.12 -39.42 97.61 Favored Glycine 0 CA--C 1.506 -0.526 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.598 -177.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . 0.435 ' O ' ' HB3' ' X' ' 45' ' ' ASP . . . -96.39 -10.36 27.8 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.47 -0.365 . . . . 0.0 110.642 176.627 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.515 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -73.69 -47.4 39.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.039 178.11 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.488 HD12 ' O ' ' X' ' 40' ' ' ILE . 10.7 mp -58.81 -33.55 70.5 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.72 0.295 . . . . 0.0 110.616 177.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . 0.435 ' HB3' ' O ' ' X' ' 42' ' ' ALA . 15.4 t0 -55.19 -45.78 75.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.197 175.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 1.2 p -86.13 -6.04 59.09 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 114.187 1.18 . . . . 0.0 114.187 -171.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.627 ' HB ' ' NE2' ' X' ' 48' ' ' GLN . 0.1 OUTLIER -109.58 -26.78 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-N 119.371 0.987 . . . . 0.0 112.893 178.685 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . 0.627 ' NE2' ' HB ' ' X' ' 47' ' ' ILE . 1.5 mp0 -155.59 -44.75 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.83 0.347 . . . . 0.0 111.54 -176.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -84.01 49.86 1.72 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.29 -174.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 14.0 p -82.55 2.94 30.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.354 0.597 . . . . 0.0 110.961 178.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -117.81 124.72 49.07 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.774 -1.103 . . . . 0.0 108.026 172.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 54.3 m-70 . . . . . 0 C--O 1.243 0.734 0 CA-C-O 118.333 -0.841 . . . . 0.0 110.632 -173.92 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.777 0 N-CA-C 111.847 -0.501 . . . . 0.0 111.847 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 67.9 m -106.74 148.01 36.07 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-O 120.857 0.36 . . . . 0.0 111.333 -178.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.458 ' C ' ' H ' ' X' ' 5' ' ' GLU . 4.3 Cg_exo -75.52 154.51 40.14 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.953 2.436 . . . . 0.0 111.901 178.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -74.25 21.66 0.39 Allowed 'Trans proline' 0 CA--C 1.532 0.39 0 C-N-CA 122.412 2.075 . . . . 0.0 112.777 177.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . 0.458 ' H ' ' C ' ' X' ' 3' ' ' PRO . 13.6 mp0 -137.6 12.05 2.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.505 175.212 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -166.81 50.72 0.07 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.227 -177.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . 0.444 ' H ' ' HB2' ' X' ' 10' ' ' LEU . 0.3 OUTLIER -85.83 155.48 58.6 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-N 114.823 -1.081 . . . . 0.0 109.24 -178.924 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.65 -14.31 30.63 Favored 'Trans proline' 0 CA--C 1.533 0.434 0 C-N-CA 121.144 1.229 . . . . 0.0 110.293 170.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 80.2 mtm180 -93.73 -30.67 14.76 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.245 175.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.444 ' HB2' ' H ' ' X' ' 7' ' ' ASP . 96.5 mt -98.44 -18.43 18.25 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -174.597 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.475 ' O ' ' HB3' ' X' ' 15' ' ' SER . 44.8 mm -68.35 -16.24 20.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 170.29 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . 0.553 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 38.2 tt0 -93.4 -54.79 3.54 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.253 174.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 22.8 t -94.49 -27.94 15.72 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -169.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.516 HD23 ' HG ' ' X' ' 18' ' ' LEU . 9.3 tt -94.5 -47.6 6.48 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 -179.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.475 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 35.1 t -62.87 -28.82 70.3 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.094 -179.397 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . 0.553 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 0.0 OUTLIER -50.11 -43.08 51.51 Favored 'General case' 0 N--CA 1.463 0.186 0 O-C-N 123.507 0.505 . . . . 0.0 110.993 178.326 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.786 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 18.9 ptp -99.26 -30.46 12.23 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.736 -176.05 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . 0.516 ' HG ' HD23 ' X' ' 14' ' ' LEU . 3.1 mm? -65.44 -33.91 77.06 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -176.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 57.6 p -98.78 -12.16 21.16 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -178.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 12.3 tpt -88.04 -23.84 23.64 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.046 -178.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.93 44.93 0.72 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.621 179.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.786 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 4.0 m-85 -116.77 -174.26 2.54 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 176.36 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' X' X ' 23' ' ' SER . . . . . 0.457 ' O ' HG22 ' X' ' 47' ' ' ILE . 50.6 m -150.47 -161.03 1.25 Allowed 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.126 -0.63 . . . . 0.0 111.143 178.143 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.426 ' HA ' ' HE1' ' X' ' 28' ' ' TRP . 7.6 t70 -116.63 123.99 48.68 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 177.056 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -119.24 78.98 1.35 Allowed 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 120.829 0.347 . . . . 0.0 110.493 -177.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 124.74 -6.79 8.38 Favored Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.524 -0.846 . . . . 0.0 113.831 176.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.37 12.16 63.43 Favored Glycine 0 C--O 1.23 -0.13 0 C-N-CA 120.61 -0.805 . . . . 0.0 111.663 -177.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.705 ' HE3' ' HB3' ' X' ' 32' ' ' LEU . 31.2 p-90 -65.1 -34.52 78.6 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-N 115.127 -0.537 . . . . 0.0 111.572 -179.116 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . . . . . . . . . 51.8 tp -55.11 -22.5 16.78 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -165.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 51.2 p -94.66 -32.52 13.35 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.697 -0.627 . . . . 0.0 111.774 175.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . 0.425 ' CG ' ' HA ' ' X' ' 28' ' ' TRP . 31.8 ptt180 -94.22 -40.1 10.18 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -173.286 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.705 ' HB3' ' HE3' ' X' ' 28' ' ' TRP . 2.9 tm? -61.91 -56.27 21.04 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 123.401 0.68 . . . . 0.0 110.24 -178.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 10.5 mp -55.06 -50.4 69.21 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.504 177.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -47.35 -53.24 14.26 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.421 -177.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 19.7 m -73.62 -23.98 59.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.918 0.39 . . . . 0.0 110.966 -178.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . 0.494 ' HB3' ' HB3' ' X' ' 39' ' ' ASP . 14.7 mptt -95.33 33.67 1.54 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.515 178.27 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 15.0 p30 46.73 35.5 3.15 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.519 0.728 . . . . 0.0 112.446 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.417 ' CD1' HD22 ' X' ' 10' ' ' LEU . 72.3 m-85 66.94 69.9 0.39 Allowed 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.364 0.666 . . . . 0.0 110.038 -178.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . 0.587 ' O ' ' HB2' ' X' ' 43' ' ' ALA . 30.2 t70 -121.9 137.6 54.72 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.449 -173.272 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.602 ' O ' HD11 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.43 -8.5 10.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.735 173.096 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.85 -48.35 81.61 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.124 -177.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -93.48 -10.56 34.56 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.898 -0.651 . . . . 0.0 110.818 175.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.587 ' HB2' ' O ' ' X' ' 39' ' ' ASP . . . -68.29 -47.55 67.32 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.674 -179.245 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.602 HD11 ' O ' ' X' ' 40' ' ' ILE . 10.3 mp -71.57 -20.2 62.04 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.119 -178.408 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -70.45 -23.05 62.64 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.431 -178.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 33.0 p -95.3 -23.55 17.16 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -174.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.635 HD12 ' HD2' ' X' ' 22' ' ' PHE . 1.7 pt -102.8 -26.75 3.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -172.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . 0.633 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.7 mt-30 -157.31 -53.36 0.07 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 118.351 0.523 . . . . 0.0 111.412 -176.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . 0.438 ' O ' ' HB2' ' X' ' 50' ' ' SER . 15.3 m-85 -78.07 175.98 9.61 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 176.573 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' X' X ' 50' ' ' SER . . . . . 0.438 ' HB2' ' O ' ' X' ' 49' ' ' TYR . 2.1 t 174.75 71.98 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 176.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -162.32 143.64 10.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.006 -176.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 37.8 m80 . . . . . 0 C--N 1.32 -0.693 0 CA-C-O 118.739 -0.648 . . . . 0.0 109.757 175.937 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.985 0 N-CA-C 112.287 -0.325 . . . . 0.0 112.287 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 26.6 m -83.1 157.89 65.21 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 179.231 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -92.31 170.91 2.58 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 122.536 2.158 . . . . 0.0 112.446 -175.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . 1.013 ' HB2' ' HB2' ' X' ' 7' ' ' ASP . 23.4 Cg_exo -61.52 159.21 32.9 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.397 2.064 . . . . 0.0 111.766 176.647 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -77.04 93.14 3.8 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.179 -174.124 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . 56.59 64.4 1.69 Allowed 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 121.807 0.813 . . . . 0.0 109.987 -176.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . 1.013 ' HB2' ' HB2' ' X' ' 4' ' ' PRO . 13.3 t70 -94.28 149.47 36.78 Favored Pre-proline 0 C--N 1.315 -0.904 0 CA-C-N 114.606 -1.179 . . . . 0.0 108.237 -178.485 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . 0.738 ' O ' ' HB2' ' X' ' 12' ' ' GLU . 63.2 Cg_exo -48.28 -13.37 0.23 Allowed 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.022 2.482 . . . . 0.0 113.033 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . 0.439 ' HB3' ' CD1' ' X' ' 38' ' ' TYR . 10.4 mmt-85 -71.5 -48.81 46.61 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.394 173.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.705 HD22 HD12 ' X' ' 14' ' ' LEU . 24.3 mt -100.08 -41.16 7.26 Favored 'General case' 0 C--O 1.222 -0.366 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -178.2 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.606 ' O ' ' HB3' ' X' ' 15' ' ' SER . 11.2 tt -63.01 -22.3 30.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.1 0.476 . . . . 0.0 110.112 -179.057 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . 0.738 ' HB2' ' O ' ' X' ' 8' ' ' PRO . 0.4 OUTLIER -94.26 -59.58 1.92 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.809 172.378 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' X' X ' 13' ' ' SER . . . . . 0.439 ' HB2' ' O ' ' X' ' 9' ' ' ARG . 49.4 m -85.62 -25.72 26.48 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -169.24 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.705 HD12 HD22 ' X' ' 10' ' ' LEU . 10.4 tt -93.0 -40.7 10.4 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 178.637 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.606 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 32.1 t -68.08 -16.65 64.11 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.867 177.211 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . 0.523 ' O ' ' HB2' ' X' ' 20' ' ' MET . 0.0 OUTLIER -55.24 -45.4 76.04 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.067 0.461 . . . . 0.0 110.316 174.464 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.645 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 15.0 ptm -99.9 -20.29 16.21 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.668 -176.305 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . 0.405 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 46.0 tp -60.12 -49.34 78.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.772 0.32 . . . . 0.0 111.005 -179.459 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 16.0 p -98.86 9.26 43.83 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -178.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' X' X ' 20' ' ' MET . . . . . 0.523 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 27.4 ttt -91.43 -28.33 17.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.035 0.445 . . . . 0.0 111.022 -178.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.35 34.55 1.59 Allowed Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.572 -0.823 . . . . 0.0 111.179 -174.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.645 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 14.9 m-30 -117.83 -174.72 2.69 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 175.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 71.7 p -161.38 -163.35 0.99 Allowed 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 119.621 -0.832 . . . . 0.0 111.043 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.626 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 0.7 OUTLIER -112.64 115.18 28.17 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 166.882 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . 0.496 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 62.9 tt0 -51.65 -34.88 39.88 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.007 -175.607 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -124.16 -68.65 0.21 Allowed Glycine 0 C--N 1.318 -0.465 0 N-CA-C 111.24 -0.744 . . . . 0.0 111.24 173.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -176.31 29.97 0.08 OUTLIER Glycine 0 CA--C 1.508 -0.379 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 177.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.651 ' CZ2' HG22 ' X' ' 47' ' ' ILE . 45.7 p-90 -97.33 -9.73 26.95 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -172.281 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.626 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 12.5 tp -52.52 -25.71 11.07 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -169.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 30' ' ' THR . . . . . 0.461 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 32.1 p -84.44 -55.9 3.91 Favored 'General case' 0 C--N 1.322 -0.604 0 O-C-N 121.876 -0.515 . . . . 0.0 110.421 170.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.4 -51.9 50.63 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.785 -177.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.417 HD13 ' C ' ' X' ' 32' ' ' LEU . 3.0 tm? -51.26 -60.36 3.21 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 123.266 0.626 . . . . 0.0 111.114 -177.319 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.483 HD13 ' O ' ' X' ' 29' ' ' LEU . 8.8 mp -62.86 -44.83 95.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.134 -179.114 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . 0.461 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.8 OUTLIER -49.47 -47.06 48.68 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -178.45 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 4.7 m -80.8 -23.92 38.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.957 0.408 . . . . 0.0 111.25 -176.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -102.5 39.72 1.47 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -175.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . 0.405 ' O ' ' HB2' ' X' ' 38' ' ' TYR . 12.2 p30 50.4 29.32 3.81 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.728 0.811 . . . . 0.0 112.512 179.422 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.445 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 92.6 m-85 71.27 71.46 0.18 Allowed 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.825 177.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . 0.4 ' O ' ' HB3' ' X' ' 43' ' ' ALA . 36.0 t0 -114.52 130.16 56.72 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.891 -174.327 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.649 ' O ' HD11 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.92 -17.9 7.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.077 169.87 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.26 -34.78 90.28 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.219 179.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.82 -15.68 19.16 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.38 -0.41 . . . . 0.0 111.002 176.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' X' ' 39' ' ' ASP . . . -72.48 -38.94 68.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.939 0.4 . . . . 0.0 110.777 178.623 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.649 HD11 ' O ' ' X' ' 40' ' ' ILE . 9.0 mp -76.75 -18.3 58.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.486 178.2 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -69.29 -34.73 75.16 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.547 175.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 7.1 p -95.75 -6.04 40.65 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -174.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.651 HG22 ' CZ2' ' X' ' 28' ' ' TRP . 6.6 pt -100.2 -30.22 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 119.613 -0.835 . . . . 0.0 113.205 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . 0.56 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.9 mp0 -165.79 -48.01 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.256 0.55 . . . . 0.0 110.595 -177.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . 0.401 ' HD2' ' HB3' ' X' ' 44' ' ' LEU . 27.0 m-85 -82.61 -165.96 1.18 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.977 -1.01 . . . . 0.0 110.53 -172.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 20.2 m -143.61 74.45 1.43 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 176.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 2.4 tppp? 66.68 45.36 2.0 Allowed 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 -174.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 94.6 m-70 . . . . . 0 C--O 1.245 0.855 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.675 -174.892 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.658 0 N-CA-C 111.734 -0.546 . . . . 0.0 111.734 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 20.2 m -95.13 110.03 47.9 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 116.788 0.294 . . . . 0.0 110.926 179.101 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.453 ' C ' ' H ' ' X' ' 5' ' ' GLU . 27.0 Cg_exo -61.17 136.83 67.21 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.468 2.112 . . . . 0.0 111.288 178.771 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 23.3 Cg_exo -69.18 29.85 0.16 Allowed 'Trans proline' 0 CA--C 1.534 0.479 0 C-N-CA 122.977 2.451 . . . . 0.0 114.019 -174.543 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . 0.453 ' H ' ' C ' ' X' ' 3' ' ' PRO . 30.9 tt0 -140.16 9.29 2.3 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.801 0.81 . . . . 0.0 109.399 173.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -150.96 25.0 0.74 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.861 -1.063 . . . . 0.0 108.841 176.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . 0.6 ' HB3' HD13 ' X' ' 10' ' ' LEU . 5.5 t70 -84.4 144.97 44.23 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 114.31 -1.313 . . . . 0.0 107.893 177.169 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -41.6 -26.77 0.42 Allowed 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 123.253 2.635 . . . . 0.0 113.764 -178.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . 0.52 ' HD2' ' CE2' ' X' ' 38' ' ' TYR . 83.9 mtm180 -83.45 -42.58 16.77 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 178.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.6 HD13 ' HB3' ' X' ' 7' ' ' ASP . 3.9 mp -97.28 -17.08 20.02 Favored 'General case' 0 C--O 1.216 -0.659 0 O-C-N 122.277 -0.264 . . . . 0.0 111.55 -174.65 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.548 ' O ' ' HB3' ' X' ' 15' ' ' SER . 10.5 tt -73.93 -12.95 15.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 170.484 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -93.81 -50.23 5.45 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 114.396 -1.275 . . . . 0.0 110.761 174.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 13' ' ' SER . . . . . 0.757 ' HA ' HG22 ' X' ' 40' ' ' ILE . 44.1 p -95.01 -34.09 12.47 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -171.236 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.532 ' HG ' HD13 ' X' ' 29' ' ' LEU . 6.4 tt -93.36 -44.54 8.23 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 -178.284 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.548 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 16.1 t -66.72 -21.72 66.07 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.924 -178.392 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 7.0 tm0? -56.54 -55.39 34.44 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.341 174.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.747 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 23.6 ptp -80.37 -26.91 38.36 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.926 -178.268 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 33.5 tp -64.83 -29.38 70.34 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.03 0.443 . . . . 0.0 110.613 178.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 14.1 t -94.64 -14.23 25.1 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.892 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 35.9 tpp -96.05 -32.22 12.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.154 -176.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.27 38.0 1.16 Allowed Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.706 -0.759 . . . . 0.0 111.876 -179.163 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.747 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 51.8 m-85 -136.05 160.88 37.29 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 50.7 m -151.6 -161.95 1.43 Allowed 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.148 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.949 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 11.3 p-10 -69.17 120.63 15.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.926 0.394 . . . . 0.0 109.997 173.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -102.64 58.25 0.79 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.447 0.641 . . . . 0.0 109.305 179.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 145.29 -8.1 1.63 Allowed Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.404 -176.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 96.82 15.48 39.5 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 121.193 -0.527 . . . . 0.0 111.847 -178.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.452 ' CH2' HG22 ' X' ' 47' ' ' ILE . 46.9 p-90 -95.7 -7.05 38.45 Favored 'General case' 0 C--O 1.221 -0.437 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -174.871 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.949 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 6.1 tp -59.06 -24.92 63.3 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.686 0.675 . . . . 0.0 111.11 -175.011 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 38.5 p -93.59 -40.2 10.41 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 121.853 -0.529 . . . . 0.0 110.855 170.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 15.8 mmm180 -60.61 -64.41 0.96 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.076 0.465 . . . . 0.0 111.339 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.522 HD13 ' C ' ' X' ' 32' ' ' LEU . 2.2 tm? -53.22 -60.46 3.26 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.903 -178.295 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 10.9 mp -54.08 -68.01 0.22 Allowed 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.352 -174.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -47.71 -46.46 29.67 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -176.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 23.4 m -66.89 -33.02 74.69 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.7 0.286 . . . . 0.0 111.616 -178.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . 0.525 ' O ' ' HB2' ' X' ' 39' ' ' ASP . 5.6 mptp? -95.43 26.44 3.86 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 178.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 39.0 t30 62.82 50.1 3.43 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 121.238 0.542 . . . . 0.0 110.832 179.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.52 ' CE2' ' HD2' ' X' ' 9' ' ' ARG . 92.0 m-85 48.23 53.91 11.09 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.862 -179.623 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . 0.525 ' HB2' ' O ' ' X' ' 36' ' ' LYS . 1.8 t0 -93.27 128.78 39.4 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.394 -173.086 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.757 HG22 ' HA ' ' X' ' 13' ' ' SER . 0.0 OUTLIER -89.61 -12.01 9.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.413 171.829 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.97 -36.51 93.16 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.603 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.02 -24.7 14.82 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.875 0.369 . . . . 0.0 110.988 177.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.569 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -64.84 -37.99 89.47 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.154 178.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.693 ' HA ' ' CG1' ' X' ' 47' ' ' ILE . 7.2 mp -68.28 -37.35 80.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.292 -178.319 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . 0.593 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.0 t70 -55.18 -37.32 66.91 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.832 0.349 . . . . 0.0 110.828 179.274 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 14.3 p -88.73 -29.05 20.11 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.693 ' CG1' ' HA ' ' X' ' 44' ' ' LEU . 24.6 pt -79.93 43.91 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 O-C-N 121.644 -0.66 . . . . 0.0 112.084 175.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 78.79 8.7 1.99 Allowed 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 172.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . 0.593 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 14.0 m-85 -105.3 55.34 0.69 Allowed 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 170.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 16.2 m -73.07 -6.62 46.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.117 0.484 . . . . 0.0 111.866 -174.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 72.0 tttt -125.74 -129.22 0.24 Allowed 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.26 -0.882 . . . . 0.0 108.929 173.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 6.8 p80 . . . . . 0 C--N 1.317 -0.839 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.457 177.347 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.749 0 N-CA-C 111.997 -0.441 . . . . 0.0 111.997 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 50.7 m -124.57 113.3 27.36 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-O 120.775 0.321 . . . . 0.0 111.157 179.278 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -69.56 140.16 42.76 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.373 2.049 . . . . 0.0 111.688 178.597 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -75.42 37.18 0.49 Allowed 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.522 2.148 . . . . 0.0 112.775 179.913 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -134.57 -5.9 2.54 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.247 -178.617 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -168.6 37.5 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.443 -178.157 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -86.0 145.91 41.94 Favored Pre-proline 0 C--N 1.32 -0.675 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 173.74 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -43.08 -26.79 0.83 Allowed 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.189 2.593 . . . . 0.0 113.191 -179.119 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . 0.496 ' HD3' ' CE1' ' X' ' 38' ' ' TYR . 69.1 mtt85 -80.03 -44.22 20.52 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.927 177.992 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.767 HD22 ' HB2' ' X' ' 14' ' ' LEU . 86.1 mt -98.07 -15.43 20.01 Favored 'General case' 0 C--O 1.217 -0.652 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -172.367 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.512 ' O ' ' HB2' ' X' ' 15' ' ' SER . 11.7 tt -71.8 -17.09 19.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 169.348 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 46.5 tp10 -94.46 -58.63 2.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.4 -1.273 . . . . 0.0 111.191 175.412 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 13' ' ' SER . . . . . 0.428 ' HA ' HG21 ' X' ' 40' ' ' ILE . 14.1 m -91.89 -22.66 19.95 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -170.251 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.767 ' HB2' HD22 ' X' ' 10' ' ' LEU . 53.4 tp -94.3 -48.03 6.35 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 177.679 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.512 ' HB2' ' O ' ' X' ' 11' ' ' ILE . 45.0 m -66.89 -18.87 65.59 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.689 -176.345 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . 0.446 ' OE1' HG23 ' X' ' 40' ' ' ILE . 5.0 tm0? -60.39 -49.19 78.55 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.161 0.505 . . . . 0.0 110.333 173.944 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.616 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 4.5 ppp? -91.31 -21.07 21.23 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.325 -177.04 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 28.6 tp -69.62 -39.56 77.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.835 -179.985 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 21.0 p -72.7 -41.95 64.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.637 -179.571 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 15.5 tpt -71.61 -29.53 64.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.475 -176.198 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.48 47.23 1.7 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.041 -1.076 . . . . 0.0 112.066 -178.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.616 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 31.5 m-85 -106.96 172.2 6.95 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 174.345 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 10.7 m -148.24 169.95 18.96 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 119.976 -0.69 . . . . 0.0 110.254 179.187 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.59 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 8.2 p-10 -71.24 140.92 50.58 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 170.98 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -116.35 65.85 0.71 Allowed 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.87 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 139.1 -3.56 2.78 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.662 -175.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 83.13 26.23 45.25 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.978 -179.575 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.567 ' HA ' ' HG3' ' X' ' 31' ' ' ARG . 55.0 p-90 -96.94 -17.93 19.79 Favored 'General case' 0 C--O 1.216 -0.683 0 CA-C-O 119.081 -0.485 . . . . 0.0 112.152 -176.353 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.59 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 35.3 tp -47.46 -45.55 26.01 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -168.303 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 30.2 p -69.05 -49.16 59.97 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.746 0.307 . . . . 0.0 110.878 176.017 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . 0.567 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 4.2 mtm180 -57.47 -60.59 3.42 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.617 -178.647 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.465 ' O ' ' HB2' ' X' ' 36' ' ' LYS . 2.1 tm? -48.67 -55.03 12.46 Favored 'General case' 0 C--O 1.23 0.079 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.25 -178.543 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 92.6 mt -59.88 -67.7 0.36 Allowed 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.751 -178.373 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -43.19 -56.15 3.58 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -175.166 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 32.3 p -67.12 -27.54 67.41 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -175.917 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . 0.465 ' HB2' ' O ' ' X' ' 32' ' ' LEU . 1.9 tttm -97.45 37.55 1.35 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.171 179.951 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 43.1 45.83 4.75 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.483 0.713 . . . . 0.0 112.119 -176.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.496 ' CE1' ' HD3' ' X' ' 9' ' ' ARG . 24.4 m-85 56.84 68.28 0.88 Allowed 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.987 178.924 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -106.92 122.53 46.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.1 -178.651 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.634 ' O ' HD12 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.85 -8.14 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.95 173.614 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.38 -43.0 97.73 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.214 177.666 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -94.45 -22.28 18.38 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.473 -0.364 . . . . 0.0 111.212 177.776 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.514 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -68.0 -38.83 83.1 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.792 178.741 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.955 HD13 HD12 ' X' ' 47' ' ' ILE . 6.9 mp -62.83 -33.26 74.86 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.654 -179.076 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . 0.461 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 18.9 t70 -53.15 -45.44 68.43 Favored 'General case' 0 C--N 1.33 -0.245 0 O-C-N 123.333 0.396 . . . . 0.0 111.468 178.272 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 3.2 p -96.45 -5.23 40.11 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 -176.124 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.955 HD12 HD13 ' X' ' 44' ' ' LEU . 23.6 pt -96.75 42.28 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 O-C-N 121.572 -0.705 . . . . 0.0 111.322 173.547 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 80.94 30.82 0.16 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.034 0.933 . . . . 0.0 112.634 174.453 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . 0.519 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 33.3 m-85 -136.03 56.3 1.83 Allowed 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 170.49 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 4.2 t -91.02 20.5 4.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.985 0.421 . . . . 0.0 111.282 -174.564 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 47.2 mttm -119.2 19.01 12.96 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.319 177.761 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 36.0 m170 . . . . . 0 C--O 1.244 0.806 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.823 -179.596 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . 0.488 ' O ' ' HD3' ' X' ' 3' ' ' PRO . . . . . . . . 0 N--CA 1.483 1.805 0 N-CA-C 112.003 -0.439 . . . . 0.0 112.003 . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 24.6 m -106.79 98.36 20.75 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-O 120.685 0.278 . . . . 0.0 110.858 -179.285 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.614 ' HG2' HD11 ' X' ' 10' ' ' LEU . 1.4 Cg_endo -82.27 179.33 5.57 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 123.217 2.611 . . . . 0.0 110.227 175.981 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . 0.459 ' O ' ' HB2' ' X' ' 7' ' ' ASP . 78.2 Cg_exo -48.85 134.41 28.41 Favored 'Trans proline' 0 C--N 1.355 0.915 0 C-N-CA 121.936 1.757 . . . . 0.0 111.341 177.208 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . 0.562 ' O ' ' HB2' ' X' ' 6' ' ' ALA . 23.7 tt0 -78.41 107.97 11.43 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 -175.341 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . 0.562 ' HB2' ' O ' ' X' ' 5' ' ' GLU . . . 80.01 50.43 0.03 OUTLIER 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 -168.067 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . 0.658 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 54.5 t0 -80.19 133.44 57.31 Favored Pre-proline 0 CA--C 1.506 -0.732 0 CA-C-N 113.693 -1.594 . . . . 0.0 107.521 177.916 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . 0.658 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 80.6 Cg_exo -40.56 -26.14 0.21 Allowed 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.908 2.405 . . . . 0.0 112.818 179.814 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 77.9 mtm180 -72.48 -53.03 13.26 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.41 175.263 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.614 HD11 ' HG2' ' X' ' 3' ' ' PRO . 4.5 mp -95.72 -23.77 16.83 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -174.318 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.589 ' HA ' ' HB2' ' X' ' 15' ' ' SER . 0.0 OUTLIER -62.73 -28.01 44.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.76 0.79 . . . . 0.0 109.016 177.086 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . 0.424 ' N ' HG23 ' X' ' 11' ' ' ILE . 81.9 mt-10 -93.9 -22.09 18.83 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.576 174.937 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 13' ' ' SER . . . . . 0.471 ' HB3' ' HA ' ' X' ' 10' ' ' LEU . 29.7 t -98.56 -61.03 1.43 Allowed 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -175.824 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.442 HD21 ' HB2' ' X' ' 18' ' ' LEU . 8.3 tt -92.58 -40.26 10.88 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-O 121.074 0.464 . . . . 0.0 109.749 -174.09 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.589 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 23.2 m -66.5 -26.91 67.39 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.009 -176.031 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . 0.415 ' NE2' ' HB3' ' X' ' 17' ' ' MET . 5.3 pp0? -69.3 -30.22 68.25 Favored 'General case' 0 C--O 1.228 -0.067 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.046 -179.425 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.936 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 18.9 ptm -96.39 -32.95 12.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.25 -179.517 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . 0.442 ' HB2' HD21 ' X' ' 14' ' ' LEU . 61.1 tp -55.13 -43.65 74.33 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 123.427 0.454 . . . . 0.0 111.592 -178.215 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 16.3 p -98.93 9.74 42.86 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -177.157 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 35.0 ttp -111.22 -12.85 14.07 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.63 -176.413 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 115.19 19.82 5.77 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.336 -0.935 . . . . 0.0 112.398 179.604 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.936 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 28.0 m-85 -116.63 163.11 16.6 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 107.734 -1.209 . . . . 0.0 107.734 170.892 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 47.5 m -154.65 -138.01 0.07 Allowed 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 120.201 -0.599 . . . . 0.0 109.919 179.96 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.758 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 25.0 p-10 -110.75 116.29 31.03 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.238 0.542 . . . . 0.0 110.907 176.298 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . 0.79 ' HG3' ' HA ' ' X' ' 47' ' ' ILE . 1.9 mm-40 -83.76 54.18 2.8 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.218 0.532 . . . . 0.0 110.9 177.631 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 136.08 2.65 2.67 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.561 -179.188 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . 0.453 ' HA2' ' OD2' ' X' ' 24' ' ' ASP . . . 87.86 13.6 64.35 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.645 179.39 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.673 ' CH2' HG21 ' X' ' 47' ' ' ILE . 42.4 p-90 -85.49 -13.24 49.72 Favored 'General case' 0 C--O 1.217 -0.657 0 O-C-N 122.629 -0.336 . . . . 0.0 111.046 179.64 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.758 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 54.5 tp -56.06 -24.26 38.63 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.366 -175.723 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 53.2 p -93.86 -21.81 19.02 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.793 -0.185 . . . . 0.0 111.43 176.339 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . 0.63 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 0.2 OUTLIER -95.02 -56.36 2.77 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 120.568 0.223 . . . . 0.0 111.528 -177.339 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -44.97 -68.85 0.16 Allowed 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 124.046 0.938 . . . . 0.0 112.063 -174.507 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.76 ' HB2' ' HA ' ' X' ' 38' ' ' TYR . 0.9 OUTLIER -67.59 -25.61 65.85 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.873 -0.331 . . . . 0.0 111.785 -176.153 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . 0.462 ' N ' HD13 ' X' ' 33' ' ' LEU . 0.8 OUTLIER -63.7 -31.43 72.6 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 122.21 -0.307 . . . . 0.0 111.685 179.481 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 4.9 t -99.26 -10.77 21.97 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 122.229 -0.294 . . . . 0.0 111.701 -179.214 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -114.39 39.92 2.66 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -174.868 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 16.3 p30 50.29 34.84 9.45 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.666 0.786 . . . . 0.0 112.025 -178.129 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.76 ' HA ' ' HB2' ' X' ' 33' ' ' LEU . 68.8 m-85 64.69 69.39 0.5 Allowed 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.786 178.512 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . 0.587 ' O ' ' HB2' ' X' ' 43' ' ' ALA . 4.1 t70 -93.26 107.21 19.07 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 113.972 -1.467 . . . . 0.0 111.176 -172.698 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.615 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.5 OUTLIER -92.24 -4.07 10.75 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.432 172.671 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -74.64 -34.23 54.15 Favored Glycine 0 N--CA 1.441 -1.014 0 C-N-CA 120.003 -1.094 . . . . 0.0 111.027 175.391 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.73 -25.0 15.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.778 -0.711 . . . . 0.0 110.979 177.327 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.681 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -64.52 -42.72 95.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.234 179.859 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.615 HD13 ' O ' ' X' ' 40' ' ' ILE . 10.9 mp -67.03 -27.68 67.6 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.909 179.614 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . 0.535 ' O ' ' HB2' ' X' ' 50' ' ' SER . 2.5 t70 -66.82 -58.01 5.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.193 174.798 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 21.2 p -61.9 -20.15 63.45 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 -174.064 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.79 ' HA ' ' HG3' ' X' ' 25' ' ' GLU . 1.8 pt -89.62 -30.05 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 C-N-CA 119.395 -0.922 . . . . 0.0 112.635 179.438 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . 0.648 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.5 mt-30 -163.28 -43.65 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 117.671 0.214 . . . . 0.0 111.542 -177.924 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -78.03 34.58 0.2 Allowed 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -172.737 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' X' X ' 50' ' ' SER . . . . . 0.535 ' HB2' ' O ' ' X' ' 45' ' ' ASP . 1.1 t -98.19 36.47 1.58 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 175.493 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -155.05 141.8 18.99 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.98 -175.567 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 . . . . . 0 C--O 1.244 0.798 0 CA-C-O 118.312 -0.852 . . . . 0.0 110.551 -179.427 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.783 0 N-CA-C 112.322 -0.311 . . . . 0.0 112.322 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 15.0 m -79.89 119.18 75.85 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-O 120.576 0.227 . . . . 0.0 110.662 -178.997 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.435 ' C ' ' H ' ' X' ' 5' ' ' GLU . 56.6 Cg_endo -72.73 128.5 13.42 Favored 'Trans proline' 0 N--CA 1.464 -0.241 0 C-N-CA 122.468 2.112 . . . . 0.0 112.275 -179.485 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 10.4 Cg_exo -71.7 24.08 0.24 Allowed 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 122.961 2.441 . . . . 0.0 113.309 -178.604 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . 0.435 ' H ' ' C ' ' X' ' 3' ' ' PRO . 93.3 mt-10 -143.35 18.03 1.89 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.255 177.043 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . 0.401 ' HA ' ' HB ' ' X' ' 11' ' ' ILE . . . -170.17 15.19 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.038 -177.692 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . 0.745 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 37.3 t0 -71.37 136.54 83.96 Favored Pre-proline 0 C--N 1.318 -0.77 0 N-CA-C 106.948 -1.501 . . . . 0.0 106.948 174.88 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . 0.745 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 78.5 Cg_exo -38.78 -28.48 0.14 Allowed 'Trans proline' 0 CA--C 1.534 0.507 0 C-N-CA 123.507 2.805 . . . . 0.0 113.186 -177.81 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 28.9 mmm180 -90.44 -50.55 5.89 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.958 176.15 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.881 HD22 ' HB2' ' X' ' 14' ' ' LEU . 96.0 mt -79.09 -15.22 58.48 Favored 'General case' 0 C--O 1.221 -0.446 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -173.284 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.54 ' O ' ' HB3' ' X' ' 15' ' ' SER . 11.8 tt -69.59 -25.92 29.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 174.033 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . 0.539 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 48.4 mt-10 -95.9 -45.91 6.76 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.531 174.307 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 20.4 m -89.67 -34.14 16.37 Favored 'General case' 0 C--O 1.222 -0.373 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -168.757 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.881 ' HB2' HD22 ' X' ' 10' ' ' LEU . 8.7 tt -95.94 -41.78 8.62 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.745 0.783 . . . . 0.0 109.017 -179.676 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.54 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 9.4 t -71.24 -16.08 62.47 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 114.73 -1.123 . . . . 0.0 111.243 -176.935 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . 0.539 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 3.8 tm0? -57.58 -58.77 6.84 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-O 120.786 0.327 . . . . 0.0 110.224 177.028 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.978 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 0.9 OUTLIER -82.91 -22.09 33.99 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.089 -179.298 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . 0.442 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 29.4 tp -66.41 -34.79 78.75 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.773 0.32 . . . . 0.0 110.775 -179.376 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 10.7 m -98.63 -36.16 9.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.546 -176.811 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 26.6 ttt -68.33 -31.81 71.48 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -176.209 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.79 46.58 0.6 Allowed Glycine 0 CA--C 1.508 -0.38 0 C-N-CA 119.938 -1.125 . . . . 0.0 113.196 178.617 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.978 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 8.9 m-30 -111.97 -174.48 2.47 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 170.758 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 49.9 m -144.66 -161.28 1.26 Allowed 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 119.7 -0.8 . . . . 0.0 111.401 -179.109 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.542 ' HA ' ' CD1' ' X' ' 28' ' ' TRP . 10.5 t0 -115.28 121.23 42.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.422 -177.946 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . 0.528 ' OE2' ' HB ' ' X' ' 46' ' ' THR . 4.5 pt-20 -61.61 -25.02 67.08 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -178.214 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 148.63 30.91 0.06 OUTLIER Glycine 0 CA--C 1.519 0.311 0 C-N-CA 120.351 -0.928 . . . . 0.0 113.665 178.948 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . 0.552 ' O ' ' HB3' ' X' ' 31' ' ' ARG . . . 126.21 33.91 0.65 Allowed Glycine 0 N--CA 1.446 -0.7 0 C-N-CA 121.026 -0.606 . . . . 0.0 111.674 178.742 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.597 ' HE3' ' HB3' ' X' ' 32' ' ' LEU . 8.5 p-90 -97.67 -39.97 8.82 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-O 120.666 0.269 . . . . 0.0 110.98 -178.263 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.642 HD11 HD13 ' X' ' 33' ' ' LEU . 46.1 tp -69.83 -19.15 63.47 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 121.767 -0.583 . . . . 0.0 110.986 -166.45 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 1.7 t -95.0 -31.01 13.82 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.992 170.796 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . 0.552 ' HB3' ' O ' ' X' ' 27' ' ' GLY . 40.8 ttt180 -96.36 -62.26 1.3 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -173.191 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.597 ' HB3' ' HE3' ' X' ' 28' ' ' TRP . 2.8 tm? -50.62 -63.25 1.18 Allowed 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.441 0.696 . . . . 0.0 111.563 -176.472 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.642 HD13 HD11 ' X' ' 29' ' ' LEU . 31.4 mt -45.77 -58.86 3.15 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.574 0.546 . . . . 0.0 111.739 -177.439 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -46.71 -58.78 3.53 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 123.83 0.707 . . . . 0.0 112.542 -178.947 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 60.9 p -62.5 -28.57 69.93 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.547 -176.889 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . 0.488 ' HB3' ' HB2' ' X' ' 39' ' ' ASP . 5.4 mptp? -94.63 39.3 1.1 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.548 176.606 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 31.82 53.12 0.24 Allowed 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.862 1.265 . . . . 0.0 113.744 -174.358 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 60.0 56.11 3.53 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.276 178.142 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . 0.488 ' HB2' ' HB3' ' X' ' 36' ' ' LYS . 24.5 m-20 -107.14 128.01 54.02 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.277 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.701 ' HA ' ' HB2' ' X' ' 43' ' ' ALA . 0.1 OUTLIER -84.36 -3.13 7.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.732 169.239 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -69.67 -36.44 75.62 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.289 179.248 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.11 -12.49 20.45 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.951 0.405 . . . . 0.0 110.214 175.088 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.701 ' HB2' ' HA ' ' X' ' 40' ' ' ILE . . . -57.2 -53.22 60.52 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.821 -179.666 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.5 ' HG ' ' HE2' ' X' ' 22' ' ' PHE . 10.2 mp -61.35 -38.77 88.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.619 -179.258 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -52.16 -46.05 65.3 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.252 -179.654 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' X' X ' 46' ' ' THR . . . . . 0.593 HG23 ' HG ' ' X' ' 32' ' ' LEU . 36.7 p -78.12 -35.11 49.53 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -171.44 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.541 HG12 ' O ' ' X' ' 43' ' ' ALA . 6.7 pt -96.25 -25.19 4.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 -168.999 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . 0.448 HE21 ' HB2' ' X' ' 48' ' ' GLN . 0.0 OUTLIER -153.64 -26.68 0.14 Allowed 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -178.207 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -101.33 54.7 0.83 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -178.284 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 17.3 m -92.12 8.24 38.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.72 -174.964 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . 0.637 ' HE2' ' HA ' ' X' ' 51' ' ' LYS . 10.0 mmpt? -130.75 133.13 45.76 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 176.041 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 60.1 t60 . . . . . 0 C--O 1.247 0.925 0 CA-C-O 118.491 -0.766 . . . . 0.0 110.596 -176.729 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.712 0 N-CA-C 112.219 -0.353 . . . . 0.0 112.219 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 66.2 m -109.43 123.95 35.23 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 120.62 0.248 . . . . 0.0 110.777 179.759 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_exo -73.42 133.93 19.9 Favored 'Trans proline' 0 CA--C 1.529 0.24 0 C-N-CA 122.795 2.33 . . . . 0.0 111.776 179.565 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -53.77 127.32 25.03 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 122.981 2.454 . . . . 0.0 112.931 -178.43 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 71.03 23.62 4.17 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 123.737 0.648 . . . . 0.0 110.953 -178.781 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -154.95 36.37 0.4 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 177.943 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 -70.38 155.49 93.35 Favored Pre-proline 0 CA--C 1.507 -0.703 0 CA-C-N 114.605 -1.18 . . . . 0.0 109.179 179.564 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -53.0 -18.37 9.45 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 122.134 1.889 . . . . 0.0 111.438 172.086 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 15.1 mmm180 -93.71 -35.82 12.61 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.353 179.744 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.613 HD21 ' HG ' ' X' ' 14' ' ' LEU . 63.9 mt -98.26 -25.33 14.9 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.792 -171.671 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.526 ' HA ' ' HB2' ' X' ' 15' ' ' SER . 10.6 tt -70.48 -14.53 18.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 171.032 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -96.58 -52.29 4.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.673 -1.148 . . . . 0.0 111.2 175.341 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 7.7 t -94.46 -32.71 13.4 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -168.963 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.613 ' HG ' HD21 ' X' ' 10' ' ' LEU . 32.3 mt -92.51 -39.16 11.54 Favored 'General case' 0 CA--C 1.506 -0.721 0 O-C-N 121.556 -0.715 . . . . 0.0 109.63 178.481 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.526 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 8.2 t -63.3 -22.31 66.8 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.519 -175.905 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . 0.404 HE21 ' HG3' ' X' ' 17' ' ' MET . 3.7 pp0? -72.73 -29.17 63.13 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 120.411 -0.516 . . . . 0.0 109.997 176.919 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.445 ' HE1' HG12 ' X' ' 47' ' ' ILE . 26.2 mtt -72.21 -40.13 68.06 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.325 171.886 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . 0.429 HD13 ' O ' ' X' ' 14' ' ' LEU . 11.1 mp -68.43 -14.13 62.79 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.453 178.911 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 2.8 t -98.92 -40.98 7.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.934 -178.389 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 83.8 mtp -83.92 -32.4 25.13 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -176.986 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.32 46.91 0.67 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.384 -0.912 . . . . 0.0 112.396 -179.548 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -117.14 160.94 20.23 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 174.134 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 13.8 m -140.9 -136.71 0.11 Allowed 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 120.196 -0.602 . . . . 0.0 110.145 -179.659 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.537 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 7.9 p-10 -121.77 122.3 39.2 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.164 173.001 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . 0.715 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 40.1 tt0 -67.68 -48.02 67.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.36 0.6 . . . . 0.0 110.377 -179.325 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -129.02 19.88 5.43 Favored Glycine 0 C--N 1.32 -0.326 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.992 -178.838 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 87.93 4.87 78.16 Favored Glycine 0 C--O 1.228 -0.256 0 C-N-CA 120.539 -0.839 . . . . 0.0 112.688 178.462 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.715 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 36.3 p-90 -75.04 -9.16 58.28 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -178.985 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.537 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 59.0 tp -53.85 -23.56 12.85 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 -171.316 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 30' ' ' THR . . . . . 0.633 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 43.9 p -84.59 -63.82 1.27 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.646 170.79 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . 0.573 ' CG ' ' HA ' ' X' ' 28' ' ' TRP . 12.1 ptm180 -57.07 -45.72 83.05 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -175.434 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.624 HD12 HD13 ' X' ' 33' ' ' LEU . 3.2 tm? -53.23 -64.4 0.83 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.782 0.325 . . . . 0.0 110.653 -178.347 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.624 HD13 HD12 ' X' ' 32' ' ' LEU . 6.7 mp -65.76 -43.69 88.11 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.891 -175.671 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . 0.633 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.0 OUTLIER -54.81 -38.92 67.94 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -178.293 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 19.3 m -85.05 -12.31 53.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.304 0.574 . . . . 0.0 110.892 -178.681 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . 0.586 ' HD2' HD11 ' X' ' 32' ' ' LEU . 90.7 mttt -112.37 37.9 2.89 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.354 179.768 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 43.37 40.62 2.72 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.648 0.779 . . . . 0.0 112.733 -178.345 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.527 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 64.4 m-85 64.04 67.89 0.59 Allowed 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.688 177.771 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . 0.571 ' O ' ' HB2' ' X' ' 43' ' ' ALA . 42.9 t0 -105.67 120.1 40.81 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.13 -176.443 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.688 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -91.26 -9.54 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 CA-C-O 121.033 0.444 . . . . 0.0 110.198 170.771 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.23 -34.65 81.14 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.394 -0.907 . . . . 0.0 111.517 176.978 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.27 -14.86 19.07 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.947 -0.626 . . . . 0.0 110.987 176.062 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.571 ' HB2' ' O ' ' X' ' 39' ' ' ASP . . . -75.84 -33.57 60.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.242 -179.16 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.688 HD13 ' O ' ' X' ' 40' ' ' ILE . 10.9 mp -72.89 -23.56 60.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.946 0.403 . . . . 0.0 110.053 177.359 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . 0.465 ' OD1' ' HA ' ' X' ' 50' ' ' SER . 17.3 t70 -68.62 -29.07 67.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.009 174.981 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 13.3 p -96.84 -14.96 21.51 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 -172.669 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.701 HG21 ' CH2' ' X' ' 28' ' ' TRP . 1.2 pp -97.84 -28.77 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 119.715 1.143 . . . . 0.0 113.104 -179.41 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . 0.498 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 2.0 mp0 -161.19 -59.35 0.05 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.014 0.435 . . . . 0.0 110.573 179.853 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -69.96 -179.15 1.78 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.919 -175.668 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' X' X ' 50' ' ' SER . . . . . 0.468 ' C ' ' HD2' ' X' ' 51' ' ' LYS . 28.1 m -153.33 26.42 0.52 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.79 0.328 . . . . 0.0 111.436 -177.851 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . 0.468 ' HD2' ' C ' ' X' ' 50' ' ' SER . 12.7 mptt -132.42 129.43 39.28 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 178.055 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 60.1 m170 . . . . . 0 C--O 1.245 0.821 0 CA-C-O 118.652 -0.689 . . . . 0.0 110.68 -177.265 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.822 0 N-CA-C 112.095 -0.402 . . . . 0.0 112.095 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 48.2 m -64.2 119.96 60.38 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-O 120.862 0.363 . . . . 0.0 111.066 -179.582 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.425 ' HG3' HD22 ' X' ' 10' ' ' LEU . 54.1 Cg_endo -95.05 176.02 1.0 Allowed 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 123.254 2.636 . . . . 0.0 112.63 -177.148 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . 0.886 ' HB2' ' HB2' ' X' ' 7' ' ' ASP . 31.8 Cg_exo -58.28 167.09 5.06 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.617 2.211 . . . . 0.0 112.47 178.405 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -84.1 90.02 7.39 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.242 -176.539 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . 59.05 63.54 1.6 Allowed 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.63 0.729 . . . . 0.0 109.929 -177.549 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . 0.886 ' HB2' ' HB2' ' X' ' 4' ' ' PRO . 9.2 t70 -91.44 147.29 35.05 Favored Pre-proline 0 C--N 1.317 -0.812 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 179.211 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . 0.5 ' HA ' HG22 ' X' ' 11' ' ' ILE . 79.0 Cg_exo -42.07 -23.77 0.27 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.115 2.543 . . . . 0.0 113.169 179.824 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . 0.429 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 63.5 mtp180 -64.53 -55.59 19.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.946 173.792 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.441 ' HA ' ' OG ' ' X' ' 13' ' ' SER . 5.1 mp -99.41 -26.26 14.19 Favored 'General case' 0 C--O 1.22 -0.465 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -176.739 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.541 ' HA ' ' CB ' ' X' ' 15' ' ' SER . 11.6 tt -64.64 -21.23 28.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.337 0.589 . . . . 0.0 109.467 178.751 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -93.63 -33.82 13.54 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.041 175.683 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' X' X ' 13' ' ' SER . . . . . 0.471 ' HA ' HG22 ' X' ' 40' ' ' ILE . 56.6 p -96.54 -48.62 5.47 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -173.402 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.431 ' HG ' HD11 ' X' ' 29' ' ' LEU . 8.2 tt -93.49 -42.18 9.38 Favored 'General case' 0 CA--C 1.507 -0.706 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -175.798 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.541 ' CB ' ' HA ' ' X' ' 11' ' ' ILE . 7.3 t -69.78 -22.69 63.32 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.754 -178.497 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . 0.532 ' OE1' HG21 ' X' ' 40' ' ' ILE . 4.5 tm0? -56.33 -59.95 4.22 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.21 0.529 . . . . 0.0 109.993 173.694 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.737 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 11.8 ptm -77.09 -22.52 52.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.457 -176.303 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 20.8 tp -68.4 -39.42 81.68 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.912 0.387 . . . . 0.0 110.382 176.715 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 15.7 t -83.69 -31.35 26.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.186 -179.603 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 37.9 tpp -69.26 -29.23 67.09 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.886 0.374 . . . . 0.0 111.249 -177.259 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.21 38.48 1.23 Allowed Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.339 -0.934 . . . . 0.0 112.15 -178.858 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.737 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 14.2 m-30 -117.4 -173.61 2.45 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 176.595 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 60.2 m -159.28 -135.28 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 176.63 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.603 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.2 p30 -121.67 133.75 54.97 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.854 0.359 . . . . 0.0 110.036 171.804 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . 0.444 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 21.7 tt0 -87.37 48.47 1.65 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.043 0.449 . . . . 0.0 110.038 178.233 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 148.97 -8.21 0.93 Allowed Glycine 0 CA--C 1.518 0.278 0 C-N-CA 120.281 -0.961 . . . . 0.0 113.646 179.849 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 101.05 15.54 28.08 Favored Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.008 -179.126 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.671 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 43.2 p-90 -91.67 -5.11 54.35 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -176.438 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.603 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 28.4 tp -56.83 -34.14 67.46 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.543 -172.293 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 70.5 p -89.32 -10.54 46.38 Favored 'General case' 0 C--N 1.321 -0.637 0 O-C-N 122.164 -0.335 . . . . 0.0 111.293 176.491 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . 0.446 ' HG2' ' HA ' ' X' ' 28' ' ' TRP . 22.6 mmm-85 -94.89 -53.04 3.99 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.021 0.439 . . . . 0.0 111.241 -177.545 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.404 HD22 ' HD3' ' X' ' 36' ' ' LYS . 3.2 tm? -54.71 -67.21 0.29 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.656 -177.727 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.549 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.8 mp -54.88 -52.45 62.8 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.531 -177.299 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -41.78 -60.0 1.5 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -177.743 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 2.9 m -66.59 -31.3 71.92 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.242 -176.622 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . 0.583 ' HE3' ' OD2' ' X' ' 39' ' ' ASP . 24.4 mtpp -96.56 39.38 1.16 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.968 -176.433 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 45.96 39.95 6.24 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.209 1.003 . . . . 0.0 113.086 179.859 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.549 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 43.5 m-85 59.89 74.12 0.46 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.599 175.69 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . 0.583 ' OD2' ' HE3' ' X' ' 36' ' ' LYS . 41.4 p-10 -112.45 138.91 48.52 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.756 0.789 . . . . 0.0 112.437 178.763 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.532 HG21 ' OE1' ' X' ' 16' ' ' GLN . 0.0 OUTLIER -90.46 -13.42 9.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.084 175.025 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.5 -50.91 61.63 Favored Glycine 0 N--CA 1.444 -0.813 0 CA-C-N 115.517 -0.765 . . . . 0.0 112.511 -176.774 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -88.5 -16.97 31.32 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.216 -0.492 . . . . 0.0 111.137 178.054 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.429 ' HB2' ' O ' ' X' ' 39' ' ' ASP . . . -67.66 -46.24 72.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.388 -179.781 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.495 ' O ' HD11 ' X' ' 47' ' ' ILE . 37.5 mt -72.11 -25.54 61.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.985 0.421 . . . . 0.0 110.524 -179.189 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . 0.645 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 9.6 t70 -61.64 -36.86 82.0 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.729 178.507 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 10.7 p -96.03 -3.71 44.38 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 -172.486 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.671 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 1.5 pp -99.78 -27.36 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 C-N-CA 118.379 -1.328 . . . . 0.0 112.614 -177.942 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . 0.46 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 2.5 mp0 -158.74 -58.32 0.07 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.753 0.311 . . . . 0.0 110.801 178.701 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . 0.645 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 1.3 p90 -105.4 109.6 21.64 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.055 0.455 . . . . 0.0 112.226 -175.303 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 3.2 p -82.06 49.89 1.47 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.836 175.554 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 62.3 mmtt -140.15 129.17 23.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.229 179.57 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 47.1 m170 . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.339 -0.839 . . . . 0.0 110.649 -178.609 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.761 0 N-CA-C 112.4 -0.28 . . . . 0.0 112.4 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' X' X ' 2' ' ' SER . . . . . 0.502 ' HB3' ' OD1' ' X' ' 7' ' ' ASP . 45.9 t -82.86 146.77 53.15 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 178.846 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.456 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 77.9 Cg_exo -50.4 137.98 38.96 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.666 2.244 . . . . 0.0 112.031 179.221 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 16.9 Cg_exo -70.92 38.48 0.32 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.995 2.464 . . . . 0.0 113.846 -175.087 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . 0.402 ' O ' ' HB1' ' X' ' 6' ' ' ALA . 59.0 mm-40 -132.98 8.07 4.05 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 175.676 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . 0.402 ' HB1' ' O ' ' X' ' 5' ' ' GLU . . . 173.25 66.2 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.004 -0.998 . . . . 0.0 108.671 -178.671 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . 0.573 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 39.2 t70 -107.22 149.72 39.04 Favored Pre-proline 0 C--N 1.315 -0.906 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 -177.88 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . 0.573 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 72.2 Cg_exo -47.4 -22.24 2.51 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 122.167 1.911 . . . . 0.0 112.5 179.58 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . 0.708 ' HB3' ' HB2' ' X' ' 38' ' ' TYR . 66.1 mtt85 -87.1 -28.82 22.3 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.272 178.185 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.834 HD22 ' HB2' ' X' ' 14' ' ' LEU . 95.7 mt -97.78 -27.58 14.25 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 122.218 -0.301 . . . . 0.0 110.696 -175.569 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.45 ' O ' ' HB3' ' X' ' 15' ' ' SER . 61.1 mt -61.88 -25.37 37.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 174.518 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . 0.543 ' HG3' ' H ' ' X' ' 13' ' ' SER . 6.3 pt-20 -96.39 -58.75 1.99 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.828 171.494 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 13' ' ' SER . . . . . 0.543 ' H ' ' HG3' ' X' ' 12' ' ' GLU . 30.8 m -81.18 -26.73 35.78 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -168.275 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.834 ' HB2' HD22 ' X' ' 10' ' ' LEU . 30.6 tp -93.13 -40.29 10.57 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.169 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.45 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 24.4 t -65.16 -26.33 68.12 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.825 -177.762 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 4.6 pp0? -74.35 -26.96 60.45 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.461 -179.211 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.777 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 20.8 ptm -93.73 -28.1 16.13 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.614 177.878 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . 0.655 HD11 ' HG ' ' X' ' 14' ' ' LEU . 4.2 mp -66.89 -35.63 80.45 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.176 179.374 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 22.4 p -87.49 -27.62 22.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.62 -0.263 . . . . 0.0 111.648 -179.263 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 46.9 tpp -80.84 -32.57 35.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.578 -176.163 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 106.35 47.83 1.03 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.047 -1.073 . . . . 0.0 112.178 -179.4 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.777 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 20.3 m-30 -108.92 168.28 9.47 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 108.083 -1.081 . . . . 0.0 108.083 176.454 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 23' ' ' SER . . . . . 0.538 ' H ' HE22 ' X' ' 48' ' ' GLN . 20.3 m -146.33 -179.33 6.67 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 119.895 -0.722 . . . . 0.0 110.832 179.45 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -77.95 132.3 37.81 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 172.125 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . 0.859 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 50.2 tt0 -76.76 -16.12 59.57 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.331 -0.548 . . . . 0.0 110.035 179.916 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -159.77 -80.11 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 111.505 -0.638 . . . . 0.0 111.505 176.637 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -162.12 32.63 0.33 Allowed Glycine 0 CA--C 1.508 -0.379 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 175.516 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.859 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 56.9 p-90 -98.37 -16.23 19.39 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -175.325 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.613 HD13 ' SD ' ' X' ' 17' ' ' MET . 60.0 tp -51.16 -48.67 61.83 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -164.762 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 30' ' ' THR . . . . . 0.522 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 40.8 p -75.86 -10.85 59.77 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.823 -0.548 . . . . 0.0 111.536 178.421 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 30.9 ttt180 -94.6 -54.87 3.34 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.37 0.268 . . . . 0.0 111.677 -179.688 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -52.47 -49.9 63.76 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.385 0.674 . . . . 0.0 110.4 179.671 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.9 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 73.1 mt -62.59 -53.68 50.99 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.564 179.25 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . 0.522 ' HB2' ' O ' ' X' ' 30' ' ' THR . 2.4 tp-100 -39.29 -56.81 1.47 Allowed 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.99 1.107 . . . . 0.0 113.99 -174.958 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 34.7 p -65.81 -17.12 64.41 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -174.859 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . 0.427 ' O ' ' HB3' ' X' ' 37' ' ' ASN . 50.9 mttm -114.33 30.32 7.38 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -176.568 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . 0.427 ' HB3' ' O ' ' X' ' 36' ' ' LYS . 32.2 t30 65.71 28.12 11.13 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.463 0.649 . . . . 0.0 110.311 179.438 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.9 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 50.1 m-85 60.8 68.25 0.76 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.525 -173.205 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . 0.476 ' O ' ' HB3' ' X' ' 43' ' ' ALA . 31.5 t70 -103.35 133.01 49.13 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.565 -174.362 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.648 ' HB ' HD12 ' X' ' 44' ' ' LEU . 0.1 OUTLIER -90.21 -3.99 10.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.136 175.805 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.41 -41.18 99.78 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 120.32 -0.943 . . . . 0.0 111.815 179.201 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -100.47 -14.88 18.09 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.949 -0.626 . . . . 0.0 111.015 175.391 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.665 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -72.26 -41.03 67.21 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.591 178.569 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.648 HD12 ' HB ' ' X' ' 40' ' ' ILE . 6.4 mp -56.06 -32.11 63.79 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 123.537 0.523 . . . . 0.0 111.202 179.794 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -51.76 -48.35 63.76 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.093 176.206 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 16.9 p -96.08 -20.15 18.88 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -175.453 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.665 HG12 ' O ' ' X' ' 43' ' ' ALA . 7.2 pt -83.78 43.67 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 O-C-N 121.607 -0.683 . . . . 0.0 112.025 177.729 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . 0.538 HE22 ' H ' ' X' ' 23' ' ' SER . 2.4 mp0 82.14 34.07 0.08 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.347 1.059 . . . . 0.0 112.874 173.158 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -146.16 55.36 1.16 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.227 0.537 . . . . 0.0 110.768 173.307 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 4.0 t -91.84 54.05 2.35 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.141 179.071 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . 0.473 ' HD3' ' N ' ' X' ' 52' ' ' HIS . 8.5 tmtt? -136.68 123.76 21.62 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.168 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . 0.473 ' N ' ' HD3' ' X' ' 51' ' ' LYS . 55.9 m170 . . . . . 0 C--O 1.247 0.926 0 CA-C-O 118.431 -0.795 . . . . 0.0 110.332 179.681 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.836 0 N-CA-C 111.827 -0.509 . . . . 0.0 111.827 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' X' X ' 2' ' ' SER . . . . . 0.514 ' HB3' ' HA ' ' X' ' 7' ' ' ASP . 15.2 m -110.27 100.82 45.9 Favored Pre-proline 0 C--N 1.324 -0.54 0 O-C-N 122.66 -0.318 . . . . 0.0 111.129 -177.511 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.473 ' C ' ' H ' ' X' ' 5' ' ' GLU . 7.3 Cg_exo -72.82 155.63 53.47 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 123.019 2.479 . . . . 0.0 111.74 179.194 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 14.4 Cg_exo -69.95 24.0 0.18 Allowed 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 123.098 2.532 . . . . 0.0 113.615 -178.802 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . 0.473 ' H ' ' C ' ' X' ' 3' ' ' PRO . 97.4 mt-10 -143.58 15.45 1.8 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.03 174.728 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -167.74 31.32 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.731 -178.686 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . 0.521 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 35.8 t70 -77.31 148.11 77.09 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 114.932 -1.031 . . . . 0.0 108.284 177.975 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . 0.521 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 86.4 Cg_exo -41.54 -34.97 2.26 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.645 2.23 . . . . 0.0 112.33 179.312 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 31.1 mmt-85 -77.97 -56.17 4.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.587 174.83 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.573 HD21 ' HB2' ' X' ' 14' ' ' LEU . 77.4 mt -73.0 -29.78 63.28 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-N 115.348 -0.842 . . . . 0.0 112.604 -169.034 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.497 ' O ' ' HB2' ' X' ' 15' ' ' SER . 12.1 tt -64.25 -20.82 27.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.656 0.741 . . . . 0.0 109.613 175.476 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . 0.442 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 40.1 tt0 -96.26 -58.48 2.06 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.388 175.246 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 16.4 t -91.93 -23.19 19.68 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -168.56 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.573 ' HB2' HD21 ' X' ' 10' ' ' LEU . 16.1 tp -92.18 -45.72 8.11 Favored 'General case' 0 CA--C 1.504 -0.802 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 177.145 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.549 ' HA ' ' HB2' ' X' ' 18' ' ' LEU . 48.8 m -64.97 -18.38 65.22 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.158 178.017 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . 0.6 HE21 ' HG2' ' X' ' 17' ' ' MET . 0.0 OUTLIER -57.44 -42.07 81.7 Favored 'General case' 0 CA--C 1.521 -0.151 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 173.276 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.6 ' HG2' HE21 ' X' ' 16' ' ' GLN . 1.9 mtp -86.98 -35.7 18.69 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.722 -176.957 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . 0.549 ' HB2' ' HA ' ' X' ' 15' ' ' SER . 3.8 mm? -62.38 -44.98 95.19 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.667 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 50.6 p -86.92 -24.55 24.78 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 -175.023 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 51.0 ttm -78.77 -32.26 46.47 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.755 0.312 . . . . 0.0 110.88 -177.674 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 112.75 47.45 0.67 Allowed Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.215 -0.993 . . . . 0.0 112.081 -179.506 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.484 ' HB2' ' HB3' ' X' ' 17' ' ' MET . 12.6 m-30 -114.7 163.83 14.9 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 176.341 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 72.0 m -150.1 150.46 31.72 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.499 -179.855 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.647 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 0.6 OUTLIER -71.07 129.05 37.97 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.389 0.614 . . . . 0.0 111.688 178.869 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . 0.751 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 30.8 tt0 -56.76 -30.04 63.2 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.71 178.581 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -146.3 -19.22 0.13 Allowed Glycine 0 CA--C 1.521 0.448 0 C-N-CA 120.351 -0.928 . . . . 0.0 114.113 -178.389 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.72 27.15 1.07 Allowed Glycine 0 C--O 1.228 -0.234 0 C-N-CA 120.409 -0.901 . . . . 0.0 112.224 -177.781 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.751 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 38.8 p-90 -96.36 -4.62 41.63 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 123.127 0.571 . . . . 0.0 111.57 -178.472 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.647 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 63.5 tp -47.87 -32.65 6.47 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -167.885 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 60.8 p -90.36 -40.13 12.28 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 121.917 -0.489 . . . . 0.0 111.432 175.365 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . 0.653 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -72.98 -37.27 67.1 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -173.628 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.457 ' HA ' HD21 ' X' ' 32' ' ' LEU . 3.5 tm? -61.99 -55.51 28.61 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.132 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.571 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 10.5 mp -56.6 -50.39 72.1 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.643 178.125 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -48.55 -44.43 36.48 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -179.696 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 8.6 m -72.67 -37.44 67.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.921 0.391 . . . . 0.0 110.845 179.707 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . 0.441 ' O ' ' HB2' ' X' ' 39' ' ' ASP . 5.1 mptp? -90.98 37.3 0.92 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.492 179.509 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 41.91 53.88 4.06 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.669 0.788 . . . . 0.0 112.667 -178.187 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.571 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 34.6 m-85 54.72 62.91 2.33 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.374 178.009 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' X' ' 36' ' ' LYS . 32.4 t0 -118.05 134.27 55.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.917 -176.053 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.589 ' HB ' HD11 ' X' ' 44' ' ' LEU . 0.1 OUTLIER -89.72 -7.53 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.271 170.601 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.4 -35.02 90.38 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.306 -179.731 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -100.03 -22.16 15.34 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.527 -0.336 . . . . 0.0 110.606 175.285 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.648 ' O ' HG13 ' X' ' 47' ' ' ILE . . . -68.25 -37.66 81.01 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.328 -179.924 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.589 HD11 ' HB ' ' X' ' 40' ' ' ILE . 9.2 mp -68.75 -17.84 64.11 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.735 0.302 . . . . 0.0 111.173 179.162 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -83.92 -29.99 26.69 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.96 0.41 . . . . 0.0 110.463 176.667 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 15.2 p -96.01 -21.69 17.84 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -172.29 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.648 HG13 ' O ' ' X' ' 43' ' ' ALA . 1.1 pp -67.16 -26.12 35.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 119.525 -0.87 . . . . 0.0 111.476 -173.955 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . 0.619 ' HB3' ' O ' ' X' ' 47' ' ' ILE . 0.1 OUTLIER 153.95 -5.66 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.682 1.193 . . . . 0.0 110.374 169.739 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 11.3 m-30 -86.66 57.76 4.68 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.305 174.081 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 7.6 m -86.27 26.22 1.07 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.556 -176.843 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 5.0 tmtp? 72.46 68.54 0.13 Allowed 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 -176.082 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 72.2 t60 . . . . . 0 C--O 1.244 0.802 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.414 -175.201 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.97 0 N-CA-C 112.117 -0.393 . . . . 0.0 112.117 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 14.5 p -63.53 126.48 89.63 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.544 0.172 . . . . 0.0 111.148 -178.184 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.431 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 33.0 Cg_exo -59.23 118.1 4.94 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.722 2.281 . . . . 0.0 111.796 -179.947 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 3.5 Cg_exo -82.14 32.9 0.52 Allowed 'Trans proline' 0 CA--C 1.53 0.303 0 C-N-CA 123.041 2.494 . . . . 0.0 113.891 -173.492 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -137.79 15.68 2.89 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 121.108 -0.237 . . . . 0.0 111.304 178.14 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -179.42 31.91 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.444 0 CA-C-O 121.374 0.607 . . . . 0.0 109.568 178.574 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . 0.512 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 38.7 t70 -81.36 143.56 52.1 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 179.085 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . 0.512 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 82.9 Cg_exo -42.53 -30.92 1.73 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.662 2.242 . . . . 0.0 112.562 179.295 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . 0.475 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 39.3 mmt180 -87.76 -52.07 5.51 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.021 177.324 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.406 ' HA ' ' HB2' ' X' ' 13' ' ' SER . 91.8 mt -81.54 -14.08 57.31 Favored 'General case' 0 C--O 1.216 -0.697 0 CA-C-N 116.0 -0.546 . . . . 0.0 112.446 -171.404 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.507 ' HA ' ' HB2' ' X' ' 15' ' ' SER . 13.9 tt -66.05 -24.76 34.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.4 0.619 . . . . 0.0 109.604 175.873 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -94.47 -28.86 15.24 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.963 174.528 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' X' X ' 13' ' ' SER . . . . . 0.406 ' HB2' ' HA ' ' X' ' 10' ' ' LEU . 16.3 m -96.21 -54.33 3.33 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -171.132 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.525 ' HG ' HD21 ' X' ' 29' ' ' LEU . 9.9 tt -94.81 -46.74 6.76 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 -176.429 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.507 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 14.4 m -63.2 -25.53 68.38 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.178 -177.991 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 2.5 tm0? -61.37 -47.68 84.74 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.029 0.442 . . . . 0.0 109.901 174.703 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.659 ' HE1' ' HB3' ' X' ' 43' ' ' ALA . 42.1 mtt -77.74 -39.8 43.13 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.046 -177.473 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 35.6 tp -64.47 -37.77 88.69 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.235 -177.723 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 3.7 t -85.7 -22.23 27.93 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.628 0.251 . . . . 0.0 110.932 -178.633 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 15.4 tpt -78.01 -32.42 51.1 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.925 0.393 . . . . 0.0 110.887 -178.733 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.6 34.53 1.55 Allowed Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.836 -177.89 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.494 ' CD2' HD12 ' X' ' 47' ' ' ILE . 14.8 m-30 -110.33 -177.31 3.21 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 174.284 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -151.13 -178.33 6.56 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.113 178.54 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -94.35 144.16 25.78 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 173.973 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . 0.453 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 29.4 tt0 -107.5 57.3 0.63 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.151 0.5 . . . . 0.0 110.189 179.65 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.38 -29.31 2.29 Favored Glycine 0 CA--C 1.517 0.191 0 C-N-CA 120.65 -0.786 . . . . 0.0 113.076 179.407 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 120.03 16.16 4.95 Favored Glycine 0 CA--C 1.506 -0.528 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 -177.931 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.871 ' HB2' ' HB2' ' X' ' 32' ' ' LEU . 60.9 p-90 -84.97 -11.85 54.59 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.132 -0.534 . . . . 0.0 111.347 -177.91 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.537 ' O ' HD11 ' X' ' 33' ' ' LEU . 30.7 tp -66.17 -19.59 65.88 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.393 -0.817 . . . . 0.0 110.018 -176.914 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 30' ' ' THR . . . . . 0.46 ' O ' ' HG3' ' X' ' 34' ' ' GLN . 0.1 OUTLIER -95.74 -31.54 13.16 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.921 167.814 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . 0.718 ' HB3' ' HA ' ' X' ' 28' ' ' TRP . 50.0 ttt-85 -87.27 -65.88 0.97 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 -174.256 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.871 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 3.3 tm? -41.67 -59.83 1.53 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.022 0.929 . . . . 0.0 111.39 179.307 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.537 HD11 ' O ' ' X' ' 29' ' ' LEU . 65.9 mt -47.36 -68.88 0.15 Allowed 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.281 -175.754 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . 0.46 ' HG3' ' O ' ' X' ' 30' ' ' THR . 5.3 mt-30 -57.4 -27.37 62.28 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -171.531 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 15.4 m -71.96 -21.74 61.55 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.952 0.406 . . . . 0.0 111.034 179.22 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 18.5 mtpp -121.28 37.38 4.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.953 -175.661 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 50.6 t30 63.72 39.03 8.9 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.377 0.608 . . . . 0.0 110.737 178.818 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.475 ' CD2' ' HB3' ' X' ' 9' ' ' ARG . 11.4 m-85 55.57 66.35 1.24 Allowed 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.425 -176.784 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . 0.523 ' O ' ' HB1' ' X' ' 43' ' ' ALA . 17.8 t70 -88.86 124.59 34.34 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.034 -0.984 . . . . 0.0 112.177 -169.499 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.693 ' O ' HD12 ' X' ' 44' ' ' LEU . 1.5 mm -89.7 -24.32 5.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.131 175.838 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.19 -33.08 84.14 Favored Glycine 0 N--CA 1.441 -1.027 0 CA-C-N 115.264 -0.88 . . . . 0.0 112.762 -177.701 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -100.16 -21.88 15.38 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.873 0.368 . . . . 0.0 111.387 -178.632 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.659 ' HB3' ' HE1' ' X' ' 17' ' ' MET . . . -70.89 -32.66 69.7 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.655 178.557 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.905 HD13 HD13 ' X' ' 47' ' ' ILE . 6.3 mp -64.65 -35.25 80.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.757 -178.99 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . 0.452 ' HA ' ' HA ' ' X' ' 50' ' ' SER . 2.9 t70 -52.83 -38.92 61.98 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.174 0.296 . . . . 0.0 111.683 179.779 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 2.0 p -96.07 -22.15 17.52 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -176.95 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.905 HD13 HD13 ' X' ' 44' ' ' LEU . 16.8 pt -83.34 42.64 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-N 118.478 0.581 . . . . 0.0 112.145 176.915 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 74.74 13.51 3.5 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.359 0.664 . . . . 0.0 112.383 173.912 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -120.59 52.59 1.16 Allowed 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 120.655 0.264 . . . . 0.0 110.501 176.161 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' X' X ' 50' ' ' SER . . . . . 0.452 ' HA ' ' HA ' ' X' ' 45' ' ' ASP . 8.5 t -80.97 9.08 7.01 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.086 0.47 . . . . 0.0 111.723 -176.449 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -140.86 21.25 2.31 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.691 176.645 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 17.4 t-160 . . . . . 0 C--O 1.244 0.775 0 CA-C-O 118.035 -0.983 . . . . 0.0 109.887 -177.193 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.701 0 N-CA-C 111.949 -0.46 . . . . 0.0 111.949 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 35.3 t -90.64 140.47 26.59 Favored Pre-proline 0 C--N 1.322 -0.612 0 O-C-N 122.96 -0.141 . . . . 0.0 110.671 -178.076 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.411 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 19.5 Cg_exo -63.8 146.38 91.81 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.657 2.238 . . . . 0.0 111.563 177.497 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 16.0 Cg_exo -71.31 30.65 0.23 Allowed 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.999 2.466 . . . . 0.0 113.863 -176.36 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . 0.4 ' H ' ' C ' ' X' ' 3' ' ' PRO . 96.2 mt-10 -134.23 6.97 3.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.021 0.439 . . . . 0.0 110.451 176.114 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -165.99 28.35 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.073 178.16 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . 0.463 ' O ' HG23 ' X' ' 11' ' ' ILE . 57.6 p30 -83.67 156.18 65.05 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.252 179.465 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -47.19 -14.6 0.19 Allowed 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.07 2.513 . . . . 0.0 114.244 -176.064 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 68.8 mtm180 -94.37 -42.71 8.75 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 111.987 0.365 . . . . 0.0 111.987 179.506 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.425 HD23 ' HB2' ' X' ' 14' ' ' LEU . 53.1 mt -97.64 -26.08 14.89 Favored 'General case' 0 C--O 1.221 -0.446 0 O-C-N 122.213 -0.305 . . . . 0.0 111.458 -177.153 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.626 ' O ' ' HB3' ' X' ' 15' ' ' SER . 7.8 tt -70.68 -15.2 18.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 169.536 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -93.73 -59.06 2.08 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.33 174.267 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 36.7 m -82.91 -33.86 26.76 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.315 0.857 . . . . 0.0 113.315 -172.411 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.505 HD21 HD23 ' X' ' 18' ' ' LEU . 9.4 tt -93.92 -39.25 10.78 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-O 121.393 0.616 . . . . 0.0 109.444 -177.421 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.626 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 6.4 t -73.67 -21.21 60.33 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.374 -176.667 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . 0.569 HE21 ' CG ' ' X' ' 17' ' ' MET . 2.4 pp0? -69.61 -26.16 64.3 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 120.134 -0.627 . . . . 0.0 109.311 173.863 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.569 ' CG ' HE21 ' X' ' 16' ' ' GLN . 77.4 mtp -73.28 -46.35 50.36 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.649 175.642 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . 0.505 HD23 HD21 ' X' ' 14' ' ' LEU . 4.3 mm? -63.32 -41.87 98.94 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.889 179.19 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 16.1 m -70.05 -17.25 63.24 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -178.936 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 30.4 ttm -101.84 -30.23 11.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.864 0.364 . . . . 0.0 111.136 -176.41 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.48 45.74 0.65 Allowed Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.659 -0.782 . . . . 0.0 111.627 -178.785 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.46 ' HB3' HD11 ' X' ' 47' ' ' ILE . 41.0 m-85 -133.74 166.27 23.02 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 177.771 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 70.2 m -158.72 -123.51 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -178.601 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.639 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.3 p30 -118.78 130.98 56.09 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 169.485 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . 1.047 ' HG3' ' HE1' ' X' ' 28' ' ' TRP . 3.0 pp20? -78.73 1.62 22.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.051 0.453 . . . . 0.0 110.5 -178.534 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -152.02 -73.49 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.98 172.38 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -175.34 28.25 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.479 0 N-CA-C 110.896 -0.882 . . . . 0.0 110.896 175.486 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 1.047 ' HE1' ' HG3' ' X' ' 25' ' ' GLU . 53.3 p-90 -98.31 -19.87 17.53 Favored 'General case' 0 C--O 1.212 -0.898 0 CA-C-O 118.557 -0.735 . . . . 0.0 112.227 -175.035 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.639 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 28.5 tp -40.35 -53.21 2.62 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -168.917 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 30' ' ' THR . . . . . 0.404 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 60.2 p -72.78 -17.66 61.56 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -178.773 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -94.59 -48.88 5.9 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.673 -174.944 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.659 ' O ' ' HD3' ' X' ' 36' ' ' LYS . 3.4 tm? -50.12 -71.99 0.06 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 123.72 0.808 . . . . 0.0 111.381 -178.166 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.683 ' HB2' ' HA ' ' X' ' 38' ' ' TYR . 0.5 OUTLIER -62.83 -25.06 68.07 Favored 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -175.292 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . 0.487 ' NE2' ' HE1' ' X' ' 38' ' ' TYR . 5.9 tp-100 -57.65 -36.21 71.56 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 -179.118 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 7.1 m -96.03 -11.48 26.37 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.927 0.394 . . . . 0.0 110.939 -178.789 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . 0.659 ' HD3' ' O ' ' X' ' 32' ' ' LEU . 4.3 mptp? -108.17 36.55 2.75 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -177.505 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 41.6 t30 59.21 37.17 23.93 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.534 0.683 . . . . 0.0 111.084 178.169 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.683 ' HA ' ' HB2' ' X' ' 33' ' ' LEU . 54.8 m-85 54.34 59.12 4.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.256 179.48 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . 0.481 ' HB2' ' O ' ' X' ' 36' ' ' LYS . 2.4 t0 -91.72 128.9 37.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.667 -1.151 . . . . 0.0 111.428 -172.415 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.538 ' O ' HD11 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.12 -7.6 10.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.346 170.416 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -70.76 -42.23 62.03 Favored Glycine 0 N--CA 1.442 -0.964 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.077 -178.977 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -91.26 -22.6 20.5 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.16 -0.52 . . . . 0.0 111.216 178.444 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.488 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -69.04 -41.16 78.04 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.418 -179.387 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.538 HD11 ' O ' ' X' ' 40' ' ' ILE . 10.9 mp -75.14 -33.86 61.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.727 0.299 . . . . 0.0 110.362 178.839 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -57.32 -35.14 69.49 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.291 179.425 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 1.5 p -86.12 -44.03 12.58 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -176.206 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.643 HG22 ' CH2' ' X' ' 28' ' ' TRP . 4.5 pt -67.1 -30.35 49.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 -170.85 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -165.61 -32.07 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 111.606 0.224 . . . . 0.0 111.606 -177.488 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . 0.442 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 13.3 m-85 -77.88 42.31 0.38 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 120.765 0.316 . . . . 0.0 110.834 -179.27 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 14.6 m -87.5 20.94 2.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.966 0.413 . . . . 0.0 111.192 -177.219 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 1.7 mmmp? -111.69 38.07 2.74 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 174.996 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 49.5 t-80 . . . . . 0 C--O 1.245 0.831 0 CA-C-N 114.819 -1.082 . . . . 0.0 109.841 -173.924 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.885 0 N-CA-C 112.208 -0.357 . . . . 0.0 112.208 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 5.6 p -92.26 137.03 25.02 Favored Pre-proline 0 C--N 1.326 -0.451 0 O-C-N 122.815 -0.227 . . . . 0.0 111.046 -179.053 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' X' X ' 3' ' ' PRO . . . . . 0.415 ' C ' ' H ' ' X' ' 5' ' ' GLU . 37.0 Cg_exo -60.6 133.96 51.65 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.029 2.486 . . . . 0.0 112.073 -179.869 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 4' ' ' PRO . . . . . 0.43 ' O ' HD13 ' X' ' 10' ' ' LEU . 8.8 Cg_exo -73.8 24.39 0.33 Allowed 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 122.892 2.394 . . . . 0.0 113.382 -177.482 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 5' ' ' GLU . . . . . 0.415 ' H ' ' C ' ' X' ' 3' ' ' PRO . 87.9 mt-10 -141.05 13.49 2.24 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.228 0.537 . . . . 0.0 109.948 175.242 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -162.57 21.75 0.1 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.453 -178.783 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' X' X ' 7' ' ' ASP . . . . . 0.611 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 25.0 t70 -75.87 146.07 78.84 Favored Pre-proline 0 C--N 1.319 -0.751 0 CA-C-N 114.367 -1.288 . . . . 0.0 108.172 175.965 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 8' ' ' PRO . . . . . 0.611 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 80.2 Cg_exo -42.97 -25.61 0.57 Allowed 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.062 2.508 . . . . 0.0 112.982 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 9' ' ' ARG . . . . . 0.48 ' HB3' ' CG ' ' X' ' 38' ' ' TYR . 64.3 mmt-85 -93.41 -39.1 11.1 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.537 179.844 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 10' ' ' LEU . . . . . 0.689 HD22 ' HB2' ' X' ' 14' ' ' LEU . 79.3 mt -95.66 -19.55 19.63 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 122.137 -0.352 . . . . 0.0 111.631 -170.764 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 11' ' ' ILE . . . . . 0.503 ' O ' ' HB3' ' X' ' 15' ' ' SER . 0.0 OUTLIER -66.39 -24.62 33.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 171.635 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -95.91 -62.29 1.31 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.613 173.625 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 35.9 m -81.07 -21.25 40.18 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -169.445 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' X' X ' 14' ' ' LEU . . . . . 0.689 ' HB2' HD22 ' X' ' 10' ' ' LEU . 8.8 tp -92.97 -45.83 7.76 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.798 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 15' ' ' SER . . . . . 0.503 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 19.3 t -67.6 -26.24 66.16 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 114.004 -1.453 . . . . 0.0 111.528 -178.031 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 3.9 tm0? -52.25 -52.09 54.57 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.058 0.456 . . . . 0.0 110.944 177.485 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' X' X ' 17' ' ' MET . . . . . 0.631 ' SD ' HD13 ' X' ' 29' ' ' LEU . 8.4 ptm -89.06 -26.71 21.26 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.116 -175.619 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 18' ' ' LEU . . . . . 0.584 HD11 ' HG ' ' X' ' 14' ' ' LEU . 28.8 mt -72.08 -17.69 61.98 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 119.961 -0.696 . . . . 0.0 112.126 -179.474 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 32.4 p -94.52 -21.72 18.69 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 121.059 -0.256 . . . . 0.0 111.383 178.584 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 86.6 mtp -87.08 -31.66 20.35 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.702 0.287 . . . . 0.0 111.321 -179.13 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 108.31 35.56 2.47 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.487 -175.329 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' X' X ' 22' ' ' PHE . . . . . 0.457 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 15.0 m-30 -112.82 146.72 38.36 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 175.295 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 62.6 m -136.72 -177.56 4.79 Favored 'General case' 0 C--N 1.308 -1.211 0 C-N-CA 119.903 -0.719 . . . . 0.0 110.779 -174.878 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' X' X ' 24' ' ' ASP . . . . . 0.872 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 1.3 p30 -79.55 123.13 27.3 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.213 0.53 . . . . 0.0 110.117 175.251 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 25' ' ' GLU . . . . . 0.494 ' CB ' ' HE1' ' X' ' 28' ' ' TRP . 18.4 tp10 -68.57 -35.29 77.19 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.264 -177.089 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -139.92 20.28 2.88 Favored Glycine 0 C--N 1.32 -0.334 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.787 178.101 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' X' X ' 27' ' ' GLY . . . . . 0.564 ' O ' ' HG2' ' X' ' 31' ' ' ARG . . . 91.31 23.18 29.93 Favored Glycine 0 C--O 1.225 -0.424 0 C-N-CA 120.509 -0.853 . . . . 0.0 112.309 -179.736 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 28' ' ' TRP . . . . . 0.715 ' HB2' ' HB2' ' X' ' 32' ' ' LEU . 47.8 p-90 -89.83 -13.7 35.98 Favored 'General case' 0 C--O 1.217 -0.644 0 O-C-N 122.887 -0.184 . . . . 0.0 111.311 -178.385 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 29' ' ' LEU . . . . . 0.872 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 11.4 tp -63.0 -20.96 65.8 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 121.791 -0.568 . . . . 0.0 109.898 -179.259 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.5 -25.7 17.49 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.266 171.224 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 31' ' ' ARG . . . . . 0.564 ' HG2' ' O ' ' X' ' 27' ' ' GLY . 15.7 mmm180 -95.92 -65.47 0.97 Allowed 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -175.433 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 32' ' ' LEU . . . . . 0.715 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 2.8 tm? -39.12 -54.94 1.7 Allowed 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.853 1.261 . . . . 0.0 112.533 -176.197 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 33' ' ' LEU . . . . . 0.727 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 93.4 mt -54.63 -61.85 2.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.497 -176.796 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -38.1 -55.89 1.23 Allowed 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -175.653 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 6.4 p -76.46 -2.44 32.13 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -169.179 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -112.79 -27.31 8.19 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 119.995 -0.682 . . . . 0.0 111.971 -179.009 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 20.7 p30 136.87 15.86 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 125.931 1.693 . . . . 0.0 109.979 178.214 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' X' X ' 38' ' ' TYR . . . . . 0.727 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 26.0 m-85 72.42 56.25 0.15 Allowed 'General case' 0 C--N 1.341 0.217 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 -170.102 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -100.72 125.94 47.22 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.766 -171.265 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' X' X ' 40' ' ' ILE . . . . . 0.665 ' O ' HD11 ' X' ' 44' ' ' LEU . 0.1 OUTLIER -89.58 -8.6 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.123 173.664 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.97 -37.27 92.42 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.355 -0.926 . . . . 0.0 111.915 177.279 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.08 -21.39 16.21 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.506 -0.347 . . . . 0.0 110.74 175.904 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' X' X ' 43' ' ' ALA . . . . . 0.637 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -67.23 -33.78 76.08 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.018 178.049 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 44' ' ' LEU . . . . . 0.692 ' HA ' ' CG1' ' X' ' 47' ' ' ILE . 7.1 mp -63.98 -30.42 71.5 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.153 179.429 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 45' ' ' ASP . . . . . 0.561 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 21.1 t70 -57.37 -39.55 76.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.19 0.519 . . . . 0.0 110.812 174.749 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 11.7 p -94.46 -5.53 46.01 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -175.626 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' X' X ' 47' ' ' ILE . . . . . 0.692 ' CG1' ' HA ' ' X' ' 44' ' ' LEU . 2.0 pt -102.63 43.91 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 O-C-N 121.999 -0.438 . . . . 0.0 111.666 173.804 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 82.0 33.45 0.09 Allowed 'General case' 0 N--CA 1.474 0.744 0 O-C-N 124.276 0.985 . . . . 0.0 112.549 173.009 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' X' X ' 49' ' ' TYR . . . . . 0.561 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 63.8 m-85 -141.58 58.16 1.51 Allowed 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 173.855 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 50' ' ' SER . . . . . 0.532 ' HA ' ' OD1' ' X' ' 45' ' ' ASP . 8.1 p -97.35 23.78 7.19 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -174.493 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 28.6 ttpp -126.06 92.19 3.53 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 178.855 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 28.1 m80 . . . . . 0 C--O 1.245 0.84 0 CA-C-O 118.351 -0.833 . . . . 0.0 110.255 -178.288 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.444 0 CA-C-O 121.186 0.517 . . . . 0.0 109.78 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -74.85 148.84 85.19 Favored Pre-proline 0 C--N 1.319 -0.749 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 174.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 8' ' ' PRO . . . . . 0.452 ' O ' ' HB2' ' X' ' 12' ' ' GLU . 86.9 Cg_exo -46.85 -24.18 2.94 Favored 'Trans proline' 0 CA--C 1.535 0.563 0 C-N-CA 122.158 1.905 . . . . 0.0 112.555 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 27.3 mmm180 -93.38 -23.49 18.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.881 -0.6 . . . . 0.0 112.512 179.31 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 43.5 mt -98.37 -28.3 13.71 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.633 0.254 . . . . 0.0 110.883 -176.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.602 ' O ' ' HB3' ' X' ' 15' ' ' SER . 11.2 tp -75.82 -17.39 15.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 171.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 12' ' ' GLU . . . . . 0.452 ' HB2' ' O ' ' X' ' 8' ' ' PRO . 0.3 OUTLIER -91.12 -53.7 4.26 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.894 175.643 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' X' X ' 13' ' ' SER . . . . . 0.633 ' HB3' HG23 ' X' ' 40' ' ' ILE . 4.3 m -95.31 -26.19 16.02 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -170.383 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.409 HD22 ' HA ' ' X' ' 14' ' ' LEU . 2.5 tm? -94.86 -41.94 8.95 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.602 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 23.2 t -67.2 -25.72 66.27 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.984 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 16' ' ' GLN . . . . . 0.404 ' OE1' HD11 ' X' ' 44' ' ' LEU . 4.2 tm0? -63.66 -54.88 28.84 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 121.174 0.511 . . . . 0.0 110.308 176.055 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.722 ' SD ' HD11 ' X' ' 29' ' ' LEU . 14.2 ptp -71.69 -33.62 68.96 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.459 -177.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 28.1 tp -67.61 -36.46 80.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.881 0.372 . . . . 0.0 110.81 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 20.7 t -79.75 -38.24 33.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.243 -178.653 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 42.2 tpp -75.75 -31.52 59.59 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.617 0.228 . . . . 0.0 111.617 -175.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.88 47.27 0.62 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.145 -1.026 . . . . 0.0 112.754 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.653 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 50.4 m-85 -119.41 169.15 10.27 Favored 'General case' 0 CA--C 1.509 -0.603 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 175.065 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 42.0 m -151.31 -148.71 0.27 Allowed 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.113 -0.635 . . . . 0.0 110.369 -179.156 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.447 ' HA ' ' HB2' ' X' ' 29' ' ' LEU . 2.3 m-20 -92.46 115.81 28.43 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 174.126 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 25' ' ' GLU . . . . . 0.629 ' HG3' ' HA ' ' X' ' 47' ' ' ILE . 48.0 mm-40 -82.9 43.26 0.84 Allowed 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.715 177.694 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 143.05 -14.33 2.36 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.581 -178.332 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.58 7.38 36.92 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.834 -0.698 . . . . 0.0 111.902 -178.708 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.639 ' HH2' HG23 ' X' ' 47' ' ' ILE . 55.9 p-90 -86.51 -13.85 44.78 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 119.046 -0.502 . . . . 0.0 111.3 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.722 HD11 ' SD ' ' X' ' 17' ' ' MET . 36.9 tp -48.21 -51.0 27.21 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -167.366 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 25.5 p -65.43 -47.83 74.86 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.739 0.304 . . . . 0.0 111.019 177.111 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 31' ' ' ARG . . . . . 0.505 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 10.0 mtm180 -54.97 -52.48 62.92 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.903 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 32' ' ' LEU . . . . . 0.466 ' HB2' ' HE3' ' X' ' 28' ' ' TRP . 2.6 tm? -55.94 -55.25 34.9 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 123.034 0.533 . . . . 0.0 110.808 178.129 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 84.2 mt -56.91 -65.17 0.66 Allowed 'General case' 0 C--O 1.225 -0.214 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.195 -176.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -54.76 -38.7 67.54 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -172.688 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 42.8 p -71.88 -13.24 61.61 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -177.119 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -120.15 38.91 3.83 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.7 -0.227 . . . . 0.0 110.537 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 43.54 46.83 6.07 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.916 0.887 . . . . 0.0 112.029 -175.632 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 38' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 63.18 76.62 0.36 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.247 178.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -111.88 123.63 50.66 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.299 -174.171 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.723 ' HB ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.87 -8.76 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.454 174.2 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.46 -44.04 95.81 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.53 -0.843 . . . . 0.0 112.338 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -93.47 -18.91 21.77 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.698 0.285 . . . . 0.0 110.865 178.158 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.603 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -71.05 -51.05 27.51 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.487 177.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.76 ' HA ' ' CG1' ' X' ' 47' ' ' ILE . 10.3 mp -62.45 -28.9 70.13 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.509 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 45' ' ' ASP . . . . . 0.521 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 17.0 t70 -51.59 -44.77 62.93 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.474 0.484 . . . . 0.0 111.691 178.779 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 2.0 p -96.48 -23.68 16.45 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -177.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.76 ' CG1' ' HA ' ' X' ' 44' ' ' LEU . 25.3 pt -81.94 45.44 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 N-CA-C 112.935 0.716 . . . . 0.0 112.935 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 48' ' ' GLN . . . . . 0.454 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 3.0 mt-30 88.33 15.63 0.07 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.05 0.94 . . . . 0.0 113.342 173.231 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' X' X ' 49' ' ' TYR . . . . . 0.521 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 32.9 m-85 . . . . . 0 C--N 1.328 -0.365 0 O-C-N 121.985 -0.447 . . . . 0.0 110.219 171.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.439 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' X' X ' 7' ' ' ASP . . . . . 0.777 ' OD2' ' HD3' ' X' ' 9' ' ' ARG . 29.5 t70 -81.7 145.82 55.2 Favored Pre-proline 0 C--N 1.321 -0.672 0 CA-C-N 114.138 -1.392 . . . . 0.0 108.18 178.502 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 8' ' ' PRO . . . . . 0.579 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 92.9 Cg_exo -42.64 -26.0 0.57 Allowed 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 123.004 2.469 . . . . 0.0 113.879 -177.355 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 9' ' ' ARG . . . . . 0.777 ' HD3' ' OD2' ' X' ' 7' ' ' ASP . 3.6 mpp_? -92.89 -38.61 11.63 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 10' ' ' LEU . . . . . 0.499 HD22 ' HB2' ' X' ' 14' ' ' LEU . 87.9 mt -97.03 -15.57 20.98 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 -172.374 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.472 ' O ' ' HB3' ' X' ' 15' ' ' SER . 15.2 tt -72.48 -19.59 19.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 172.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -94.44 -51.03 4.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.317 174.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 13' ' ' SER . . . . . 0.43 ' O ' ' HG2' ' X' ' 17' ' ' MET . 34.5 m -94.73 -29.63 14.69 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -169.005 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.499 ' HB2' HD22 ' X' ' 10' ' ' LEU . 10.0 tt -94.24 -40.62 9.9 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.472 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 5.6 t -67.53 -26.1 66.16 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.708 -179.03 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 16' ' ' GLN . . . . . 0.415 ' HA ' ' OG ' ' X' ' 19' ' ' SER . 1.1 pp0? -73.64 -28.48 61.8 Favored 'General case' 0 C--O 1.224 -0.263 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 175.597 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.43 ' HG2' ' O ' ' X' ' 13' ' ' SER . 91.0 mmm -65.46 -42.29 92.48 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 174.232 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.38 -34.64 77.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.067 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 19' ' ' SER . . . . . 0.415 ' OG ' ' HA ' ' X' ' 16' ' ' GLN . 5.1 p -84.83 -34.79 22.62 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -175.595 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 20' ' ' MET . . . . . 0.447 ' HA ' ' CE ' ' X' ' 20' ' ' MET . 21.2 mmt -78.44 -15.2 58.9 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 121.141 -0.224 . . . . 0.0 111.486 -178.409 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 98.68 44.57 2.45 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.499 178.714 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -125.6 -177.78 4.02 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 176.058 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 23' ' ' SER . . . . . 0.41 ' O ' HG21 ' X' ' 47' ' ' ILE . 42.5 m -156.96 -134.86 0.04 OUTLIER 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 175.524 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.586 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 2.8 p30 -122.15 131.43 53.95 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 169.737 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -97.61 55.11 1.21 Allowed 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.099 -0.64 . . . . 0.0 109.868 178.345 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 144.31 -0.22 1.08 Allowed Glycine 0 CA--C 1.518 0.227 0 C-N-CA 120.279 -0.963 . . . . 0.0 113.632 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.0 11.22 63.58 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.004 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.798 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 42.0 p-90 -87.21 -5.62 58.89 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -176.701 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.586 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 53.7 tp -59.83 -26.59 65.92 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 122.075 -0.39 . . . . 0.0 111.35 -175.083 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 80.5 p -93.73 -11.47 31.37 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.816 0.341 . . . . 0.0 111.082 175.326 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 31' ' ' ARG . . . . . 0.498 ' CG ' ' HA ' ' X' ' 28' ' ' TRP . 13.3 mmm180 -94.99 -61.98 1.39 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.25 0.548 . . . . 0.0 110.746 -178.458 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -47.16 -72.37 0.05 Allowed 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 114.345 -1.298 . . . . 0.0 111.408 -177.136 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.583 ' H ' HD12 ' X' ' 33' ' ' LEU . 6.3 mp -53.79 -50.0 67.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.579 -175.766 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 34' ' ' GLN . . . . . 0.401 HE22 HD21 ' X' ' 10' ' ' LEU . 0.0 OUTLIER -49.22 -34.06 14.01 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -176.154 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 2.7 m -99.05 -2.86 36.11 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 111.732 0.271 . . . . 0.0 111.732 -174.178 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -123.86 37.75 4.34 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -177.049 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 47.8 t30 69.48 26.33 5.18 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.38 0.61 . . . . 0.0 110.73 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.524 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 29.4 m-85 54.54 64.9 1.66 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.268 178.254 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 39' ' ' ASP . . . . . 0.426 ' O ' ' HG ' ' X' ' 33' ' ' LEU . 33.7 p-10 -103.79 133.8 48.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.013 -0.994 . . . . 0.0 112.551 -173.594 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.645 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -91.45 -3.92 10.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.95 170.285 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.96 -36.32 81.18 Favored Glycine 0 N--CA 1.444 -0.807 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.736 177.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -96.88 -17.66 20.02 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.304 -0.448 . . . . 0.0 110.783 176.119 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.645 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -68.44 -45.99 71.05 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.217 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.618 ' HA ' HD11 ' X' ' 47' ' ' ILE . 10.2 mp -63.41 -34.01 76.8 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.788 0.328 . . . . 0.0 110.754 178.297 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -58.85 -38.31 78.44 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.743 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 9.6 p -96.48 -5.93 38.38 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -172.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.798 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 1.4 pp -98.81 -27.07 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 CA-C-N 119.565 1.075 . . . . 0.0 112.502 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 48' ' ' GLN . . . . . 0.494 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.6 mp0 -159.8 -35.92 0.06 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.784 0.326 . . . . 0.0 110.949 -179.11 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.426 -177.011 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.48 0 CA-C-O 121.881 0.848 . . . . 0.0 109.837 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -89.68 150.08 43.44 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 172.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -46.36 -25.27 3.12 Favored 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 122.339 2.026 . . . . 0.0 113.05 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 66.0 mtt85 -87.59 -38.59 15.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.661 178.121 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 98.0 mt -81.95 -26.61 33.85 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.498 -176.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.512 ' O ' ' HB3' ' X' ' 15' ' ' SER . 0.3 OUTLIER -69.48 -20.18 23.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 174.188 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -88.34 -63.99 1.21 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.186 -0.915 . . . . 0.0 111.668 173.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 11.5 m -89.67 -26.7 20.57 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -167.053 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.57 ' HG ' HD11 ' X' ' 29' ' ' LEU . 7.8 tt -93.4 -42.74 9.12 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.512 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 15.3 t -67.12 -31.13 71.39 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.789 -175.509 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -65.91 -33.35 75.63 Favored 'General case' 0 C--O 1.227 -0.103 0 C-N-CA 120.501 -0.48 . . . . 0.0 111.022 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.812 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 14.7 ptm -89.03 -30.31 18.81 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.046 177.597 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 53.3 tp -59.71 -41.5 90.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.935 0.398 . . . . 0.0 110.665 177.641 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 14.6 m -87.69 -40.1 14.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.228 -175.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 86.3 mmm -72.28 -27.18 62.31 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -175.049 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.25 46.87 0.62 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 119.901 -1.142 . . . . 0.0 113.172 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.812 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 39.7 m-85 -122.69 160.24 26.27 Favored 'General case' 0 CA--C 1.511 -0.552 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 171.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 5.0 m -147.87 178.11 8.77 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.095 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.592 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.3 p30 -85.07 130.03 34.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.201 0.524 . . . . 0.0 110.082 173.522 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 25' ' ' GLU . . . . . 0.729 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 51.7 tp10 -69.67 -25.08 63.72 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.212 -176.849 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -145.66 15.25 1.8 Allowed Glycine 0 C--O 1.228 -0.238 0 C-N-CA 120.336 -0.935 . . . . 0.0 113.597 -178.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 27' ' ' GLY . . . . . 0.423 ' O ' ' HD3' ' X' ' 31' ' ' ARG . . . 90.91 22.89 31.72 Favored Glycine 0 CA--C 1.509 -0.337 0 C-N-CA 120.468 -0.872 . . . . 0.0 111.92 179.616 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.729 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 38.8 p-90 -96.12 -5.0 41.75 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -176.343 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.592 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 3.2 tp -51.37 -38.73 54.81 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -170.226 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 30' ' ' THR . . . . . 0.768 ' O ' ' HG3' ' X' ' 34' ' ' GLN . 70.5 p -79.72 -46.2 17.5 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 119.928 -0.709 . . . . 0.0 110.195 173.185 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 31' ' ' ARG . . . . . 0.677 ' HD2' ' H ' ' X' ' 31' ' ' ARG . 1.4 mpt_? -53.34 -66.19 0.43 Allowed 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.422 0.689 . . . . 0.0 112.398 -179.065 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 32' ' ' LEU . . . . . 0.491 HD22 ' HE2' ' X' ' 36' ' ' LYS . 3.5 tm? -50.91 -60.5 3.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.437 -177.311 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.535 HD13 ' O ' ' X' ' 29' ' ' LEU . 11.0 mp -52.51 -47.8 66.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.405 -175.209 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 34' ' ' GLN . . . . . 0.768 ' HG3' ' O ' ' X' ' 30' ' ' THR . 33.2 mt-30 -64.88 -26.07 68.16 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -173.325 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 70.4 p -74.02 -16.68 61.05 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.315 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 36' ' ' LYS . . . . . 0.491 ' HE2' HD22 ' X' ' 32' ' ' LEU . 2.8 mptp? -121.33 37.08 4.43 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 121.266 -0.173 . . . . 0.0 111.462 177.677 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 37.9 t30 66.25 52.72 1.1 Allowed 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.161 0.505 . . . . 0.0 111.357 177.024 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.419 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 1.2 m-85 44.71 58.61 3.82 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.131 177.164 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 39' ' ' ASP . . . . . 0.489 ' O ' ' HG ' ' X' ' 33' ' ' LEU . 24.9 p-10 -111.15 151.49 28.1 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 119.167 -1.013 . . . . 0.0 113.523 -172.141 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.627 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -90.66 -2.88 10.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 114.11 -1.405 . . . . 0.0 110.119 172.245 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.31 -37.06 85.89 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.851 -0.69 . . . . 0.0 111.797 -178.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.21 -21.0 17.54 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.251 -0.474 . . . . 0.0 110.532 175.434 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.627 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -63.62 -47.26 82.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.303 178.815 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.413 ' HA ' HD11 ' X' ' 47' ' ' ILE . 1.1 tp -62.68 -26.35 68.61 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.355 -179.295 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -67.28 -45.64 76.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.057 -179.439 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 27.5 p -97.31 -20.7 17.68 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -170.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.703 HG23 ' HH2' ' X' ' 28' ' ' TRP . 4.6 pt -64.58 -30.37 50.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 118.959 0.799 . . . . 0.0 112.586 -171.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -166.42 -41.56 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.201 0.524 . . . . 0.0 109.923 177.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 . . . . . 0 C--N 1.326 -0.416 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.007 -175.227 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.415 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.01 154.22 41.76 Favored Pre-proline 0 C--O 1.218 -0.59 0 CA-C-N 114.785 -1.098 . . . . 0.0 108.322 174.043 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_exo -45.7 -22.46 1.19 Allowed 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 123.305 2.67 . . . . 0.0 114.55 -174.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -83.99 -42.17 16.5 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 122.055 -0.403 . . . . 0.0 112.045 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 67.9 mt -99.25 -19.45 17.09 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -175.578 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.598 ' O ' ' HB3' ' X' ' 15' ' ' SER . 0.1 OUTLIER -69.4 -22.73 25.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 175.653 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -93.78 -37.58 11.71 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.765 176.138 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 13' ' ' SER . . . . . 0.405 ' HA ' HG23 ' X' ' 40' ' ' ILE . 7.4 m -95.83 -40.72 9.19 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -171.77 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.422 HD23 HD11 ' X' ' 29' ' ' LEU . 3.3 tm? -94.58 -48.41 6.11 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -178.306 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.598 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 22.9 t -64.49 -27.11 68.75 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.053 -176.344 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 18.6 tm0? -62.56 -46.65 87.38 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.206 0.527 . . . . 0.0 109.812 174.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 17' ' ' MET . . . . . . . . . . . . . 77.2 mtp -71.36 -43.62 66.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.723 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 29.1 tp -62.58 -32.48 73.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.953 -176.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 8.0 t -96.33 -11.04 26.41 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.749 0.278 . . . . 0.0 111.749 -175.436 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 14.0 tpt -102.0 -31.71 10.53 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.777 -0.369 . . . . 0.0 111.372 -178.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.28 44.91 0.7 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.547 -0.835 . . . . 0.0 111.607 -177.37 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -128.99 146.58 50.94 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 177.097 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 14.9 m -146.22 -164.03 1.88 Allowed 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.132 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.915 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 9.1 p-10 -76.33 116.68 17.25 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 172.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 58.9 tt0 -100.96 65.17 1.09 Allowed 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 177.214 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 140.64 -6.07 2.64 Favored Glycine 0 N--CA 1.449 -0.478 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.268 -174.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.79 16.75 55.96 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 121.089 -0.577 . . . . 0.0 112.124 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.683 ' HH2' HG23 ' X' ' 47' ' ' ILE . 58.6 p-90 -93.32 -13.33 28.28 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -174.621 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.915 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 3.7 tp -57.01 -33.62 67.35 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.648 -0.658 . . . . 0.0 112.135 -170.35 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 30' ' ' THR . . . . . 0.5 ' O ' ' HG2' ' X' ' 34' ' ' GLN . 10.4 p -87.89 -10.41 50.77 Favored 'General case' 0 C--O 1.218 -0.599 0 C-N-CA 120.185 -0.606 . . . . 0.0 111.034 175.499 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 31' ' ' ARG . . . . . 0.53 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 20.0 mtp180 -95.6 -56.4 2.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.337 0.589 . . . . 0.0 110.868 -178.328 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -50.46 -53.31 30.69 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.948 -177.239 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.715 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 9.6 mp -68.31 -47.08 68.53 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -170.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 34' ' ' GLN . . . . . 0.5 ' HG2' ' O ' ' X' ' 30' ' ' THR . 50.0 mm-40 -37.98 -71.27 0.08 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 -172.024 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 33.3 p -60.81 -29.91 69.75 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.802 0.334 . . . . 0.0 111.84 -173.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 36' ' ' LYS . . . . . 0.403 ' HB3' ' HB2' ' X' ' 39' ' ' ASP . 49.8 mttp -88.01 37.07 0.79 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.409 177.898 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 46.37 34.32 2.23 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.352 1.061 . . . . 0.0 112.56 179.169 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.715 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 31.9 m-85 68.57 73.9 0.27 Allowed 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.869 -176.878 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 39' ' ' ASP . . . . . 0.403 ' HB2' ' HB3' ' X' ' 36' ' ' LYS . 35.2 t0 -100.47 125.5 46.78 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.975 -175.858 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.647 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.95 -13.79 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.625 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.662 169.856 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.63 -37.93 95.58 Favored Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.564 -0.827 . . . . 0.0 112.352 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.08 -18.75 19.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.436 -0.382 . . . . 0.0 111.065 176.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.646 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -70.47 -36.36 73.84 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.498 178.46 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.768 HD12 HD11 ' X' ' 47' ' ' ILE . 7.1 mp -60.7 -36.88 79.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.188 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 45' ' ' ASP . . . . . 0.543 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.1 t70 -51.93 -41.72 62.25 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 123.48 0.487 . . . . 0.0 111.354 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 5.1 p -96.23 -5.81 39.53 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -177.409 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.768 HD11 HD12 ' X' ' 44' ' ' LEU . 14.1 pt -101.95 44.33 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 CA-C-N 118.164 0.438 . . . . 0.0 111.63 174.603 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 79.04 27.1 0.43 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.94 0.896 . . . . 0.0 112.367 174.577 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' X' X ' 49' ' ' TYR . . . . . 0.543 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 62.3 m-85 . . . . . 0 C--N 1.326 -0.431 0 CA-C-O 120.882 0.372 . . . . 0.0 110.173 173.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 6' ' ' ALA . . . . . 0.427 ' HA ' HG23 ' X' ' 11' ' ' ILE . . . . . . . . 0 CA--C 1.515 -0.372 0 CA-C-O 121.554 0.692 . . . . 0.0 109.935 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 7' ' ' ASP . . . . . 0.49 ' O ' HG12 ' X' ' 11' ' ' ILE . 7.6 t70 -93.94 147.96 34.41 Favored Pre-proline 0 C--N 1.314 -0.974 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 175.133 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 8' ' ' PRO . . . . . 0.455 ' HA ' HD11 ' X' ' 11' ' ' ILE . 85.0 Cg_exo -44.18 -30.32 3.41 Favored 'Trans proline' 0 CA--C 1.532 0.421 0 C-N-CA 122.903 2.402 . . . . 0.0 112.709 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 9' ' ' ARG . . . . . 0.478 ' HB3' ' HD2' ' X' ' 38' ' ' TYR . 80.3 mtm-85 -84.15 -29.49 26.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.514 178.795 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 10' ' ' LEU . . . . . 0.412 HD22 ' HB2' ' X' ' 14' ' ' LEU . 88.1 mt -97.88 -20.71 17.32 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -174.704 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.49 HG12 ' O ' ' X' ' 7' ' ' ASP . 10.7 pt -73.64 -13.41 16.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 168.535 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -95.21 -53.13 3.9 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.629 174.057 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 23.7 t -93.29 -32.22 14.4 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -169.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.412 ' HB2' HD22 ' X' ' 10' ' ' LEU . 8.3 tt -93.28 -40.33 10.48 Favored 'General case' 0 CA--C 1.51 -0.592 0 O-C-N 121.395 -0.816 . . . . 0.0 109.002 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.471 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 10.5 t -70.03 -23.1 63.06 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.494 -176.556 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 16' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' X' ' 20' ' ' MET . 0.0 OUTLIER -65.3 -26.78 68.21 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.249 -179.906 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.709 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 15.9 ptm -99.14 -24.74 14.77 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 121.033 -0.267 . . . . 0.0 110.504 175.677 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 35.7 tp -62.22 -40.73 97.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.752 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 40.3 p -91.4 -25.81 19.18 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.487 -178.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 20' ' ' MET . . . . . 0.401 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 44.5 ttm -73.89 -31.26 63.04 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.499 -0.318 . . . . 0.0 111.148 -176.068 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 104.54 47.12 1.23 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.081 -1.057 . . . . 0.0 112.685 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.709 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 13.9 m-30 -114.27 175.92 5.27 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 175.366 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 23' ' ' SER . . . . . 0.607 ' O ' HG22 ' X' ' 47' ' ' ILE . 12.3 m -145.9 158.64 43.85 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 119.812 -0.755 . . . . 0.0 111.407 -178.174 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 24' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -68.68 133.74 48.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.464 173.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 25' ' ' GLU . . . . . 0.814 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 2.3 tm-20 -91.28 -16.95 26.74 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -175.107 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -170.25 21.1 0.08 OUTLIER Glycine 0 CA--C 1.519 0.32 0 C-N-CA 119.221 -1.466 . . . . 0.0 114.49 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 87.19 24.0 38.77 Favored Glycine 0 C--N 1.32 -0.311 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.402 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.814 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 59.1 p-90 -96.86 -14.65 21.69 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 119.157 -0.449 . . . . 0.0 112.179 -178.468 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.421 ' HA ' ' CE3' ' X' ' 28' ' ' TRP . 26.0 tp -52.33 -24.31 7.34 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -169.789 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 21.8 p -88.65 -61.59 1.68 Allowed 'General case' 0 C--N 1.32 -0.683 0 O-C-N 121.826 -0.546 . . . . 0.0 110.469 169.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 31' ' ' ARG . . . . . 0.73 ' HG2' ' HA ' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -49.37 -56.74 8.56 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -177.482 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' X' X ' 32' ' ' LEU . . . . . 0.603 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 2.5 tm? -54.12 -46.46 72.19 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 122.642 0.377 . . . . 0.0 110.842 -178.243 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.595 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 11.2 mp -70.04 -51.38 32.55 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.454 -178.259 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -44.37 -56.22 4.38 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -176.39 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 61.9 p -75.92 -2.7 31.55 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -175.473 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 36' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' X' ' 39' ' ' ASP . 53.7 mttp -120.59 28.27 8.07 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 40.7 t30 64.02 30.86 13.92 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.737 0.779 . . . . 0.0 110.262 178.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.595 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 8.6 m-30 59.43 63.55 1.53 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.874 -174.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 39' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' X' ' 36' ' ' LYS . 32.2 t70 -95.86 124.83 40.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.871 -173.153 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.817 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -90.44 -6.25 10.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.396 171.769 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.29 -40.81 99.5 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.442 -0.885 . . . . 0.0 111.982 177.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.5 -20.98 16.14 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.173 -0.514 . . . . 0.0 110.906 176.355 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.817 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -66.88 -39.15 87.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.646 178.584 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.854 HD12 HD11 ' X' ' 47' ' ' ILE . 5.7 mp -57.85 -37.02 73.13 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.149 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -49.78 -46.34 50.68 Favored 'General case' 0 CA--C 1.532 0.269 0 O-C-N 123.696 0.623 . . . . 0.0 111.499 178.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -88.21 -21.69 24.41 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -177.63 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.854 HD11 HD12 ' X' ' 44' ' ' LEU . 8.1 pt -88.05 43.3 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 O-C-N 121.757 -0.589 . . . . 0.0 111.639 174.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 48' ' ' GLN . . . . . 0.444 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 1.5 mp0 85.88 38.13 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.526 1.13 . . . . 0.0 112.982 174.223 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' X' X ' 49' ' ' TYR . . . . . 0.561 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 26.6 m-85 . . . . . 0 C--N 1.328 -0.335 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 170.012 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.3 0 CA-C-O 121.084 0.469 . . . . 0.0 110.252 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' X' X ' 7' ' ' ASP . . . . . 0.406 ' O ' HG22 ' X' ' 11' ' ' ILE . 8.3 m-20 -77.75 154.78 80.93 Favored Pre-proline 0 C--O 1.216 -0.669 0 CA-C-N 115.448 -0.797 . . . . 0.0 109.298 176.158 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -46.04 -26.2 3.39 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 122.911 2.407 . . . . 0.0 112.675 177.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 56.0 mtm-85 -92.02 -33.96 14.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.188 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 93.7 mt -98.4 -19.52 17.68 Favored 'General case' 0 C--O 1.219 -0.519 0 O-C-N 122.223 -0.298 . . . . 0.0 111.578 -173.065 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.573 ' O ' ' HB3' ' X' ' 15' ' ' SER . 10.6 tt -74.08 -15.36 16.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 169.477 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 12' ' ' GLU . . . . . 0.516 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 4.7 tm-20 -94.77 -60.74 1.63 Allowed 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 114.754 -1.112 . . . . 0.0 110.277 175.605 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 36.7 m -89.77 -26.43 20.6 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -170.576 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 14' ' ' LEU . . . . . . . . . . . . . 7.5 tt -92.88 -40.41 10.63 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.573 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 28.1 t -70.18 -17.09 63.15 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.908 178.07 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 16' ' ' GLN . . . . . 0.516 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 12.7 tm0? -55.24 -50.73 68.71 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.509 178.383 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 17' ' ' MET . . . . . 1.014 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 0.5 OUTLIER -91.18 -23.66 20.17 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.012 179.405 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' X' X ' 18' ' ' LEU . . . . . 0.543 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 24.2 tp -63.49 -40.95 98.43 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.798 0.332 . . . . 0.0 110.805 -178.54 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 12.2 t -99.55 9.38 43.3 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.211 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 20' ' ' MET . . . . . 0.474 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 55.1 tpp -104.5 -31.2 9.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.836 0.351 . . . . 0.0 110.874 -179.31 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 108.9 45.75 1.01 Allowed Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.313 -0.946 . . . . 0.0 111.831 -177.022 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 1.014 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 46.0 m-85 -125.79 178.78 5.51 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 175.162 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 44.8 m -161.39 160.23 29.22 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 176.614 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.669 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 50.2 p-10 -78.39 160.52 27.73 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.374 -0.53 . . . . 0.0 109.89 172.157 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 25' ' ' GLU . . . . . 0.749 ' HG2' ' CD1' ' X' ' 28' ' ' TRP . 18.1 pt-20 -64.05 -20.39 65.9 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.407 178.589 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 144.24 42.56 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.217 -0.992 . . . . 0.0 114.324 174.59 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 154.95 -16.85 0.54 Allowed Glycine 0 C--N 1.333 0.403 0 C-N-CA 118.39 -1.862 . . . . 0.0 115.389 171.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.936 ' HH2' HG23 ' X' ' 47' ' ' ILE . 43.2 p-90 -87.03 -20.03 27.78 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 118.459 1.13 . . . . 0.0 113.033 -173.807 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.669 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 42.3 tp -55.79 -21.32 18.7 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.15 0.886 . . . . 0.0 111.401 -176.502 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.88 -31.67 17.22 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 175.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 31' ' ' ARG . . . . . 0.675 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -95.15 -52.05 4.37 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 -178.678 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' X' X ' 32' ' ' LEU . . . . . 0.561 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 3.2 tm? -49.83 -51.56 39.05 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.49 0.716 . . . . 0.0 111.535 -177.397 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.698 ' O ' ' HA ' ' X' ' 38' ' ' TYR . 8.0 mp -71.99 -9.03 57.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.751 -177.107 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.7 -38.5 10.78 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.714 0.293 . . . . 0.0 110.775 -179.134 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 9.3 p -75.21 -39.49 60.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.44 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 36' ' ' LYS . . . . . 0.407 ' HG2' ' CB ' ' X' ' 42' ' ' ALA . 5.0 mptp? -78.3 37.92 0.28 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.956 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 41.9 45.92 3.34 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.851 0.86 . . . . 0.0 112.151 -177.526 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.698 ' HA ' ' O ' ' X' ' 33' ' ' LEU . 67.7 m-85 59.78 77.86 0.3 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.312 177.227 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -134.84 138.69 44.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.931 -175.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.65 ' H ' HD13 ' X' ' 40' ' ' ILE . 0.1 OUTLIER -90.14 -9.72 10.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.919 169.294 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.57 -34.41 89.44 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.203 178.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 42' ' ' ALA . . . . . 0.407 ' CB ' ' HG2' ' X' ' 36' ' ' LYS . . . -99.01 -15.29 19.12 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.334 -0.433 . . . . 0.0 110.612 176.295 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.648 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -76.56 -35.84 57.97 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.163 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.507 HD13 ' O ' ' X' ' 40' ' ' ILE . 9.5 mp -69.7 -32.65 71.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.275 177.823 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -60.92 -31.85 71.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.157 177.215 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 21.8 p -98.01 -33.91 11.0 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -174.155 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.936 HG23 ' HH2' ' X' ' 28' ' ' TRP . 1.8 pt -65.71 -35.04 74.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 C-N-CA 119.337 -0.945 . . . . 0.0 112.837 -169.688 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' X' X ' 48' ' ' GLN . . . . . 0.431 ' OE1' ' HD1' ' X' ' 22' ' ' PHE . 1.0 OUTLIER -166.89 -34.95 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 120.735 0.302 . . . . 0.0 110.382 179.075 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' X' X ' 49' ' ' TYR . . . . . 0.504 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 52.7 m-85 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.978 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.324 0 CA-C-O 121.722 0.772 . . . . 0.0 109.149 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' X' X ' 7' ' ' ASP . . . . . 0.43 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 32.3 t70 -93.85 144.53 28.28 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 114.86 -1.064 . . . . 0.0 108.34 178.709 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 8' ' ' PRO . . . . . 0.43 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 93.0 Cg_exo -42.36 -23.66 0.3 Allowed 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.362 2.708 . . . . 0.0 114.054 -178.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 9' ' ' ARG . . . . . 0.469 ' HD3' ' CE2' ' X' ' 38' ' ' TYR . 60.1 mtt85 -87.73 -46.07 9.8 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 10' ' ' LEU . . . . . 0.719 HD22 ' HB2' ' X' ' 14' ' ' LEU . 74.3 mt -99.41 -11.89 20.73 Favored 'General case' 0 C--O 1.219 -0.504 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -175.463 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.659 ' O ' ' HB3' ' X' ' 15' ' ' SER . 11.2 tt -69.25 -25.65 29.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 121.552 0.691 . . . . 0.0 109.202 176.087 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -96.61 -38.11 10.09 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.661 176.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 32.5 m -96.01 -33.0 12.3 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -172.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.719 ' HB2' HD22 ' X' ' 10' ' ' LEU . 10.1 tt -95.33 -49.0 5.65 Favored 'General case' 0 CA--C 1.508 -0.657 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.659 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 37.2 t -61.42 -31.4 71.33 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 114.426 -1.261 . . . . 0.0 111.403 -177.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -53.47 -55.0 29.04 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.871 0.367 . . . . 0.0 110.22 176.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.744 ' HB3' ' HB2' ' X' ' 22' ' ' PHE . 68.8 mtm -69.23 -39.91 78.24 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.493 -178.419 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.91 -32.5 74.23 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -177.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 20.7 p -86.13 -37.35 18.87 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.852 0.315 . . . . 0.0 111.852 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 13.4 tpt -69.99 -24.95 63.39 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.362 -176.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.9 34.54 1.5 Allowed Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.434 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.744 ' HB2' ' HB3' ' X' ' 17' ' ' MET . 5.6 m-85 -110.58 -176.13 2.9 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 173.056 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 23' ' ' SER . . . . . 0.6 ' O ' HG21 ' X' ' 47' ' ' ILE . 15.3 m -152.47 -149.28 0.29 Allowed 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.392 178.082 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.444 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 12.2 p-10 -122.88 131.78 53.89 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 170.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -115.69 68.05 0.71 Allowed 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.097 -0.641 . . . . 0.0 111.012 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 136.9 5.51 1.89 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.378 -0.915 . . . . 0.0 113.136 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 79.38 7.63 88.34 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.173 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.834 ' HZ2' HG23 ' X' ' 47' ' ' ILE . 46.0 p-90 -79.65 -10.1 59.74 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 111.556 0.206 . . . . 0.0 111.556 -178.435 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.675 HD11 ' HG ' ' X' ' 14' ' ' LEU . 14.5 tp -55.97 -24.65 39.76 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 122.015 -0.428 . . . . 0.0 111.283 -174.818 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 30' ' ' THR . . . . . 0.636 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 20.5 p -94.41 -47.47 6.57 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 122.072 -0.393 . . . . 0.0 110.706 169.605 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 31' ' ' ARG . . . . . 0.448 ' H ' ' HG2' ' X' ' 31' ' ' ARG . 15.6 mmm180 -55.65 -59.78 4.37 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.303 0.641 . . . . 0.0 112.012 -178.16 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 32' ' ' LEU . . . . . 0.535 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 2.8 tm? -55.97 -60.53 3.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.934 -1.03 . . . . 0.0 111.128 -176.118 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.454 HD13 ' O ' ' X' ' 29' ' ' LEU . 9.8 mp -57.32 -45.61 84.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.387 -176.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 34' ' ' GLN . . . . . 0.636 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.3 OUTLIER -49.82 -48.43 50.86 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 123.217 0.323 . . . . 0.0 111.436 179.685 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 14.1 m -67.15 -46.21 74.74 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.171 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -81.74 37.14 0.46 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.682 -179.296 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 5.5 p-10 40.33 49.92 2.6 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.806 0.842 . . . . 0.0 112.387 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.469 ' CE2' ' HD3' ' X' ' 9' ' ' ARG . 79.2 m-85 61.72 67.93 0.73 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.143 177.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -120.6 137.94 54.15 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.82 -177.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.71 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -90.9 -9.8 10.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.432 171.826 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -60.78 -38.43 95.23 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.587 -178.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.51 -15.4 18.68 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.486 -0.357 . . . . 0.0 110.594 175.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.71 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -68.41 -51.33 45.12 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.357 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.464 HD13 ' HB ' ' X' ' 40' ' ' ILE . 11.1 mp -59.52 -28.69 67.29 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.886 0.374 . . . . 0.0 110.913 178.802 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 45' ' ' ASP . . . . . 0.451 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 37.1 t70 -65.36 -33.09 75.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.797 -179.095 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 5.0 p -95.87 -5.81 40.77 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 -172.051 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.834 HG23 ' HZ2' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -105.03 -27.39 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-N 119.005 0.821 . . . . 0.0 112.522 -179.047 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' X' X ' 48' ' ' GLN . . . . . 0.539 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 0.0 OUTLIER -157.49 -48.84 0.07 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.282 0.563 . . . . 0.0 110.279 179.71 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' X' X ' 49' ' ' TYR . . . . . 0.451 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 48.1 m-85 . . . . . 0 C--N 1.323 -0.55 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.781 -173.33 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.515 -0.385 0 CA-C-O 121.707 0.765 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' X' X ' 7' ' ' ASP . . . . . 0.588 ' CG ' ' HD2' ' X' ' 8' ' ' PRO . 21.5 t70 -75.75 154.32 85.24 Favored Pre-proline 0 C--N 1.318 -0.764 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 176.544 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 8' ' ' PRO . . . . . 0.588 ' HD2' ' CG ' ' X' ' 7' ' ' ASP . 71.1 Cg_exo -39.07 -25.41 0.1 Allowed 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 123.233 2.622 . . . . 0.0 113.627 -178.454 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 9' ' ' ARG . . . . . 0.529 ' HD3' ' OD2' ' X' ' 7' ' ' ASP . 5.6 mtp180 -77.11 -48.11 18.64 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 176.054 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 79.6 mt -92.05 -26.4 18.34 Favored 'General case' 0 C--O 1.217 -0.608 0 O-C-N 122.254 -0.279 . . . . 0.0 111.672 -175.03 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.525 ' O ' ' HB3' ' X' ' 15' ' ' SER . 12.7 tt -69.69 -15.32 19.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 173.065 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -91.8 -58.4 2.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.001 174.213 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 50.2 m -90.86 -29.96 17.22 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -169.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.407 ' O ' ' HG3' ' X' ' 17' ' ' MET . 5.2 tt -94.52 -45.05 7.58 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 -179.686 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.525 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 19.3 t -64.77 -25.73 68.05 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.8 -175.763 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 16' ' ' GLN . . . . . 0.669 ' O ' ' HB2' ' X' ' 20' ' ' MET . 5.2 pp0? -65.96 -24.31 66.78 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 120.952 -0.299 . . . . 0.0 111.562 -179.549 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.528 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 4.6 ppp? -101.52 -27.38 13.14 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.775 0.322 . . . . 0.0 110.564 176.19 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 24.7 tp -65.93 -43.29 88.52 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.983 -179.123 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 29.6 t -96.84 8.82 43.5 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.09 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 20' ' ' MET . . . . . 0.669 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 10.3 tpt -100.36 -31.42 11.34 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.972 0.415 . . . . 0.0 110.561 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.11 42.1 2.88 Favored Glycine 0 N--CA 1.447 -0.611 0 N-CA-C 111.058 -0.817 . . . . 0.0 111.058 -174.257 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.528 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 11.4 m-30 -115.76 171.23 7.88 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 23' ' ' SER . . . . . 0.477 ' O ' HG22 ' X' ' 47' ' ' ILE . 32.4 m -153.35 161.95 41.79 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.605 177.059 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.505 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 15.6 p30 -68.54 136.95 53.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.124 0.487 . . . . 0.0 110.389 174.721 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 25' ' ' GLU . . . . . 0.684 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 38.5 tt0 -61.54 -19.45 62.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.366 -0.833 . . . . 0.0 111.22 -176.166 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -149.69 -64.68 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.677 176.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 27' ' ' GLY . . . . . 0.484 ' HA2' ' OD2' ' X' ' 24' ' ' ASP . . . 179.52 32.9 0.06 OUTLIER Glycine 0 CA--C 1.506 -0.531 0 N-CA-C 110.755 -0.938 . . . . 0.0 110.755 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.754 ' HH2' HG23 ' X' ' 47' ' ' ILE . 40.5 p-90 -96.83 -4.02 41.09 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -172.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.505 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 20.9 tp -59.11 -24.08 62.67 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.746 -0.596 . . . . 0.0 112.058 -170.797 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 30' ' ' THR . . . . . 0.407 ' HA ' ' OE1' ' X' ' 34' ' ' GLN . 6.7 m -95.05 -11.88 27.57 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 121.368 0.604 . . . . 0.0 111.074 174.03 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -95.66 -54.84 3.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.727 -177.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -61.37 -61.04 2.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.105 -177.317 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.631 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 7.8 mp -60.37 -60.75 3.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.254 -172.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 34' ' ' GLN . . . . . 0.407 ' OE1' ' HA ' ' X' ' 30' ' ' THR . 12.2 mp0 -46.45 -43.01 16.21 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -173.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 40.2 p -76.9 -12.17 59.92 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 -176.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -118.69 32.97 5.85 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.624 0.231 . . . . 0.0 111.624 -177.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 45.9 t30 60.37 40.71 17.14 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.43 0.634 . . . . 0.0 110.513 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.631 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 18.1 m-85 55.86 61.03 2.96 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.649 -179.293 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -86.06 118.19 25.37 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.471 -173.254 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.689 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.3 OUTLIER -90.53 -4.34 10.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.37 173.72 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.92 -39.96 93.43 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 120.589 -0.815 . . . . 0.0 111.73 176.394 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.16 -25.86 14.39 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.07 -0.565 . . . . 0.0 111.11 178.154 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.689 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -65.01 -41.81 95.02 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.899 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.746 HD12 HD11 ' X' ' 47' ' ' ILE . 7.1 mp -65.34 -33.73 76.67 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.381 -178.419 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 45' ' ' ASP . . . . . 0.636 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.4 t70 -58.43 -39.34 79.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.018 0.437 . . . . 0.0 110.554 178.053 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 8.8 p -94.83 -6.38 42.96 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -177.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.754 HG23 ' HH2' ' X' ' 28' ' ' TRP . 13.0 pt -100.72 42.93 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 O-C-N 121.703 -0.623 . . . . 0.0 111.382 174.138 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' X' X ' 48' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 0.9 OUTLIER 89.49 -6.93 0.41 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.798 1.239 . . . . 0.0 113.318 173.988 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' X' X ' 49' ' ' TYR . . . . . 0.636 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 6.9 m-85 . . . . . 0 C--N 1.325 -0.475 0 O-C-N 121.944 -0.472 . . . . 0.0 111.59 178.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.512 -0.512 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' X' X ' 7' ' ' ASP . . . . . 0.486 ' O ' HG12 ' X' ' 11' ' ' ILE . 9.0 t70 -108.34 150.22 40.29 Favored Pre-proline 0 C--N 1.316 -0.871 0 CA-C-N 114.15 -1.387 . . . . 0.0 107.416 -177.399 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 8' ' ' PRO . . . . . 0.452 ' HD2' ' CG ' ' X' ' 7' ' ' ASP . 94.8 Cg_exo -42.76 -31.99 2.32 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.906 2.404 . . . . 0.0 113.25 -177.531 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 9' ' ' ARG . . . . . 0.508 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 69.1 mtp180 -78.08 -26.56 48.21 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 178.735 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 10' ' ' LEU . . . . . 0.717 HD22 ' HB2' ' X' ' 14' ' ' LEU . 56.5 mt -97.67 -22.3 16.54 Favored 'General case' 0 C--O 1.221 -0.421 0 C-N-CA 122.283 0.233 . . . . 0.0 110.788 177.706 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.554 ' O ' ' HB3' ' X' ' 15' ' ' SER . 43.5 mm -66.86 -13.86 17.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 108.617 -0.882 . . . . 0.0 108.617 171.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -93.73 -64.19 1.11 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.66 -1.155 . . . . 0.0 111.1 171.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 13' ' ' SER . . . . . 0.527 ' O ' ' HE2' ' X' ' 17' ' ' MET . 15.9 m -86.92 -25.65 24.29 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -168.627 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.717 ' HB2' HD22 ' X' ' 10' ' ' LEU . 60.5 tp -93.37 -43.96 8.52 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.554 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 46.3 t -63.23 -26.75 68.93 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.173 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 19.9 tm0? -57.05 -47.92 79.78 Favored 'General case' 0 N--CA 1.461 0.089 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 174.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.618 ' HB3' ' O ' ' X' ' 22' ' ' PHE . 59.1 mtm -75.79 -43.99 43.59 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.204 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 28.9 tp -57.72 -32.86 67.83 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 123.4 0.437 . . . . 0.0 111.578 -177.57 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 46.8 t -88.07 -30.93 19.53 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.576 -178.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 20' ' ' MET . . . . . 0.451 ' HB3' ' CE1' ' X' ' 22' ' ' PHE . 15.0 tpt -80.6 -31.51 36.69 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -176.319 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.43 24.57 4.37 Favored Glycine 0 CA--C 1.52 0.371 0 C-N-CA 119.976 -1.107 . . . . 0.0 113.939 176.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.618 ' O ' ' HB3' ' X' ' 17' ' ' MET . 0.0 OUTLIER -138.61 167.09 22.7 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 171.136 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 36.6 m -158.59 -91.57 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 119.971 -0.692 . . . . 0.0 111.926 -175.466 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.442 ' CG ' ' H ' ' X' ' 27' ' ' GLY . 56.2 t0 -119.17 122.92 43.11 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.297 -176.22 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 25' ' ' GLU . . . . . 0.799 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 54.8 tt0 -61.44 -29.45 69.95 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.249 176.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 155.84 40.33 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 119.567 -1.301 . . . . 0.0 115.294 173.032 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 27' ' ' GLY . . . . . 0.442 ' H ' ' CG ' ' X' ' 24' ' ' ASP . . . 146.09 -14.81 1.7 Allowed Glycine 0 C--N 1.332 0.342 0 C-N-CA 119.178 -1.487 . . . . 0.0 114.724 171.037 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.871 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 56.8 p-90 -96.2 -14.73 22.51 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 117.81 0.805 . . . . 0.0 113.041 -173.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.44 ' HA ' ' CE3' ' X' ' 28' ' ' TRP . 38.8 tp -54.76 -34.72 62.94 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.864 -0.523 . . . . 0.0 112.392 -170.261 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 30' ' ' THR . . . . . 0.547 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 80.3 p -85.5 -16.45 39.52 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 122.167 -0.333 . . . . 0.0 111.273 177.708 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 13.7 mtm105 -95.37 -52.6 4.09 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.971 0.415 . . . . 0.0 111.216 -176.262 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -52.07 -70.34 0.09 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.241 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.584 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 7.0 mp -58.43 -45.51 88.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.992 -175.425 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 34' ' ' GLN . . . . . 0.547 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.7 OUTLIER -53.23 -38.99 63.44 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -174.231 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 40.5 p -94.37 -2.34 52.23 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.837 0.351 . . . . 0.0 111.938 -177.077 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -118.29 38.05 3.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.9 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 41.64 45.12 2.86 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.744 0.817 . . . . 0.0 111.928 -176.073 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.584 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 53.1 m-85 60.05 78.01 0.29 Allowed 'General case' 0 C--O 1.233 0.209 0 CA-C-N 114.873 -1.058 . . . . 0.0 111.382 178.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -97.86 120.96 39.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.704 -177.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.529 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.12 -19.96 7.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 172.029 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.18 -46.37 91.15 Favored Glycine 0 N--CA 1.441 -0.973 0 C-N-CA 120.493 -0.86 . . . . 0.0 112.277 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -83.81 -22.05 31.91 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.475 -0.362 . . . . 0.0 111.002 178.08 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.711 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -68.91 -47.4 65.9 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.944 178.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.529 HD13 ' O ' ' X' ' 40' ' ' ILE . 10.8 mp -67.36 -29.12 68.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.03 -179.417 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -65.13 -28.45 69.43 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 121.284 0.564 . . . . 0.0 110.897 178.521 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 7.6 p -96.08 -32.69 12.41 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -175.118 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.871 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 0.9 OUTLIER -83.36 -29.43 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -173.137 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' X' X ' 48' ' ' GLN . . . . . 0.565 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.3 mt-30 -164.04 -35.9 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 -177.716 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' X' X ' 49' ' ' TYR . . . . . 0.513 ' CE2' ' HE2' ' X' ' 22' ' ' PHE . 37.4 m-85 . . . . . 0 C--N 1.323 -0.551 0 CA-C-O 120.809 0.338 . . . . 0.0 110.707 -177.06 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.51 -0.577 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -106.94 142.19 24.47 Favored Pre-proline 0 C--N 1.314 -0.955 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 -179.097 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -44.96 -20.88 0.43 Allowed 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.152 2.568 . . . . 0.0 113.325 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 87.8 mtm-85 -92.56 -37.73 12.31 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 122.901 0.48 . . . . 0.0 112.11 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 10' ' ' LEU . . . . . 0.738 HD23 ' HB2' ' X' ' 13' ' ' SER . 36.7 mt -98.84 -10.66 22.63 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -175.814 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.698 ' O ' ' HB2' ' X' ' 15' ' ' SER . 12.6 tt -68.1 -21.91 27.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 175.731 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -95.62 -26.22 15.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.847 170.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 13' ' ' SER . . . . . 0.738 ' HB2' HD23 ' X' ' 10' ' ' LEU . 20.3 m -96.65 -48.51 5.48 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -171.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.538 ' HB2' HD22 ' X' ' 10' ' ' LEU . 2.4 tm? -93.11 -44.13 8.52 Favored 'General case' 0 CA--C 1.507 -0.709 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 -179.508 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.698 ' HB2' ' O ' ' X' ' 11' ' ' ILE . 18.9 m -64.67 -17.83 64.42 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.277 -176.541 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.28 -28.44 47.6 Favored 'General case' 0 N--CA 1.461 0.117 0 C-N-CA 120.557 -0.457 . . . . 0.0 111.091 177.288 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 17' ' ' MET . . . . . 1.046 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 23.0 ptp -94.16 -26.53 16.65 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.588 178.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 36.8 tp -57.46 -40.18 77.94 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.459 -179.329 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 25.6 m -70.8 -37.76 73.28 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -177.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -84.66 -26.24 27.93 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 111.895 0.331 . . . . 0.0 111.895 -174.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.69 46.15 0.86 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.318 -0.944 . . . . 0.0 112.277 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 1.046 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 6.5 m-85 -127.36 146.46 50.45 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 175.355 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 58.6 m -151.51 -116.89 0.04 OUTLIER 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.784 -175.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.681 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.4 p30 -122.47 142.89 50.09 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.182 172.561 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 25' ' ' GLU . . . . . 0.762 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 29.5 tt0 -67.58 -50.61 57.53 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.582 0.706 . . . . 0.0 110.054 177.225 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -133.77 -3.61 3.25 Favored Glycine 0 C--N 1.319 -0.372 0 CA-C-N 114.978 -1.01 . . . . 0.0 112.855 -178.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.05 12.16 3.66 Favored Glycine 0 C--N 1.33 0.205 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.739 178.19 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.774 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 28.2 p-90 -80.35 -6.96 58.82 Favored 'General case' 0 C--O 1.22 -0.453 0 N-CA-C 111.998 0.369 . . . . 0.0 111.998 -178.833 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.681 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 15.0 tp -56.6 -32.37 65.19 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.934 0.397 . . . . 0.0 111.627 -173.74 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 30' ' ' THR . . . . . 0.497 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 35.1 p -82.3 -19.97 38.38 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.341 176.43 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 31' ' ' ARG . . . . . 0.602 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 8.8 mtm180 -95.24 -57.03 2.53 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.694 -175.113 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -51.35 -62.35 1.67 Allowed 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.608 0.763 . . . . 0.0 111.157 -177.209 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.841 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 7.3 mp -60.62 -45.48 93.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.243 -176.558 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 34' ' ' GLN . . . . . 0.497 ' HB2' ' O ' ' X' ' 30' ' ' THR . 33.8 tp60 -39.15 -61.21 0.79 Allowed 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -175.489 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 26.7 p -85.3 -2.82 58.49 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -174.416 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -108.3 28.73 8.03 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 122.202 -0.311 . . . . 0.0 111.274 177.761 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 48.0 t30 60.31 42.7 14.57 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.09 0.471 . . . . 0.0 110.866 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.841 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 89.4 m-85 53.55 58.61 5.01 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.562 0.696 . . . . 0.0 110.177 -178.067 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -77.01 117.1 18.26 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.448 -1.251 . . . . 0.0 111.428 -172.455 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.634 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.78 -5.11 10.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.109 0.481 . . . . 0.0 110.291 170.958 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -80.28 -36.48 23.91 Favored Glycine 0 N--CA 1.439 -1.117 0 C-N-CA 120.476 -0.869 . . . . 0.0 111.52 178.119 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.56 -20.49 18.96 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.182 -0.509 . . . . 0.0 111.273 178.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.659 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -65.27 -45.01 86.19 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.019 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.634 HD13 ' O ' ' X' ' 40' ' ' ILE . 11.0 mp -66.26 -29.34 69.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.644 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -63.66 -29.5 70.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.281 176.612 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 3.6 p -98.04 -16.16 19.73 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -175.153 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.774 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 0.4 OUTLIER -94.06 -30.61 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 119.431 -0.908 . . . . 0.0 113.17 -176.292 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' X' X ' 48' ' ' GLN . . . . . 0.463 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.7 mp0 -161.22 -42.58 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.968 0.413 . . . . 0.0 110.966 -178.799 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' X' X ' 49' ' ' TYR . . . . . 0.432 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 60.0 m-85 . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.639 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.322 0 CA-C-O 121.434 0.635 . . . . 0.0 109.457 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' X' X ' 7' ' ' ASP . . . . . 0.534 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 28.9 t70 -81.7 147.22 58.42 Favored Pre-proline 0 C--N 1.318 -0.771 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 176.535 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' X' X ' 8' ' ' PRO . . . . . 0.534 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 83.9 Cg_exo -47.06 -24.92 3.68 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.07 1.847 . . . . 0.0 112.849 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 77.8 mtm-85 -94.17 -28.46 15.64 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' X' X ' 10' ' ' LEU . . . . . 0.501 HD22 ' HB2' ' X' ' 14' ' ' LEU . 50.2 mt -97.95 -16.97 19.48 Favored 'General case' 0 CA--C 1.514 -0.42 0 O-C-N 122.14 -0.35 . . . . 0.0 111.284 -177.175 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.536 ' HA ' ' HB2' ' X' ' 15' ' ' SER . 14.2 tt -73.02 -8.77 12.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 172.492 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' X' X ' 12' ' ' GLU . . . . . 0.546 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 45.8 mt-10 -93.65 -62.61 1.33 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.637 -1.165 . . . . 0.0 110.754 173.318 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 11.0 m -90.05 -27.93 19.38 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -168.363 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.501 ' HB2' HD22 ' X' ' 10' ' ' LEU . 9.5 tt -94.28 -44.39 7.97 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.536 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 12.9 t -66.71 -18.95 65.64 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.125 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' X' X ' 16' ' ' GLN . . . . . 0.546 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 18.8 tm0? -64.03 -44.27 93.03 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 175.239 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.614 ' SD ' HD13 ' X' ' 29' ' ' LEU . 62.1 mtt -69.86 -38.35 76.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.606 178.139 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' X' X ' 18' ' ' LEU . . . . . 0.437 ' HB2' ' HA ' ' X' ' 15' ' ' SER . 7.9 mp -62.12 -32.5 73.08 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.499 178.233 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 37.2 t -80.6 -44.35 19.08 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.331 -178.012 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 26.2 mmt -78.66 -32.21 47.07 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -175.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.6 46.86 0.82 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.363 -0.922 . . . . 0.0 112.124 -178.445 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -128.52 162.97 25.98 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 177.418 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 44.8 m -139.78 -143.25 0.16 Allowed 'General case' 0 C--N 1.315 -0.91 0 C-N-CA 120.576 -0.45 . . . . 0.0 109.789 178.33 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.715 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 21.8 p-10 -99.72 128.23 45.82 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.94 0.4 . . . . 0.0 110.272 173.395 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' X' X ' 25' ' ' GLU . . . . . 0.816 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 42.9 tp10 -83.71 56.99 3.86 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.751 0.786 . . . . 0.0 109.223 176.229 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 133.31 -87.33 0.27 Allowed Glycine 0 N--CA 1.446 -0.686 0 CA-C-N 114.827 -1.079 . . . . 0.0 111.476 -174.416 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -172.27 29.28 0.11 Allowed Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 121.041 -0.599 . . . . 0.0 111.741 177.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.824 ' HH2' HG23 ' X' ' 47' ' ' ILE . 53.3 p-90 -95.92 -9.66 30.74 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 -176.878 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.715 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 10.6 tp -59.69 -19.96 53.15 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 121.826 -0.546 . . . . 0.0 110.761 -175.663 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' X' X ' 30' ' ' THR . . . . . 0.649 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 38.7 p -93.83 -48.03 6.48 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 121.993 -0.442 . . . . 0.0 110.624 169.79 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 42.7 mmm-85 -63.71 -61.22 2.45 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.287 -176.367 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' X' X ' 32' ' ' LEU . . . . . 0.645 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 2.0 tm? -50.33 -52.38 37.31 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.84 -178.276 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.424 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 62.3 mt -61.06 -62.01 2.16 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.305 -179.514 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' X' X ' 34' ' ' GLN . . . . . 0.649 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.0 OUTLIER -42.8 -54.69 4.0 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -175.966 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 29.6 p -68.39 -24.74 64.81 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -175.089 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 61.0 mttm -105.19 37.4 2.2 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.978 178.519 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 42.05 41.86 2.16 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.715 0.806 . . . . 0.0 112.841 -178.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.424 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 74.3 m-85 65.96 66.22 0.5 Allowed 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.033 177.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -104.25 120.18 40.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.257 -179.238 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.765 ' HB ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.26 -3.6 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.155 173.719 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.8 -41.01 97.76 Favored Glycine 0 N--CA 1.443 -0.878 0 C-N-CA 120.402 -0.904 . . . . 0.0 111.961 177.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.99 -20.27 16.84 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.156 -0.522 . . . . 0.0 111.18 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.698 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -74.33 -31.71 62.54 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.011 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.765 HD13 ' HB ' ' X' ' 40' ' ' ILE . 6.5 mp -75.43 -19.15 59.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.199 179.428 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' X' X ' 45' ' ' ASP . . . . . 0.544 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.5 t70 -70.33 -27.14 64.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.87 0.367 . . . . 0.0 110.502 177.287 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 17.9 p -95.83 -23.44 16.92 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.824 HG23 ' HH2' ' X' ' 28' ' ' TRP . 2.4 pp -84.09 42.55 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 178.336 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 84.67 7.55 0.5 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.164 0.985 . . . . 0.0 112.801 172.552 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' X' X ' 49' ' ' TYR . . . . . 0.544 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 15.9 m-85 . . . . . 0 C--N 1.325 -0.473 0 CA-C-O 121.082 0.468 . . . . 0.0 110.944 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.293 0 CA-C-O 121.821 0.82 . . . . 0.0 108.868 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -78.36 147.3 72.05 Favored Pre-proline 0 C--O 1.216 -0.678 0 CA-C-N 114.462 -1.245 . . . . 0.0 108.17 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -44.99 -23.14 0.85 Allowed 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 122.728 2.285 . . . . 0.0 113.272 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' X' X ' 9' ' ' ARG . . . . . 0.646 ' HD2' ' CE2' ' X' ' 38' ' ' TYR . 78.3 mtm180 -93.2 -33.93 13.8 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.996 -0.547 . . . . 0.0 112.315 -179.583 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' X' X ' 10' ' ' LEU . . . . . 0.493 HD22 ' HB2' ' X' ' 14' ' ' LEU . 83.8 mt -97.82 -19.02 18.41 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 122.212 -0.305 . . . . 0.0 111.019 -176.862 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.421 ' O ' HD13 ' X' ' 11' ' ' ILE . 0.3 OUTLIER -75.54 -9.9 13.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 170.826 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -96.44 -58.28 2.1 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.549 171.079 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' X' X ' 13' ' ' SER . . . . . 0.426 ' HA ' HG23 ' X' ' 40' ' ' ILE . 45.9 t -96.35 -24.9 15.95 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 -167.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.493 ' HB2' HD22 ' X' ' 10' ' ' LEU . 9.8 tt -95.77 -43.87 7.68 Favored 'General case' 0 CA--C 1.508 -0.659 0 CA-C-N 118.997 0.817 . . . . 0.0 109.823 -176.566 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.601 ' HA ' ' HB3' ' X' ' 18' ' ' LEU . 61.4 p -74.91 -9.78 58.87 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.968 -178.476 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 5.1 tm0? -57.45 -60.54 3.5 Favored 'General case' 0 C--N 1.339 0.111 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 174.519 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.843 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 0.6 OUTLIER -73.77 -29.08 61.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.654 178.614 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' X' X ' 18' ' ' LEU . . . . . 0.601 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 26.4 tp -61.77 -30.97 71.15 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.504 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 23.1 t -97.42 -34.18 11.13 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 120.586 0.231 . . . . 0.0 111.254 -177.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 81.1 mtp -79.61 -12.88 59.82 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -176.373 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.68 42.1 3.21 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.272 -0.966 . . . . 0.0 113.264 176.378 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.843 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 46.0 m-85 -129.16 161.13 30.81 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 174.448 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 55.0 m -139.77 -177.83 5.14 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.707 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.568 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 6.2 p-10 -77.12 115.85 17.26 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.293 0.568 . . . . 0.0 109.983 175.347 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -86.11 59.68 5.78 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.117 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.73 -4.68 2.21 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.27 -0.967 . . . . 0.0 113.189 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' X' X ' 27' ' ' GLY . . . . . 0.404 ' HA2' ' OD2' ' X' ' 24' ' ' ASP . . . 86.09 21.04 53.95 Favored Glycine 0 N--CA 1.445 -0.744 0 C-N-CA 120.44 -0.886 . . . . 0.0 111.546 -177.834 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.615 ' HH2' HG23 ' X' ' 47' ' ' ILE . 46.2 p-90 -84.85 -10.74 56.84 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-O 119.625 -0.226 . . . . 0.0 111.432 -179.309 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.568 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 48.5 tp -59.01 -28.27 66.24 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.896 -0.503 . . . . 0.0 111.785 -170.028 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 28.9 m -94.37 -11.08 30.66 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 120.948 0.404 . . . . 0.0 111.118 174.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' X' X ' 31' ' ' ARG . . . . . 0.553 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 5.0 mtp-105 -96.04 -53.12 3.77 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.148 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 8.8 tp -64.85 -77.54 0.06 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.867 0.692 . . . . 0.0 112.867 -172.126 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.754 ' HA ' ' HB2' ' X' ' 36' ' ' LYS . 1.6 pp -69.4 -16.93 63.61 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -171.278 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' X' X ' 34' ' ' GLN . . . . . 0.456 ' N ' HD12 ' X' ' 33' ' ' LEU . 25.9 tp60 -64.33 -33.75 76.57 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.5 0.191 . . . . 0.0 110.98 178.156 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 78.1 p -95.69 -16.88 21.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.972 0.415 . . . . 0.0 110.383 175.703 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' X' X ' 36' ' ' LYS . . . . . 0.754 ' HB2' ' HA ' ' X' ' 33' ' ' LEU . 43.9 mttp -87.81 38.71 0.85 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.603 177.929 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 43.73 40.08 2.85 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.842 0.857 . . . . 0.0 112.953 -178.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.646 ' CE2' ' HD2' ' X' ' 9' ' ' ARG . 72.8 m-85 58.74 71.35 0.59 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.713 173.368 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -125.59 142.43 51.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.736 0.779 . . . . 0.0 112.705 -179.168 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.806 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.1 OUTLIER -91.39 -3.98 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.27 173.594 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.12 -42.96 97.85 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.967 -178.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -94.17 -23.73 17.8 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.272 -0.464 . . . . 0.0 110.549 175.637 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.806 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -66.53 -32.57 74.0 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.093 178.355 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.608 HD12 HD11 ' X' ' 47' ' ' ILE . 3.3 tp -66.24 -35.87 81.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.236 0.541 . . . . 0.0 110.616 -179.513 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' X' X ' 45' ' ' ASP . . . . . 0.546 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 18.9 t70 -69.1 -34.27 74.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.019 178.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 44.9 p -91.63 -24.31 19.58 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -174.618 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.615 HG23 ' HH2' ' X' ' 28' ' ' TRP . 5.7 pt -72.19 -26.14 24.49 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 119.886 -0.726 . . . . 0.0 111.504 -176.444 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -173.94 -45.37 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 O-C-N 123.12 0.262 . . . . 0.0 111.081 178.679 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' X' X ' 49' ' ' TYR . . . . . 0.546 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 51.9 m-85 . . . . . 0 C--N 1.327 -0.377 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -173.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.397 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' X' X ' 7' ' ' ASP . . . . . 0.552 ' HB2' ' H ' ' X' ' 10' ' ' LEU . 2.9 m-20 -71.26 156.05 92.23 Favored Pre-proline 0 CA--C 1.505 -0.77 0 CA-C-N 114.895 -1.048 . . . . 0.0 108.622 178.791 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -58.44 -12.26 13.27 Favored 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 121.084 1.189 . . . . 0.0 110.489 169.102 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 37.3 mtp85 -93.34 -43.04 8.98 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 114.784 -1.098 . . . . 0.0 111.551 174.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' X' X ' 10' ' ' LEU . . . . . 0.625 HD22 ' HB2' ' X' ' 14' ' ' LEU . 32.0 mt -88.13 -21.94 24.37 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -173.709 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.492 ' O ' ' HB3' ' X' ' 15' ' ' SER . 15.1 tt -69.52 -17.12 21.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 172.528 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 50.9 mm-40 -95.05 -64.95 1.01 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.684 173.114 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 13.2 m -81.6 -26.55 34.8 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -169.139 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.625 ' HB2' HD22 ' X' ' 10' ' ' LEU . 0.2 OUTLIER -94.98 -49.32 5.6 Favored 'General case' 0 CA--C 1.506 -0.741 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 -179.823 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.492 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 21.9 t -62.59 -27.03 68.91 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.521 -176.639 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' X' X ' 16' ' ' GLN . . . . . 0.408 ' O ' ' HB2' ' X' ' 20' ' ' MET . 4.7 tm0? -51.14 -49.24 61.23 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 120.938 0.399 . . . . 0.0 110.662 176.343 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.798 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 10.5 ptm -97.96 -31.45 12.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.828 -176.186 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 29.2 tp -64.35 -31.94 73.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.822 0.344 . . . . 0.0 111.071 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 15.8 m -98.73 -7.52 27.56 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.443 -178.331 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' X' X ' 20' ' ' MET . . . . . 0.432 ' HA ' ' CE ' ' X' ' 20' ' ' MET . 0.1 OUTLIER -92.63 -31.66 15.06 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.841 0.353 . . . . 0.0 110.808 -179.122 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.58 31.49 2.14 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.671 -0.776 . . . . 0.0 111.826 -176.318 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.798 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 20.4 m-30 -116.46 155.97 27.66 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 175.362 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -140.04 -159.43 0.96 Allowed 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 120.101 -0.639 . . . . 0.0 110.261 -179.137 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.997 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 18.8 p-10 -85.93 114.73 23.07 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.396 0.617 . . . . 0.0 109.542 172.164 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' X' X ' 25' ' ' GLU . . . . . 0.516 ' HB2' ' HE1' ' X' ' 28' ' ' TRP . 5.7 mm-40 -84.01 54.42 2.92 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.571 -178.344 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 139.77 -17.23 3.03 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.405 -177.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 111.65 7.69 23.65 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.173 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.761 ' HH2' HG23 ' X' ' 47' ' ' ILE . 51.7 p-90 -83.55 -22.26 32.45 Favored 'General case' 0 C--O 1.208 -1.112 0 CA-C-O 119.087 -0.483 . . . . 0.0 111.992 -178.285 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.997 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 11.6 tp -50.13 -34.67 22.97 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 118.898 0.772 . . . . 0.0 111.577 -174.73 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.53 -30.24 52.71 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 175.597 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 16.4 mtp180 -92.36 -55.52 3.38 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -175.579 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' X' X ' 32' ' ' LEU . . . . . 0.453 ' HB3' HD12 ' X' ' 33' ' ' LEU . 2.8 tm? -43.15 -59.89 1.88 Allowed 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.29 1.036 . . . . 0.0 111.996 -178.267 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.782 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.8 mp -70.58 -36.67 73.72 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.569 -174.377 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 32.7 tp60 -52.63 -46.74 67.22 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -173.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 22.5 p -77.76 -12.09 59.94 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.801 0.334 . . . . 0.0 111.694 -178.007 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 50.1 mttp -112.51 37.66 2.99 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.114 -178.22 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 41.62 39.77 1.22 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.628 0.771 . . . . 0.0 112.172 -177.316 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.782 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 31.2 m-85 66.94 77.76 0.27 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.907 -179.329 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -106.19 126.7 52.54 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.675 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.585 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -90.22 -12.97 9.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 120.932 0.396 . . . . 0.0 110.201 172.208 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -60.22 -41.13 98.13 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.631 179.154 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.87 -17.43 21.11 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.751 0.31 . . . . 0.0 111.085 177.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.585 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -69.97 -42.97 72.43 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.658 177.207 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.739 HD12 HD11 ' X' ' 47' ' ' ILE . 8.9 mp -62.47 -27.34 69.06 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.085 -178.391 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' X' X ' 45' ' ' ASP . . . . . 0.481 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 33.5 t70 -55.13 -39.6 69.61 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.814 0.34 . . . . 0.0 111.709 179.026 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 1.1 p -95.99 -24.48 16.35 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 -177.273 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.761 HG23 ' HH2' ' X' ' 28' ' ' TRP . 8.3 pt -82.78 44.66 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 178.586 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 82.68 25.5 0.15 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.135 0.974 . . . . 0.0 113.14 171.635 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' X' X ' 49' ' ' TYR . . . . . 0.481 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 66.2 m-85 . . . . . 0 N--CA 1.468 0.455 0 N-CA-C 110.34 -0.244 . . . . 0.0 110.34 174.098 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.516 -0.344 0 CA-C-O 121.11 0.481 . . . . 0.0 109.706 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' X' X ' 7' ' ' ASP . . . . . 0.502 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 0.3 OUTLIER -67.35 152.86 95.75 Favored Pre-proline 0 CA--C 1.512 -0.505 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.026 177.248 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' X' X ' 8' ' ' PRO . . . . . 0.502 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 23.6 Cg_endo -59.45 -13.17 19.6 Favored 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 121.452 1.435 . . . . 0.0 110.574 171.486 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' X' X ' 9' ' ' ARG . . . . . 0.419 ' H ' ' HB3' ' X' ' 7' ' ' ASP . 36.5 mmt180 -93.78 -50.0 5.57 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.424 -1.262 . . . . 0.0 111.823 175.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' X' X ' 10' ' ' LEU . . . . . 0.791 HD22 ' HB2' ' X' ' 14' ' ' LEU . 89.5 mt -94.68 -17.02 22.62 Favored 'General case' 0 C--O 1.217 -0.608 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -169.779 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.521 ' O ' ' HB2' ' X' ' 15' ' ' SER . 0.2 OUTLIER -65.91 -25.23 35.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 175.471 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -94.87 -42.58 8.62 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.508 174.274 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' X' X ' 13' ' ' SER . . . . . 0.478 ' HA ' HG23 ' X' ' 40' ' ' ILE . 4.0 t -94.97 -36.98 11.36 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 -166.807 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.791 ' HB2' HD22 ' X' ' 10' ' ' LEU . 8.4 tt -94.63 -42.82 8.59 Favored 'General case' 0 CA--C 1.51 -0.558 0 CA-C-O 121.51 0.671 . . . . 0.0 109.209 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.549 ' HA ' ' HB3' ' X' ' 18' ' ' LEU . 46.3 m -64.8 -17.27 64.07 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.123 -179.299 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -58.46 -63.04 1.42 Allowed 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.116 175.705 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.861 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 0.9 OUTLIER -76.13 -25.24 55.15 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.799 -0.361 . . . . 0.0 111.172 179.884 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' X' X ' 18' ' ' LEU . . . . . 0.549 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 37.2 tp -61.54 -34.8 76.18 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.817 0.342 . . . . 0.0 110.865 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 29.9 p -89.07 -42.21 11.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.574 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 91.4 mmm -66.53 -32.81 74.4 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -176.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 109.83 46.37 0.9 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.218 -0.991 . . . . 0.0 111.931 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.861 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 95.4 m-85 -130.63 172.21 12.2 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 175.679 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' X' X ' 23' ' ' SER . . . . . 0.419 ' O ' HG22 ' X' ' 47' ' ' ILE . 50.2 m -155.27 -173.86 4.73 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.571 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 30.7 p30 -83.39 154.11 24.19 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.939 0.4 . . . . 0.0 110.125 172.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' X' X ' 25' ' ' GLU . . . . . 0.505 ' HG2' ' CD1' ' X' ' 28' ' ' TRP . 7.5 pt-20 -82.59 -7.41 59.65 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.197 -174.908 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -170.66 -28.91 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.713 -178.817 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' X' X ' 27' ' ' GLY . . . . . 0.455 ' HA2' ' OD2' ' X' ' 24' ' ' ASP . . . 148.39 31.09 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 119.983 -1.103 . . . . 0.0 112.937 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.848 ' HH2' HG23 ' X' ' 47' ' ' ILE . 40.4 p-90 -96.17 -13.89 23.19 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 178.865 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.576 HD21 ' HG ' ' X' ' 14' ' ' LEU . 30.4 tp -58.11 -15.2 8.65 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 122.019 -0.426 . . . . 0.0 111.584 -174.769 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 82.7 p -94.46 -56.35 2.84 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 121.823 -0.548 . . . . 0.0 110.614 169.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' X' X ' 31' ' ' ARG . . . . . 0.689 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -69.72 -51.4 34.65 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -174.761 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' X' X ' 32' ' ' LEU . . . . . 0.845 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 3.4 tm? -51.05 -54.79 21.61 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.582 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.757 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 10.8 mp -54.95 -60.12 3.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.825 177.017 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 22.8 tp60 -40.0 -48.98 2.49 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.868 0.73 . . . . 0.0 112.556 -179.693 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 7.6 m -59.57 -51.28 70.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.022 -0.536 . . . . 0.0 112.017 -174.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.57 37.4 1.2 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 40.2 t30 61.98 61.01 1.43 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.4 176.051 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.757 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 81.0 m-85 43.9 52.86 6.5 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.351 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -82.37 130.74 35.17 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.46 -173.159 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.579 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.69 -12.2 9.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.058 169.688 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.51 -41.73 83.62 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.457 -0.877 . . . . 0.0 112.135 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -91.31 -19.57 22.82 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.339 -0.431 . . . . 0.0 110.943 177.567 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.531 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -71.58 -39.69 70.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.789 178.555 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.727 ' HA ' HG12 ' X' ' 47' ' ' ILE . 7.0 mp -65.55 -37.09 85.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.886 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -54.14 -35.92 62.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.233 176.189 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 7.4 p -96.25 -22.12 17.44 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -177.845 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.848 HG23 ' HH2' ' X' ' 28' ' ' TRP . 28.0 pt -83.97 42.78 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.8 -0.562 . . . . 0.0 111.715 176.982 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 72.85 20.46 3.59 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.405 0.682 . . . . 0.0 112.094 174.377 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' X' X ' 49' ' ' TYR . . . . . 0.497 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 9.7 m-30 . . . . . 0 C--N 1.328 -0.369 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 173.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.442 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' X' X ' 7' ' ' ASP . . . . . 0.545 ' O ' HG12 ' X' ' 11' ' ' ILE . 23.6 t70 -80.27 154.54 74.55 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 113.35 -1.75 . . . . 0.0 107.901 178.359 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' X' X ' 8' ' ' PRO . . . . . 0.457 ' HD2' ' CG ' ' X' ' 7' ' ' ASP . 68.8 Cg_exo -49.31 -21.66 4.9 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 121.98 1.787 . . . . 0.0 112.461 177.693 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' X' X ' 9' ' ' ARG . . . . . 0.44 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 34.6 mmt180 -87.27 -26.62 23.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.35 177.31 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' X' X ' 10' ' ' LEU . . . . . 0.464 HD12 ' HB2' ' X' ' 14' ' ' LEU . 4.4 mm? -98.01 -33.39 11.21 Favored 'General case' 0 C--O 1.222 -0.38 0 O-C-N 122.292 -0.255 . . . . 0.0 110.75 -175.653 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.545 HG12 ' O ' ' X' ' 7' ' ' ASP . 18.1 pt -68.97 -12.53 16.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 170.287 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -96.56 -66.49 0.9 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.148 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' X' X ' 13' ' ' SER . . . . . 0.472 ' OG ' HG23 ' X' ' 40' ' ' ILE . 34.6 t -83.77 -23.23 31.62 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -170.163 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.464 ' HB2' HD12 ' X' ' 10' ' ' LEU . 2.6 tm? -92.51 -42.53 9.66 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 177.684 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.527 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 43.9 t -62.75 -24.93 67.95 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.209 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 19.7 tm0? -55.17 -43.57 74.41 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.908 0.385 . . . . 0.0 110.551 176.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.651 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 9.5 ptm -96.66 -27.78 14.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.545 -178.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' X' X ' 18' ' ' LEU . . . . . 0.479 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 35.6 tp -64.22 -40.5 96.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.942 0.401 . . . . 0.0 110.815 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 19.0 m -91.72 -4.51 54.99 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.71 -176.573 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 16.7 tpt -102.78 -33.24 9.45 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.379 -179.235 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.65 46.52 0.67 Allowed Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.211 -0.995 . . . . 0.0 112.266 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.651 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 47.5 m-85 -125.63 163.62 22.38 Favored 'General case' 0 CA--C 1.507 -0.695 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 175.869 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' X' X ' 23' ' ' SER . . . . . 0.478 ' O ' HG22 ' X' ' 47' ' ' ILE . 41.4 m -145.82 171.09 15.3 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 120.426 -0.51 . . . . 0.0 109.95 -179.561 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.472 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.6 p30 -69.51 134.0 48.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.2 0.524 . . . . 0.0 110.628 177.012 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' X' X ' 25' ' ' GLU . . . . . 0.591 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 33.3 tt0 -87.18 55.54 3.6 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.546 0.688 . . . . 0.0 109.379 177.937 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 136.01 -95.05 0.24 Allowed Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.371 -0.832 . . . . 0.0 111.918 -176.131 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -166.73 29.78 0.19 Allowed Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.991 -0.623 . . . . 0.0 111.673 178.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.629 ' HH2' HG23 ' X' ' 47' ' ' ILE . 53.6 p-90 -92.96 -14.08 27.96 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -176.877 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.472 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 13.8 tp -57.1 -24.52 54.67 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -168.915 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 77.1 p -82.71 -48.56 10.73 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.298 170.708 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 31.8 mtt-85 -60.07 -57.97 10.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.977 -177.502 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -50.28 -51.12 47.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.064 -176.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.46 HD13 ' O ' ' X' ' 29' ' ' LEU . 11.0 mp -62.64 -64.31 0.96 Allowed 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.27 179.554 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -43.42 -43.11 5.06 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -178.463 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 28.0 m -64.65 -52.24 58.4 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -176.119 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' X' X ' 36' ' ' LYS . . . . . 0.631 ' HB2' ' HB2' ' X' ' 39' ' ' ASP . 0.0 OUTLIER -93.38 40.28 1.06 Allowed 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -176.638 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 5.7 p-10 44.29 51.11 7.65 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.324 0.649 . . . . 0.0 111.84 -176.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.44 ' CD2' ' HB3' ' X' ' 9' ' ' ARG . 57.8 m-85 64.37 73.39 0.43 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 114.467 -1.242 . . . . 0.0 111.003 178.147 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' X' X ' 39' ' ' ASP . . . . . 0.631 ' HB2' ' HB2' ' X' ' 36' ' ' LYS . 2.5 t0 -97.35 117.72 32.23 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.045 -0.979 . . . . 0.0 111.127 -176.379 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.586 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.1 -18.38 7.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 121.102 0.477 . . . . 0.0 109.791 171.367 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.18 -34.12 89.08 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.543 179.151 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -100.01 -20.61 15.99 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.729 0.3 . . . . 0.0 111.282 177.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.471 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -72.47 -36.22 68.41 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.45 179.246 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.72 ' HA ' HG12 ' X' ' 47' ' ' ILE . 7.0 mp -63.68 -31.64 72.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.098 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' X' X ' 45' ' ' ASP . . . . . 0.54 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.9 t70 -55.18 -48.71 73.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.949 177.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 3.3 p -85.98 -5.61 59.19 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 -177.235 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.72 HG12 ' HA ' ' X' ' 44' ' ' LEU . 30.1 pt -106.24 43.3 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 O-C-N 121.902 -0.499 . . . . 0.0 111.272 175.151 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' X' X ' 48' ' ' GLN . . . . . 0.415 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 1.1 mp0 85.05 22.86 0.09 Allowed 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.657 1.183 . . . . 0.0 113.308 173.171 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' X' X ' 49' ' ' TYR . . . . . 0.645 ' HE1' ' CZ ' ' X' ' 22' ' ' PHE . 32.2 m-85 . . . . . 0 C--N 1.327 -0.407 0 N-CA-C 110.224 -0.288 . . . . 0.0 110.224 172.413 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 -0.191 0 CA-C-O 121.196 0.522 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -73.14 156.8 89.15 Favored Pre-proline 0 CA--C 1.509 -0.601 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.966 177.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -55.07 -12.76 5.5 Favored 'Trans proline' 0 CA--C 1.536 0.576 0 C-N-CA 121.307 1.338 . . . . 0.0 110.987 169.529 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -90.99 -49.13 6.59 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.01 177.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' X' X ' 10' ' ' LEU . . . . . 0.517 HD22 ' HB2' ' X' ' 14' ' ' LEU . 53.9 mt -97.85 -17.55 19.24 Favored 'General case' 0 C--O 1.22 -0.491 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -173.168 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.608 ' O ' ' HB3' ' X' ' 15' ' ' SER . 0.5 OUTLIER -66.75 -21.33 28.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.876 0.846 . . . . 0.0 108.932 174.083 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -95.15 -45.83 7.04 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.584 175.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 8.1 t -94.05 -36.3 12.18 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -169.399 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.566 HD13 HD21 ' X' ' 29' ' ' LEU . 42.1 tp -92.71 -43.44 9.06 Favored 'General case' 0 CA--C 1.51 -0.582 0 O-C-N 121.682 -0.636 . . . . 0.0 109.791 179.711 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.608 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 33.4 t -61.43 -25.64 67.34 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.818 -175.86 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.01 -30.58 63.87 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 120.584 -0.446 . . . . 0.0 111.21 179.22 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.781 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 23.7 ptp -90.14 -27.86 19.33 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.28 177.819 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 27.7 tp -63.93 -28.59 69.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.795 178.601 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 8.9 p -93.69 -44.21 8.28 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.901 -179.174 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 25.0 mmt -69.99 -24.09 63.26 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -175.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.82 47.39 1.27 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.087 -1.054 . . . . 0.0 112.555 -179.641 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.781 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 47.5 m-85 -127.06 144.5 51.01 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 176.274 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 14.3 m -144.39 169.95 16.95 Favored 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 119.855 -0.738 . . . . 0.0 111.233 -173.373 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.578 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 8.4 p-10 -71.73 131.19 42.76 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.798 173.687 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' X' X ' 25' ' ' GLU . . . . . 0.569 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 16.0 tp10 -69.21 -69.18 0.35 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.718 -177.475 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -97.47 -20.29 22.88 Favored Glycine 0 C--N 1.316 -0.539 0 C-N-CA 120.951 -0.643 . . . . 0.0 113.169 -179.236 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.52 32.67 0.81 Allowed Glycine 0 CA--C 1.507 -0.407 0 C-N-CA 120.537 -0.839 . . . . 0.0 111.211 -176.783 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.637 ' HH2' HG23 ' X' ' 47' ' ' ILE . 23.9 p-90 -96.15 -3.79 43.86 Favored 'General case' 0 C--O 1.217 -0.647 0 CA-C-N 115.173 -0.513 . . . . 0.0 111.452 -176.695 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.777 HD12 HD13 ' X' ' 33' ' ' LEU . 11.0 tp -60.19 -32.26 70.92 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 122.176 -0.328 . . . . 0.0 111.348 -172.955 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' X' X ' 30' ' ' THR . . . . . 0.401 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 4.6 m -79.89 -15.39 57.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.965 0.412 . . . . 0.0 110.821 175.353 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' X' X ' 31' ' ' ARG . . . . . 0.547 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 11.3 mtm180 -96.33 -60.24 1.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.033 0.444 . . . . 0.0 111.168 -178.122 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -49.31 -72.63 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.773 -178.065 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.777 HD13 HD12 ' X' ' 29' ' ' LEU . 6.9 mp -56.75 -45.77 81.82 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.787 -174.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' X' X ' 34' ' ' GLN . . . . . 0.401 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.5 OUTLIER -49.59 -51.76 34.98 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -176.972 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 2.2 m -77.64 -7.44 56.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.073 0.463 . . . . 0.0 111.107 -177.264 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -115.06 37.83 3.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.362 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 11.7 p30 49.74 33.04 5.73 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.02 0.928 . . . . 0.0 112.777 179.127 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.505 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 67.8 m-85 63.83 70.15 0.52 Allowed 'General case' 0 C--O 1.234 0.267 0 C-N-CA 122.955 0.502 . . . . 0.0 110.818 178.196 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 44.7 p-10 -111.42 141.04 45.49 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.683 0.754 . . . . 0.0 112.72 -178.157 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.577 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -92.6 -6.17 10.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.385 170.244 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.21 -44.19 76.83 Favored Glycine 0 CA--C 1.505 -0.565 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.435 -177.053 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.84 -18.49 20.33 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 120.827 0.346 . . . . 0.0 110.831 177.225 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.577 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -71.63 -31.92 67.4 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.778 177.797 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.806 HD12 HD11 ' X' ' 47' ' ' ILE . 6.1 tp -65.14 -31.54 72.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.111 0.481 . . . . 0.0 110.443 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -73.94 -27.55 61.07 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.847 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 22.9 p -97.15 -31.12 12.63 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 -175.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.806 HD11 HD12 ' X' ' 44' ' ' LEU . 2.1 pt -64.63 -26.93 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -171.368 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -167.74 -39.09 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 120.77 0.319 . . . . 0.0 111.077 177.024 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 60.2 m-85 . . . . . 0 C--N 1.327 -0.407 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.94 -177.578 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.512 -0.482 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -102.02 150.03 37.08 Favored Pre-proline 0 C--N 1.317 -0.822 0 CA-C-N 114.191 -1.368 . . . . 0.0 108.127 -176.367 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -45.24 -25.87 2.15 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.33 2.02 . . . . 0.0 113.11 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 50.5 mtp85 -92.95 -35.0 13.54 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 178.728 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 97.1 mt -88.28 -18.03 29.43 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 116.8 -0.182 . . . . 0.0 110.81 -177.365 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.481 ' HA ' ' HB2' ' X' ' 15' ' ' SER . 0.4 OUTLIER -63.83 -26.04 39.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.639 0.733 . . . . 0.0 109.272 171.318 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' X' X ' 12' ' ' GLU . . . . . 0.555 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 5.3 mm-40 -85.81 -45.24 11.77 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.368 176.596 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' X' X ' 13' ' ' SER . . . . . 0.579 ' HB2' HD23 ' X' ' 33' ' ' LEU . 11.2 p -96.09 -43.14 7.9 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 113.858 1.058 . . . . 0.0 113.858 -169.44 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.592 ' HG ' HD11 ' X' ' 29' ' ' LEU . 2.9 tt -93.09 -45.44 7.9 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -176.224 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.481 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 33.1 m -68.5 -14.56 63.09 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.414 179.532 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' X' X ' 16' ' ' GLN . . . . . 0.555 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 1.0 OUTLIER -62.3 -65.95 0.61 Allowed 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 171.106 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.488 ' CB ' ' HB2' ' X' ' 22' ' ' PHE . 70.5 mtm -62.71 -39.46 94.08 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.874 -179.051 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 30.0 tp -61.09 -34.4 74.87 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -177.087 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 27.8 t -94.99 -8.44 36.9 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.602 0.239 . . . . 0.0 111.563 -177.248 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 50.5 tpp -101.74 -31.81 10.6 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.495 -178.527 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.26 34.31 1.64 Allowed Glycine 0 CA--C 1.511 -0.214 0 C-N-CA 120.581 -0.818 . . . . 0.0 111.501 -177.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.508 ' HB3' HD12 ' X' ' 47' ' ' ILE . 4.5 m-85 -121.76 138.77 54.23 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 176.415 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 68.8 m -134.83 -128.15 0.16 Allowed 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.687 -176.268 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.589 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.6 p30 -120.98 136.96 54.86 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.751 173.124 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' X' X ' 25' ' ' GLU . . . . . 0.413 ' HB2' ' HE1' ' X' ' 28' ' ' TRP . 23.2 tt0 -68.46 -38.49 81.13 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.002 0.429 . . . . 0.0 110.385 -177.557 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -144.15 -0.14 1.07 Allowed Glycine 0 CA--C 1.519 0.33 0 C-N-CA 120.739 -0.743 . . . . 0.0 113.57 -178.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 123.09 28.67 1.33 Allowed Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.253 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.812 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 32.9 p-90 -96.53 -8.76 31.16 Favored 'General case' 0 C--O 1.218 -0.597 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -178.523 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.592 HD11 ' HG ' ' X' ' 14' ' ' LEU . 20.3 tp -65.48 -17.39 64.52 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.069 0.461 . . . . 0.0 110.342 -176.124 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -93.8 -16.34 24.23 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.799 172.052 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' X' X ' 31' ' ' ARG . . . . . 0.428 ' HD3' ' HA ' ' X' ' 28' ' ' TRP . 19.8 mtp85 -97.33 -66.07 0.92 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.213 0.53 . . . . 0.0 112.106 -177.729 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -46.92 -73.47 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 114.093 -1.412 . . . . 0.0 112.682 -172.135 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.678 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.8 mp -50.49 -51.94 42.74 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-O 121.027 0.441 . . . . 0.0 111.346 -174.697 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 15.0 mp0 -50.67 -38.55 47.19 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.69 -178.391 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 5.3 m -86.46 -6.77 58.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.986 0.422 . . . . 0.0 110.993 -177.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -125.41 38.83 4.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.891 -177.485 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 56.91 22.45 7.15 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.247 1.019 . . . . 0.0 113.061 178.917 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.678 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 15.1 m-85 72.34 73.25 0.15 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.608 0.763 . . . . 0.0 110.11 177.777 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 45.4 p-10 -115.11 142.92 45.99 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.558 0.694 . . . . 0.0 112.581 -177.32 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.612 ' H ' HD13 ' X' ' 40' ' ' ILE . 0.1 OUTLIER -91.54 -19.5 7.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.082 173.09 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.12 -39.42 97.61 Favored Glycine 0 CA--C 1.506 -0.526 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.598 -177.262 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' X' X ' 42' ' ' ALA . . . . . 0.446 ' O ' ' HB3' ' X' ' 45' ' ' ASP . . . -96.39 -10.36 27.8 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.47 -0.365 . . . . 0.0 110.642 176.627 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.527 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -73.69 -47.4 39.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.039 178.11 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' X' X ' 44' ' ' LEU . . . . . . . . . . . . . 10.7 mp -58.81 -33.55 70.5 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.72 0.295 . . . . 0.0 110.616 177.405 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' X' X ' 45' ' ' ASP . . . . . 0.446 ' HB3' ' O ' ' X' ' 42' ' ' ALA . 15.4 t0 -55.19 -45.78 75.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.197 175.739 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 1.2 p -86.13 -6.04 59.09 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 114.187 1.18 . . . . 0.0 114.187 -171.317 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.812 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 0.1 OUTLIER -109.58 -26.78 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-N 119.371 0.987 . . . . 0.0 112.893 178.685 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' X' X ' 48' ' ' GLN . . . . . 0.479 ' OE1' ' HB ' ' X' ' 47' ' ' ILE . 0.0 OUTLIER -155.59 -44.75 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.83 0.347 . . . . 0.0 111.54 -176.747 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 . . . . . 0 C--N 1.326 -0.413 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.29 -174.664 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.426 0 CA-C-O 121.498 0.666 . . . . 0.0 109.227 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' X' X ' 7' ' ' ASP . . . . . 0.516 ' H ' ' HB2' ' X' ' 10' ' ' LEU . 0.3 OUTLIER -85.83 155.48 58.6 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-N 114.823 -1.081 . . . . 0.0 109.24 -178.924 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.65 -14.31 30.63 Favored 'Trans proline' 0 CA--C 1.533 0.434 0 C-N-CA 121.144 1.229 . . . . 0.0 110.293 170.528 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 80.2 mtm180 -93.73 -30.67 14.76 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.245 175.679 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' X' X ' 10' ' ' LEU . . . . . 0.516 ' HB2' ' H ' ' X' ' 7' ' ' ASP . 96.5 mt -98.44 -18.43 18.25 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -174.597 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.485 ' O ' ' HB3' ' X' ' 15' ' ' SER . 44.8 mm -68.35 -16.24 20.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 170.29 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' X' X ' 12' ' ' GLU . . . . . 0.569 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 38.2 tt0 -93.4 -54.79 3.54 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.253 174.838 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' X' X ' 13' ' ' SER . . . . . 0.418 ' HA ' HG23 ' X' ' 40' ' ' ILE . 22.8 t -94.49 -27.94 15.72 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -169.825 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' X' X ' 14' ' ' LEU . . . . . . . . . . . . . 9.3 tt -94.5 -47.6 6.48 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 -179.769 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.485 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 35.1 t -62.87 -28.82 70.3 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.094 -179.397 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' X' X ' 16' ' ' GLN . . . . . 0.569 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 16.3 tm0? -50.11 -43.08 51.51 Favored 'General case' 0 N--CA 1.463 0.186 0 O-C-N 123.507 0.505 . . . . 0.0 110.993 178.326 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.806 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 18.9 ptp -99.26 -30.46 12.23 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.736 -176.05 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -65.44 -33.91 77.06 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -176.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 57.6 p -98.78 -12.16 21.16 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -178.87 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 12.3 tpt -88.04 -23.84 23.64 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.046 -178.005 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.93 44.93 0.72 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.621 179.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.806 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 4.0 m-85 -116.77 -174.26 2.54 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 176.36 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' X' X ' 23' ' ' SER . . . . . 0.557 ' O ' HG21 ' X' ' 47' ' ' ILE . 50.6 m -150.47 -161.03 1.25 Allowed 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.126 -0.63 . . . . 0.0 111.143 178.143 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.479 ' HA ' ' HE1' ' X' ' 28' ' ' TRP . 7.6 t70 -116.63 123.99 48.68 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 177.056 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -119.24 78.98 1.35 Allowed 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 120.829 0.347 . . . . 0.0 110.493 -177.114 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 124.74 -6.79 8.38 Favored Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.524 -0.846 . . . . 0.0 113.831 176.989 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.37 12.16 63.43 Favored Glycine 0 C--O 1.23 -0.13 0 C-N-CA 120.61 -0.805 . . . . 0.0 111.663 -177.135 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.712 ' HE3' ' HB3' ' X' ' 32' ' ' LEU . 31.2 p-90 -65.1 -34.52 78.6 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-N 115.127 -0.537 . . . . 0.0 111.572 -179.116 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' X' X ' 29' ' ' LEU . . . . . . . . . . . . . 51.8 tp -55.11 -22.5 16.78 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -165.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 51.2 p -94.66 -32.52 13.35 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.697 -0.627 . . . . 0.0 111.774 175.192 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' X' X ' 31' ' ' ARG . . . . . 0.44 ' CG ' ' HA ' ' X' ' 28' ' ' TRP . 31.8 ptt180 -94.22 -40.1 10.18 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -173.286 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' X' X ' 32' ' ' LEU . . . . . 0.712 ' HB3' ' HE3' ' X' ' 28' ' ' TRP . 2.9 tm? -61.91 -56.27 21.04 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 123.401 0.68 . . . . 0.0 110.24 -178.615 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 10.5 mp -55.06 -50.4 69.21 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.504 177.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -47.35 -53.24 14.26 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.421 -177.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 19.7 m -73.62 -23.98 59.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.918 0.39 . . . . 0.0 110.966 -178.185 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' X' X ' 36' ' ' LYS . . . . . 0.53 ' HB3' ' HB3' ' X' ' 39' ' ' ASP . 14.7 mptt -95.33 33.67 1.54 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.515 178.27 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 46.73 35.5 3.15 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.519 0.728 . . . . 0.0 112.446 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' X' X ' 38' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 66.94 69.9 0.39 Allowed 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.364 0.666 . . . . 0.0 110.038 -178.167 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' X' X ' 39' ' ' ASP . . . . . 0.53 ' HB3' ' HB3' ' X' ' 36' ' ' LYS . 30.2 t70 -121.9 137.6 54.72 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.449 -173.272 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.756 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -90.43 -8.5 10.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.735 173.096 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' X' X ' 41' ' ' GLY . . . . . 0.419 ' H ' ' CG ' ' X' ' 39' ' ' ASP . . . -62.85 -48.35 81.61 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.124 -177.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -93.48 -10.56 34.56 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.898 -0.651 . . . . 0.0 110.818 175.782 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.756 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -68.29 -47.55 67.32 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.674 -179.245 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.414 HD13 ' O ' ' X' ' 40' ' ' ILE . 10.3 mp -71.57 -20.2 62.04 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.119 -178.408 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -70.45 -23.05 62.64 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.431 -178.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 33.0 p -95.3 -23.55 17.16 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -174.594 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.62 ' O ' ' HG3' ' X' ' 48' ' ' GLN . 1.7 pt -102.8 -26.75 3.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -172.992 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' X' X ' 48' ' ' GLN . . . . . 0.62 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.7 mt-30 -157.31 -53.36 0.07 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 118.351 0.523 . . . . 0.0 111.412 -176.819 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 . . . . . 0 C--N 1.322 -0.588 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 176.573 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.516 -0.362 0 CA-C-O 121.807 0.813 . . . . 0.0 109.987 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' X' X ' 7' ' ' ASP . . . . . 0.455 ' O ' HG22 ' X' ' 11' ' ' ILE . 13.3 t70 -94.28 149.47 36.78 Favored Pre-proline 0 C--N 1.315 -0.904 0 CA-C-N 114.606 -1.179 . . . . 0.0 108.237 -178.485 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' X' X ' 8' ' ' PRO . . . . . 0.749 ' O ' ' HB2' ' X' ' 12' ' ' GLU . 63.2 Cg_exo -48.28 -13.37 0.23 Allowed 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.022 2.482 . . . . 0.0 113.033 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' X' X ' 9' ' ' ARG . . . . . 0.449 ' HB3' ' CD1' ' X' ' 38' ' ' TYR . 10.4 mmt-85 -71.5 -48.81 46.61 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.394 173.873 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' X' X ' 10' ' ' LEU . . . . . 0.548 HD22 ' HB2' ' X' ' 14' ' ' LEU . 24.3 mt -100.08 -41.16 7.26 Favored 'General case' 0 C--O 1.222 -0.366 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -178.2 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.621 ' O ' ' HB3' ' X' ' 15' ' ' SER . 11.2 tt -63.01 -22.3 30.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.1 0.476 . . . . 0.0 110.112 -179.057 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' X' X ' 12' ' ' GLU . . . . . 0.749 ' HB2' ' O ' ' X' ' 8' ' ' PRO . 0.4 OUTLIER -94.26 -59.58 1.92 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.809 172.378 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' X' X ' 13' ' ' SER . . . . . 0.434 ' HB2' ' O ' ' X' ' 9' ' ' ARG . 49.4 m -85.62 -25.72 26.48 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -169.24 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.548 ' HB2' HD22 ' X' ' 10' ' ' LEU . 10.4 tt -93.0 -40.7 10.4 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 178.637 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.621 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 32.1 t -68.08 -16.65 64.11 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.867 177.211 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' X' X ' 16' ' ' GLN . . . . . 0.539 ' O ' ' HB2' ' X' ' 20' ' ' MET . 19.1 tm0? -55.24 -45.4 76.04 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.067 0.461 . . . . 0.0 110.316 174.464 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.668 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 15.0 ptm -99.9 -20.29 16.21 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.668 -176.305 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' X' X ' 18' ' ' LEU . . . . . 0.451 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 46.0 tp -60.12 -49.34 78.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.772 0.32 . . . . 0.0 111.005 -179.459 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 16.0 p -98.86 9.26 43.83 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -178.442 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' X' X ' 20' ' ' MET . . . . . 0.539 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 27.4 ttt -91.43 -28.33 17.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.035 0.445 . . . . 0.0 111.022 -178.82 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.35 34.55 1.59 Allowed Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.572 -0.823 . . . . 0.0 111.179 -174.627 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.668 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 14.9 m-30 -117.83 -174.72 2.69 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 175.803 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 71.7 p -161.38 -163.35 0.99 Allowed 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 119.621 -0.832 . . . . 0.0 111.043 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.634 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 0.7 OUTLIER -112.64 115.18 28.17 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 166.882 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' X' X ' 25' ' ' GLU . . . . . 0.563 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 62.9 tt0 -51.65 -34.88 39.88 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.007 -175.607 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -124.16 -68.65 0.21 Allowed Glycine 0 C--N 1.318 -0.465 0 N-CA-C 111.24 -0.744 . . . . 0.0 111.24 173.524 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -176.31 29.97 0.08 OUTLIER Glycine 0 CA--C 1.508 -0.379 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 177.661 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.759 ' HH2' HG23 ' X' ' 47' ' ' ILE . 45.7 p-90 -97.33 -9.73 26.95 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -172.281 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.634 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 12.5 tp -52.52 -25.71 11.07 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -169.879 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' X' X ' 30' ' ' THR . . . . . 0.456 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 32.1 p -84.44 -55.9 3.91 Favored 'General case' 0 C--N 1.322 -0.604 0 O-C-N 121.876 -0.515 . . . . 0.0 110.421 170.509 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.4 -51.9 50.63 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.785 -177.901 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -51.26 -60.36 3.21 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 123.266 0.626 . . . . 0.0 111.114 -177.319 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.462 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 8.8 mp -62.86 -44.83 95.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.134 -179.114 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' X' X ' 34' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.8 OUTLIER -49.47 -47.06 48.68 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -178.45 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 4.7 m -80.8 -23.92 38.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.957 0.408 . . . . 0.0 111.25 -176.404 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -102.5 39.72 1.47 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -175.243 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 50.4 29.32 3.81 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.728 0.811 . . . . 0.0 112.512 179.422 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.462 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 92.6 m-85 71.27 71.46 0.18 Allowed 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.825 177.876 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -114.52 130.16 56.72 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.891 -174.327 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.565 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -90.92 -17.9 7.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.077 169.87 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.26 -34.78 90.28 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.219 179.192 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.82 -15.68 19.16 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.38 -0.41 . . . . 0.0 111.002 176.675 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.565 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -72.48 -38.94 68.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.939 0.4 . . . . 0.0 110.777 178.623 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.545 ' HG ' HD11 ' X' ' 47' ' ' ILE . 9.0 mp -76.75 -18.3 58.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.486 178.2 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -69.29 -34.73 75.16 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.547 175.674 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 7.1 p -95.75 -6.04 40.65 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -174.333 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.759 HG23 ' HH2' ' X' ' 28' ' ' TRP . 6.6 pt -100.2 -30.22 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 119.613 -0.835 . . . . 0.0 113.205 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' X' X ' 48' ' ' GLN . . . . . 0.543 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 0.0 OUTLIER -165.79 -48.01 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.256 0.55 . . . . 0.0 110.595 -177.57 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 . . . . . 0 C--N 1.325 -0.495 0 CA-C-N 114.977 -1.01 . . . . 0.0 110.53 -172.894 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.228 0 CA-C-O 121.973 0.892 . . . . 0.0 108.841 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -84.4 144.97 44.23 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 114.31 -1.313 . . . . 0.0 107.893 177.169 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -41.6 -26.77 0.42 Allowed 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 123.253 2.635 . . . . 0.0 113.764 -178.175 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' X' X ' 9' ' ' ARG . . . . . 0.524 ' HD2' ' CE2' ' X' ' 38' ' ' TYR . 83.9 mtm180 -83.45 -42.58 16.77 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 178.931 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 3.9 mp -97.28 -17.08 20.02 Favored 'General case' 0 C--O 1.216 -0.659 0 O-C-N 122.277 -0.264 . . . . 0.0 111.55 -174.65 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.562 ' O ' ' HB3' ' X' ' 15' ' ' SER . 10.5 tt -73.93 -12.95 15.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 170.484 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -93.81 -50.23 5.45 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 114.396 -1.275 . . . . 0.0 110.761 174.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' X' X ' 13' ' ' SER . . . . . 0.582 ' HA ' HG23 ' X' ' 40' ' ' ILE . 44.1 p -95.01 -34.09 12.47 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -171.236 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.522 ' HG ' HD11 ' X' ' 29' ' ' LEU . 6.4 tt -93.36 -44.54 8.23 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 -178.284 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.562 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 16.1 t -66.72 -21.72 66.07 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.924 -178.392 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 7.0 tm0? -56.54 -55.39 34.44 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.341 174.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.786 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 23.6 ptp -80.37 -26.91 38.36 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.926 -178.268 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' X' X ' 18' ' ' LEU . . . . . 0.436 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 33.5 tp -64.83 -29.38 70.34 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.03 0.443 . . . . 0.0 110.613 178.265 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 14.1 t -94.64 -14.23 25.1 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.892 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 35.9 tpp -96.05 -32.22 12.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.154 -176.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.27 38.0 1.16 Allowed Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.706 -0.759 . . . . 0.0 111.876 -179.163 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.786 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 51.8 m-85 -136.05 160.88 37.29 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 50.7 m -151.6 -161.95 1.43 Allowed 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.148 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.965 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 11.3 p-10 -69.17 120.63 15.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.926 0.394 . . . . 0.0 109.997 173.328 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -102.64 58.25 0.79 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.447 0.641 . . . . 0.0 109.305 179.193 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 145.29 -8.1 1.63 Allowed Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.404 -176.411 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 96.82 15.48 39.5 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 121.193 -0.527 . . . . 0.0 111.847 -178.647 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.874 ' HH2' HG23 ' X' ' 47' ' ' ILE . 46.9 p-90 -95.7 -7.05 38.45 Favored 'General case' 0 C--O 1.221 -0.437 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -174.871 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.965 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 6.1 tp -59.06 -24.92 63.3 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.686 0.675 . . . . 0.0 111.11 -175.011 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 38.5 p -93.59 -40.2 10.41 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 121.853 -0.529 . . . . 0.0 110.855 170.673 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 15.8 mmm180 -60.61 -64.41 0.96 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.076 0.465 . . . . 0.0 111.339 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -53.22 -60.46 3.26 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.903 -178.295 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 10.9 mp -54.08 -68.01 0.22 Allowed 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.352 -174.837 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -47.71 -46.46 29.67 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -176.378 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 23.4 m -66.89 -33.02 74.69 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.7 0.286 . . . . 0.0 111.616 -178.575 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' X' X ' 36' ' ' LYS . . . . . 0.534 ' O ' ' HB2' ' X' ' 39' ' ' ASP . 5.6 mptp? -95.43 26.44 3.86 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 178.876 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 39.0 t30 62.82 50.1 3.43 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 121.238 0.542 . . . . 0.0 110.832 179.315 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.524 ' CE2' ' HD2' ' X' ' 9' ' ' ARG . 92.0 m-85 48.23 53.91 11.09 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.862 -179.623 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' X' X ' 39' ' ' ASP . . . . . 0.534 ' HB2' ' O ' ' X' ' 36' ' ' LYS . 1.8 t0 -93.27 128.78 39.4 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.394 -173.086 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.582 HG23 ' HA ' ' X' ' 13' ' ' SER . 0.0 OUTLIER -89.61 -12.01 9.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.413 171.829 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.97 -36.51 93.16 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.603 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.02 -24.7 14.82 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.875 0.369 . . . . 0.0 110.988 177.552 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.577 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -64.84 -37.99 89.47 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.154 178.88 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.704 ' HA ' ' CG1' ' X' ' 47' ' ' ILE . 7.2 mp -68.28 -37.35 80.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.292 -178.319 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' X' X ' 45' ' ' ASP . . . . . 0.602 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.0 t70 -55.18 -37.32 66.91 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.832 0.349 . . . . 0.0 110.828 179.274 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 14.3 p -88.73 -29.05 20.11 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.874 HG23 ' HH2' ' X' ' 28' ' ' TRP . 24.6 pt -79.93 43.91 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 O-C-N 121.644 -0.66 . . . . 0.0 112.084 175.788 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 78.79 8.7 1.99 Allowed 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 172.418 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' X' X ' 49' ' ' TYR . . . . . 0.602 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 14.0 m-85 . . . . . 0 C--N 1.328 -0.362 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 170.97 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 -0.277 0 CA-C-O 121.179 0.514 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -86.0 145.91 41.94 Favored Pre-proline 0 C--N 1.32 -0.675 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 173.74 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -43.08 -26.79 0.83 Allowed 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.189 2.593 . . . . 0.0 113.191 -179.119 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' X' X ' 9' ' ' ARG . . . . . 0.506 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 69.1 mtt85 -80.03 -44.22 20.52 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.927 177.992 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' X' X ' 10' ' ' LEU . . . . . 0.671 HD22 ' HB2' ' X' ' 14' ' ' LEU . 86.1 mt -98.07 -15.43 20.01 Favored 'General case' 0 C--O 1.217 -0.652 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -172.367 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.515 ' O ' ' HB2' ' X' ' 15' ' ' SER . 11.7 tt -71.8 -17.09 19.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 169.348 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 46.5 tp10 -94.46 -58.63 2.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.4 -1.273 . . . . 0.0 111.191 175.412 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 14.1 m -91.89 -22.66 19.95 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -170.251 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.671 ' HB2' HD22 ' X' ' 10' ' ' LEU . 53.4 tp -94.3 -48.03 6.35 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 177.679 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.515 ' HB2' ' O ' ' X' ' 11' ' ' ILE . 45.0 m -66.89 -18.87 65.59 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.689 -176.345 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 5.0 tm0? -60.39 -49.19 78.55 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.161 0.505 . . . . 0.0 110.333 173.944 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.648 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 4.5 ppp? -91.31 -21.07 21.23 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.325 -177.04 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' X' X ' 18' ' ' LEU . . . . . 0.412 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 28.6 tp -69.62 -39.56 77.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.835 -179.985 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 21.0 p -72.7 -41.95 64.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.637 -179.571 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 15.5 tpt -71.61 -29.53 64.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.475 -176.198 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.48 47.23 1.7 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.041 -1.076 . . . . 0.0 112.066 -178.947 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.648 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 31.5 m-85 -106.96 172.2 6.95 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 174.345 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' X' X ' 23' ' ' SER . . . . . 0.435 ' O ' HG22 ' X' ' 47' ' ' ILE . 10.7 m -148.24 169.95 18.96 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 119.976 -0.69 . . . . 0.0 110.254 179.187 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.637 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 8.2 p-10 -71.24 140.92 50.58 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 170.98 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -116.35 65.85 0.71 Allowed 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.87 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 139.1 -3.56 2.78 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.662 -175.942 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 83.13 26.23 45.25 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.978 -179.575 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.775 ' HH2' HG23 ' X' ' 47' ' ' ILE . 55.0 p-90 -96.94 -17.93 19.79 Favored 'General case' 0 C--O 1.216 -0.683 0 CA-C-O 119.081 -0.485 . . . . 0.0 112.152 -176.353 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.637 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 35.3 tp -47.46 -45.55 26.01 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -168.303 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 30.2 p -69.05 -49.16 59.97 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.746 0.307 . . . . 0.0 110.878 176.017 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' X' X ' 31' ' ' ARG . . . . . 0.567 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 4.2 mtm180 -57.47 -60.59 3.42 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.617 -178.647 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' X' X ' 32' ' ' LEU . . . . . 0.479 ' O ' ' HB2' ' X' ' 36' ' ' LYS . 2.1 tm? -48.67 -55.03 12.46 Favored 'General case' 0 C--O 1.23 0.079 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.25 -178.543 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 92.6 mt -59.88 -67.7 0.36 Allowed 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.751 -178.373 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -43.19 -56.15 3.58 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -175.166 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 32.3 p -67.12 -27.54 67.41 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -175.917 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' X' X ' 36' ' ' LYS . . . . . 0.479 ' HB2' ' O ' ' X' ' 32' ' ' LEU . 1.9 tttm -97.45 37.55 1.35 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.171 179.951 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 43.1 45.83 4.75 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.483 0.713 . . . . 0.0 112.119 -176.866 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.506 ' CD2' ' HB3' ' X' ' 9' ' ' ARG . 24.4 m-85 56.84 68.28 0.88 Allowed 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.987 178.924 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -106.92 122.53 46.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.1 -178.651 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.656 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -89.85 -8.14 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.95 173.614 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.38 -43.0 97.73 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.214 177.666 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -94.45 -22.28 18.38 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.473 -0.364 . . . . 0.0 111.212 177.776 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.656 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -68.0 -38.83 83.1 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.792 178.741 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.779 HD12 HD11 ' X' ' 47' ' ' ILE . 6.9 mp -62.83 -33.26 74.86 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.654 -179.076 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' X' X ' 45' ' ' ASP . . . . . 0.474 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 18.9 t70 -53.15 -45.44 68.43 Favored 'General case' 0 C--N 1.33 -0.245 0 O-C-N 123.333 0.396 . . . . 0.0 111.468 178.272 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 3.2 p -96.45 -5.23 40.11 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 -176.124 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.779 HD11 HD12 ' X' ' 44' ' ' LEU . 23.6 pt -96.75 42.28 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 O-C-N 121.572 -0.705 . . . . 0.0 111.322 173.547 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 80.94 30.82 0.16 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.034 0.933 . . . . 0.0 112.634 174.453 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' X' X ' 49' ' ' TYR . . . . . 0.527 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 33.3 m-85 . . . . . 0 C--N 1.327 -0.402 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 170.49 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.452 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' X' X ' 7' ' ' ASP . . . . . 0.654 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 54.5 t0 -80.19 133.44 57.31 Favored Pre-proline 0 CA--C 1.506 -0.732 0 CA-C-N 113.693 -1.594 . . . . 0.0 107.521 177.916 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' X' X ' 8' ' ' PRO . . . . . 0.654 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 80.6 Cg_exo -40.56 -26.14 0.21 Allowed 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.908 2.405 . . . . 0.0 112.818 179.814 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 77.9 mtm180 -72.48 -53.03 13.26 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.41 175.263 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' X' X ' 10' ' ' LEU . . . . . 0.498 ' HA ' ' HB3' ' X' ' 13' ' ' SER . 4.5 mp -95.72 -23.77 16.83 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -174.318 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.573 ' HA ' ' HB2' ' X' ' 15' ' ' SER . 0.0 OUTLIER -62.73 -28.01 44.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.76 0.79 . . . . 0.0 109.016 177.086 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' X' X ' 12' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' X' ' 16' ' ' GLN . 81.9 mt-10 -93.9 -22.09 18.83 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.576 174.937 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' X' X ' 13' ' ' SER . . . . . 0.498 ' HB3' ' HA ' ' X' ' 10' ' ' LEU . 29.7 t -98.56 -61.03 1.43 Allowed 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -175.824 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.506 ' HG ' HD11 ' X' ' 29' ' ' LEU . 8.3 tt -92.58 -40.26 10.88 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-O 121.074 0.464 . . . . 0.0 109.749 -174.09 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.573 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 23.2 m -66.5 -26.91 67.39 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.009 -176.031 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' X' X ' 16' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' X' ' 12' ' ' GLU . 5.3 pp0? -69.3 -30.22 68.25 Favored 'General case' 0 C--O 1.228 -0.067 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.046 -179.425 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.948 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 18.9 ptm -96.39 -32.95 12.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.25 -179.517 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 61.1 tp -55.13 -43.65 74.33 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 123.427 0.454 . . . . 0.0 111.592 -178.215 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 16.3 p -98.93 9.74 42.86 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -177.157 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 35.0 ttp -111.22 -12.85 14.07 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.63 -176.413 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 115.19 19.82 5.77 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.336 -0.935 . . . . 0.0 112.398 179.604 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.948 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 28.0 m-85 -116.63 163.11 16.6 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 107.734 -1.209 . . . . 0.0 107.734 170.892 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 47.5 m -154.65 -138.01 0.07 Allowed 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 120.201 -0.599 . . . . 0.0 109.919 179.96 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.773 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 25.0 p-10 -110.75 116.29 31.03 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.238 0.542 . . . . 0.0 110.907 176.298 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' X' X ' 25' ' ' GLU . . . . . 0.738 ' HG3' ' HA ' ' X' ' 47' ' ' ILE . 1.9 mm-40 -83.76 54.18 2.8 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.218 0.532 . . . . 0.0 110.9 177.631 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 136.08 2.65 2.67 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.561 -179.188 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' X' X ' 27' ' ' GLY . . . . . 0.459 ' HA2' ' OD2' ' X' ' 24' ' ' ASP . . . 87.86 13.6 64.35 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.645 179.39 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.77 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 42.4 p-90 -85.49 -13.24 49.72 Favored 'General case' 0 C--O 1.217 -0.657 0 O-C-N 122.629 -0.336 . . . . 0.0 111.046 179.64 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.773 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 54.5 tp -56.06 -24.26 38.63 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.366 -175.723 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 53.2 p -93.86 -21.81 19.02 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.793 -0.185 . . . . 0.0 111.43 176.339 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' X' X ' 31' ' ' ARG . . . . . 0.618 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 0.2 OUTLIER -95.02 -56.36 2.77 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 120.568 0.223 . . . . 0.0 111.528 -177.339 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -44.97 -68.85 0.16 Allowed 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 124.046 0.938 . . . . 0.0 112.063 -174.507 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.795 ' HB2' ' HA ' ' X' ' 38' ' ' TYR . 0.9 OUTLIER -67.59 -25.61 65.85 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.873 -0.331 . . . . 0.0 111.785 -176.153 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' X' X ' 34' ' ' GLN . . . . . 0.459 ' N ' HD12 ' X' ' 33' ' ' LEU . 10.4 tp60 -63.7 -31.43 72.6 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 122.21 -0.307 . . . . 0.0 111.685 179.481 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' X' X ' 35' ' ' THR . . . . . 0.43 HG22 ' O ' ' X' ' 31' ' ' ARG . 4.9 t -99.26 -10.77 21.97 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 122.229 -0.294 . . . . 0.0 111.701 -179.214 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -114.39 39.92 2.66 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -174.868 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 50.29 34.84 9.45 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.666 0.786 . . . . 0.0 112.025 -178.129 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.795 ' HA ' ' HB2' ' X' ' 33' ' ' LEU . 68.8 m-85 64.69 69.39 0.5 Allowed 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.786 178.512 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -93.26 107.21 19.07 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 113.972 -1.467 . . . . 0.0 111.176 -172.698 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.635 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.5 OUTLIER -92.24 -4.07 10.75 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.432 172.671 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -74.64 -34.23 54.15 Favored Glycine 0 N--CA 1.441 -1.014 0 C-N-CA 120.003 -1.094 . . . . 0.0 111.027 175.391 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.73 -25.0 15.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.778 -0.711 . . . . 0.0 110.979 177.327 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.689 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -64.52 -42.72 95.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.234 179.859 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.631 HD13 ' O ' ' X' ' 40' ' ' ILE . 10.9 mp -67.03 -27.68 67.6 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.909 179.614 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -66.82 -58.01 5.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.193 174.798 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 21.2 p -61.9 -20.15 63.45 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 -174.064 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.77 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 1.8 pt -89.62 -30.05 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 C-N-CA 119.395 -0.922 . . . . 0.0 112.635 179.438 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' X' X ' 48' ' ' GLN . . . . . 0.631 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 0.4 OUTLIER -163.28 -43.65 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 117.671 0.214 . . . . 0.0 111.542 -177.924 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 . . . . . 0 N--CA 1.464 0.253 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -172.737 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' X' X ' 6' ' ' ALA . . . . . 0.417 ' HA ' ' HB ' ' X' ' 11' ' ' ILE . . . . . . . . 0 CA--C 1.515 -0.377 0 CA-C-O 121.251 0.548 . . . . 0.0 110.038 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' X' X ' 7' ' ' ASP . . . . . 0.751 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 37.3 t0 -71.37 136.54 83.96 Favored Pre-proline 0 C--N 1.318 -0.77 0 N-CA-C 106.948 -1.501 . . . . 0.0 106.948 174.88 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' X' X ' 8' ' ' PRO . . . . . 0.751 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 78.5 Cg_exo -38.78 -28.48 0.14 Allowed 'Trans proline' 0 CA--C 1.534 0.507 0 C-N-CA 123.507 2.805 . . . . 0.0 113.186 -177.81 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 28.9 mmm180 -90.44 -50.55 5.89 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.958 176.15 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' X' X ' 10' ' ' LEU . . . . . 0.712 HD22 ' HB2' ' X' ' 14' ' ' LEU . 96.0 mt -79.09 -15.22 58.48 Favored 'General case' 0 C--O 1.221 -0.446 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -173.284 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.552 ' O ' ' HB3' ' X' ' 15' ' ' SER . 11.8 tt -69.59 -25.92 29.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 174.033 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' X' X ' 12' ' ' GLU . . . . . 0.555 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 48.4 mt-10 -95.9 -45.91 6.76 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.531 174.307 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' X' X ' 13' ' ' SER . . . . . 0.467 ' HA ' HG23 ' X' ' 40' ' ' ILE . 20.4 m -89.67 -34.14 16.37 Favored 'General case' 0 C--O 1.222 -0.373 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -168.757 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.766 ' HG ' HD11 ' X' ' 29' ' ' LEU . 8.7 tt -95.94 -41.78 8.62 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.745 0.783 . . . . 0.0 109.017 -179.676 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.552 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 9.4 t -71.24 -16.08 62.47 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 114.73 -1.123 . . . . 0.0 111.243 -176.935 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' X' X ' 16' ' ' GLN . . . . . 0.555 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 3.8 tm0? -57.58 -58.77 6.84 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-O 120.786 0.327 . . . . 0.0 110.224 177.028 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' X' X ' 17' ' ' MET . . . . . 1.013 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 0.9 OUTLIER -82.91 -22.09 33.99 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.089 -179.298 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' X' X ' 18' ' ' LEU . . . . . 0.482 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 29.4 tp -66.41 -34.79 78.75 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.773 0.32 . . . . 0.0 110.775 -179.376 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 10.7 m -98.63 -36.16 9.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.546 -176.811 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 26.6 ttt -68.33 -31.81 71.48 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -176.209 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.79 46.58 0.6 Allowed Glycine 0 CA--C 1.508 -0.38 0 C-N-CA 119.938 -1.125 . . . . 0.0 113.196 178.617 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 1.013 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 8.9 m-30 -111.97 -174.48 2.47 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 170.758 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 49.9 m -144.66 -161.28 1.26 Allowed 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 119.7 -0.8 . . . . 0.0 111.401 -179.109 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.561 ' HA ' ' CD1' ' X' ' 28' ' ' TRP . 10.5 t0 -115.28 121.23 42.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.422 -177.946 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' X' X ' 25' ' ' GLU . . . . . 0.553 ' OE2' ' HB ' ' X' ' 46' ' ' THR . 4.5 pt-20 -61.61 -25.02 67.08 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -178.214 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 148.63 30.91 0.06 OUTLIER Glycine 0 CA--C 1.519 0.311 0 C-N-CA 120.351 -0.928 . . . . 0.0 113.665 178.948 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' X' X ' 27' ' ' GLY . . . . . 0.564 ' O ' ' HB3' ' X' ' 31' ' ' ARG . . . 126.21 33.91 0.65 Allowed Glycine 0 N--CA 1.446 -0.7 0 C-N-CA 121.026 -0.606 . . . . 0.0 111.674 178.742 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.604 ' HE3' ' HB3' ' X' ' 32' ' ' LEU . 8.5 p-90 -97.67 -39.97 8.82 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-O 120.666 0.269 . . . . 0.0 110.98 -178.263 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.766 HD11 ' HG ' ' X' ' 14' ' ' LEU . 46.1 tp -69.83 -19.15 63.47 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 121.767 -0.583 . . . . 0.0 110.986 -166.45 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 1.7 t -95.0 -31.01 13.82 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.992 170.796 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' X' X ' 31' ' ' ARG . . . . . 0.564 ' HB3' ' O ' ' X' ' 27' ' ' GLY . 40.8 ttt180 -96.36 -62.26 1.3 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -173.191 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' X' X ' 32' ' ' LEU . . . . . 0.604 ' HB3' ' HE3' ' X' ' 28' ' ' TRP . 2.8 tm? -50.62 -63.25 1.18 Allowed 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.441 0.696 . . . . 0.0 111.563 -176.472 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 31.4 mt -45.77 -58.86 3.15 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.574 0.546 . . . . 0.0 111.739 -177.439 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 46.4 mm-40 -46.71 -58.78 3.53 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 123.83 0.707 . . . . 0.0 112.542 -178.947 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 60.9 p -62.5 -28.57 69.93 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.547 -176.889 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' X' X ' 36' ' ' LYS . . . . . 0.514 ' HB3' ' HB2' ' X' ' 39' ' ' ASP . 5.4 mptp? -94.63 39.3 1.1 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.548 176.606 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 52.0 p30 31.82 53.12 0.24 Allowed 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.862 1.265 . . . . 0.0 113.744 -174.358 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' X' X ' 38' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 60.0 56.11 3.53 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.276 178.142 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' X' X ' 39' ' ' ASP . . . . . 0.514 ' HB2' ' HB3' ' X' ' 36' ' ' LYS . 24.5 m-20 -107.14 128.01 54.02 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.277 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.634 ' H ' HD13 ' X' ' 40' ' ' ILE . 0.1 OUTLIER -84.36 -3.13 7.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.732 169.239 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -69.67 -36.44 75.62 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.289 179.248 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.11 -12.49 20.45 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.951 0.405 . . . . 0.0 110.214 175.088 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.605 ' CB ' ' HA ' ' X' ' 40' ' ' ILE . . . -57.2 -53.22 60.52 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.821 -179.666 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.505 ' HG ' ' HE2' ' X' ' 22' ' ' PHE . 10.2 mp -61.35 -38.77 88.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.619 -179.258 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -52.16 -46.05 65.3 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.252 -179.654 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' X' X ' 46' ' ' THR . . . . . 0.553 ' HB ' ' OE2' ' X' ' 25' ' ' GLU . 36.7 p -78.12 -35.11 49.53 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -171.44 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.544 HG12 ' O ' ' X' ' 43' ' ' ALA . 6.7 pt -96.25 -25.19 4.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 -168.999 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -153.64 -26.68 0.14 Allowed 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -178.207 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 . . . . . 0 C--N 1.324 -0.523 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -178.284 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.468 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' X' X ' 7' ' ' ASP . . . . . 0.454 ' O ' HG22 ' X' ' 11' ' ' ILE . 80.9 m-20 -70.38 155.49 93.35 Favored Pre-proline 0 CA--C 1.507 -0.703 0 CA-C-N 114.605 -1.18 . . . . 0.0 109.179 179.564 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -53.0 -18.37 9.45 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 122.134 1.889 . . . . 0.0 111.438 172.086 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 15.1 mmm180 -93.71 -35.82 12.61 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.353 179.744 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' X' X ' 10' ' ' LEU . . . . . 0.684 HD22 ' HG ' ' X' ' 14' ' ' LEU . 63.9 mt -98.26 -25.33 14.9 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.792 -171.671 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.529 ' HA ' ' HB2' ' X' ' 15' ' ' SER . 10.6 tt -70.48 -14.53 18.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 171.032 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -96.58 -52.29 4.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.673 -1.148 . . . . 0.0 111.2 175.341 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 7.7 t -94.46 -32.71 13.4 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -168.963 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.684 ' HG ' HD22 ' X' ' 10' ' ' LEU . 32.3 mt -92.51 -39.16 11.54 Favored 'General case' 0 CA--C 1.506 -0.721 0 O-C-N 121.556 -0.715 . . . . 0.0 109.63 178.481 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.529 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 8.2 t -63.3 -22.31 66.8 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.519 -175.905 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.73 -29.17 63.13 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 120.411 -0.516 . . . . 0.0 109.997 176.919 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' X' X ' 17' ' ' MET . . . . . . . . . . . . . 26.2 mtt -72.21 -40.13 68.06 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.325 171.886 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 11.1 mp -68.43 -14.13 62.79 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.453 178.911 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 2.8 t -98.92 -40.98 7.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.934 -178.389 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 83.8 mtp -83.92 -32.4 25.13 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -176.986 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.32 46.91 0.67 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.384 -0.912 . . . . 0.0 112.396 -179.548 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -117.14 160.94 20.23 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 174.134 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 13.8 m -140.9 -136.71 0.11 Allowed 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 120.196 -0.602 . . . . 0.0 110.145 -179.659 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.551 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 7.9 p-10 -121.77 122.3 39.2 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.164 173.001 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' X' X ' 25' ' ' GLU . . . . . 0.784 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 40.1 tt0 -67.68 -48.02 67.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.36 0.6 . . . . 0.0 110.377 -179.325 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -129.02 19.88 5.43 Favored Glycine 0 C--N 1.32 -0.326 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.992 -178.838 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 87.93 4.87 78.16 Favored Glycine 0 C--O 1.228 -0.256 0 C-N-CA 120.539 -0.839 . . . . 0.0 112.688 178.462 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.786 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 36.3 p-90 -75.04 -9.16 58.28 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -178.985 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.551 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 59.0 tp -53.85 -23.56 12.85 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 -171.316 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' X' X ' 30' ' ' THR . . . . . 0.638 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 43.9 p -84.59 -63.82 1.27 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.646 170.79 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' X' X ' 31' ' ' ARG . . . . . 0.568 ' CG ' ' HA ' ' X' ' 28' ' ' TRP . 12.1 ptm180 -57.07 -45.72 83.05 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -175.434 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -53.23 -64.4 0.83 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.782 0.325 . . . . 0.0 110.653 -178.347 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.545 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.7 mp -65.76 -43.69 88.11 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.891 -175.671 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' X' X ' 34' ' ' GLN . . . . . 0.638 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.0 OUTLIER -54.81 -38.92 67.94 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -178.293 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 19.3 m -85.05 -12.31 53.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.304 0.574 . . . . 0.0 110.892 -178.681 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -112.37 37.9 2.89 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.354 179.768 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 43.37 40.62 2.72 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.648 0.779 . . . . 0.0 112.733 -178.345 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.545 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 64.4 m-85 64.04 67.89 0.59 Allowed 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.688 177.771 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -105.67 120.1 40.81 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.13 -176.443 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.708 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -91.26 -9.54 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 CA-C-O 121.033 0.444 . . . . 0.0 110.198 170.771 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.23 -34.65 81.14 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.394 -0.907 . . . . 0.0 111.517 176.978 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.27 -14.86 19.07 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.947 -0.626 . . . . 0.0 110.987 176.062 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.708 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -75.84 -33.57 60.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.242 -179.16 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.631 ' HA ' HD11 ' X' ' 47' ' ' ILE . 10.9 mp -72.89 -23.56 60.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.946 0.403 . . . . 0.0 110.053 177.359 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -68.62 -29.07 67.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.009 174.981 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 13.3 p -96.84 -14.96 21.51 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 -172.669 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.786 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 1.2 pp -97.84 -28.77 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 119.715 1.143 . . . . 0.0 113.104 -179.41 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' X' X ' 48' ' ' GLN . . . . . 0.489 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 2.0 mp0 -161.19 -59.35 0.05 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.014 0.435 . . . . 0.0 110.573 179.853 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.919 -175.668 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.215 0 CA-C-O 121.63 0.729 . . . . 0.0 109.929 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -91.44 147.29 35.05 Favored Pre-proline 0 C--N 1.317 -0.812 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 179.211 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' X' X ' 8' ' ' PRO . . . . . 0.621 ' HA ' HG22 ' X' ' 11' ' ' ILE . 79.0 Cg_exo -42.07 -23.77 0.27 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.115 2.543 . . . . 0.0 113.169 179.824 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' X' X ' 9' ' ' ARG . . . . . 0.436 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 63.5 mtp180 -64.53 -55.59 19.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.946 173.792 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' X' X ' 10' ' ' LEU . . . . . 0.451 ' HA ' ' OG ' ' X' ' 13' ' ' SER . 5.1 mp -99.41 -26.26 14.19 Favored 'General case' 0 C--O 1.22 -0.465 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -176.739 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.621 HG22 ' HA ' ' X' ' 8' ' ' PRO . 11.6 tt -64.64 -21.23 28.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.337 0.589 . . . . 0.0 109.467 178.751 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -93.63 -33.82 13.54 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.041 175.683 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' X' X ' 13' ' ' SER . . . . . 0.636 ' HA ' HG23 ' X' ' 40' ' ' ILE . 56.6 p -96.54 -48.62 5.47 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -173.402 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.442 ' HG ' HD11 ' X' ' 29' ' ' LEU . 8.2 tt -93.49 -42.18 9.38 Favored 'General case' 0 CA--C 1.507 -0.706 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -175.798 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.532 ' CB ' ' HA ' ' X' ' 11' ' ' ILE . 7.3 t -69.78 -22.69 63.32 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.754 -178.497 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 4.5 tm0? -56.33 -59.95 4.22 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.21 0.529 . . . . 0.0 109.993 173.694 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.758 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 11.8 ptm -77.09 -22.52 52.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.457 -176.303 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 20.8 tp -68.4 -39.42 81.68 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.912 0.387 . . . . 0.0 110.382 176.715 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 15.7 t -83.69 -31.35 26.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.186 -179.603 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 37.9 tpp -69.26 -29.23 67.09 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.886 0.374 . . . . 0.0 111.249 -177.259 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.21 38.48 1.23 Allowed Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.339 -0.934 . . . . 0.0 112.15 -178.858 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.758 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 14.2 m-30 -117.4 -173.61 2.45 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 176.595 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 60.2 m -159.28 -135.28 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 176.63 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.611 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.2 p30 -121.67 133.75 54.97 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.854 0.359 . . . . 0.0 110.036 171.804 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' X' X ' 25' ' ' GLU . . . . . 0.496 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 21.7 tt0 -87.37 48.47 1.65 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.043 0.449 . . . . 0.0 110.038 178.233 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 148.97 -8.21 0.93 Allowed Glycine 0 CA--C 1.518 0.278 0 C-N-CA 120.281 -0.961 . . . . 0.0 113.646 179.849 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 101.05 15.54 28.08 Favored Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.008 -179.126 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.718 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 43.2 p-90 -91.67 -5.11 54.35 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -176.438 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.611 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 28.4 tp -56.83 -34.14 67.46 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.543 -172.293 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 70.5 p -89.32 -10.54 46.38 Favored 'General case' 0 C--N 1.321 -0.637 0 O-C-N 122.164 -0.335 . . . . 0.0 111.293 176.491 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' X' X ' 31' ' ' ARG . . . . . 0.49 ' HG2' ' HA ' ' X' ' 28' ' ' TRP . 22.6 mmm-85 -94.89 -53.04 3.99 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.021 0.439 . . . . 0.0 111.241 -177.545 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.71 -67.21 0.29 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.656 -177.727 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.557 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.8 mp -54.88 -52.45 62.8 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.531 -177.299 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -41.78 -60.0 1.5 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -177.743 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 2.9 m -66.59 -31.3 71.92 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.242 -176.622 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' X' X ' 36' ' ' LYS . . . . . 0.595 ' HE3' ' OD2' ' X' ' 39' ' ' ASP . 24.4 mtpp -96.56 39.38 1.16 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.968 -176.433 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 45.96 39.95 6.24 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.209 1.003 . . . . 0.0 113.086 179.859 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.557 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 43.5 m-85 59.89 74.12 0.46 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.599 175.69 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' X' X ' 39' ' ' ASP . . . . . 0.595 ' OD2' ' HE3' ' X' ' 36' ' ' LYS . 41.4 p-10 -112.45 138.91 48.52 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.756 0.789 . . . . 0.0 112.437 178.763 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.636 HG23 ' HA ' ' X' ' 13' ' ' SER . 0.0 OUTLIER -90.46 -13.42 9.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.084 175.025 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.5 -50.91 61.63 Favored Glycine 0 N--CA 1.444 -0.813 0 CA-C-N 115.517 -0.765 . . . . 0.0 112.511 -176.774 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -88.5 -16.97 31.32 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.216 -0.492 . . . . 0.0 111.137 178.054 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.502 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -67.66 -46.24 72.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.388 -179.781 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.556 HD13 ' OH ' ' X' ' 49' ' ' TYR . 37.5 mt -72.11 -25.54 61.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.985 0.421 . . . . 0.0 110.524 -179.189 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' X' X ' 45' ' ' ASP . . . . . 0.655 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 9.6 t70 -61.64 -36.86 82.0 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.729 178.507 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 10.7 p -96.03 -3.71 44.38 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 -172.486 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.718 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 1.5 pp -99.78 -27.36 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 C-N-CA 118.379 -1.328 . . . . 0.0 112.614 -177.942 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' X' X ' 48' ' ' GLN . . . . . 0.446 ' N ' HD12 ' X' ' 47' ' ' ILE . 0.0 OUTLIER -158.74 -58.32 0.07 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.753 0.311 . . . . 0.0 110.801 178.701 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' X' X ' 49' ' ' TYR . . . . . 0.655 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 1.3 p90 . . . . . 0 C--N 1.326 -0.453 0 CA-C-O 121.055 0.455 . . . . 0.0 112.226 -175.303 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.516 -0.338 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' X' X ' 7' ' ' ASP . . . . . 0.589 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 39.2 t70 -107.22 149.72 39.04 Favored Pre-proline 0 C--N 1.315 -0.906 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 -177.88 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 8' ' ' PRO . . . . . 0.589 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 72.2 Cg_exo -47.4 -22.24 2.51 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 122.167 1.911 . . . . 0.0 112.5 179.58 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 9' ' ' ARG . . . . . 0.734 ' HB3' ' HB2' ' X' ' 38' ' ' TYR . 66.1 mtt85 -87.1 -28.82 22.3 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.272 178.185 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 10' ' ' LEU . . . . . 0.554 HD22 ' HB2' ' X' ' 14' ' ' LEU . 95.7 mt -97.78 -27.58 14.25 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 122.218 -0.301 . . . . 0.0 110.696 -175.569 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.468 ' O ' ' HB3' ' X' ' 15' ' ' SER . 61.1 mt -61.88 -25.37 37.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 174.518 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 12' ' ' GLU . . . . . 0.467 ' HG2' ' O ' ' X' ' 8' ' ' PRO . 6.3 pt-20 -96.39 -58.75 1.99 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.828 171.494 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 13' ' ' SER . . . . . 0.601 ' HB3' HG23 ' X' ' 40' ' ' ILE . 30.8 m -81.18 -26.73 35.78 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -168.275 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.554 ' HB2' HD22 ' X' ' 10' ' ' LEU . 30.6 tp -93.13 -40.29 10.57 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.169 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.468 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 24.4 t -65.16 -26.33 68.12 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.825 -177.762 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.35 -26.96 60.45 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.461 -179.211 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.799 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 20.8 ptm -93.73 -28.1 16.13 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.614 177.878 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 4.2 mp -66.89 -35.63 80.45 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.176 179.374 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 22.4 p -87.49 -27.62 22.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.62 -0.263 . . . . 0.0 111.648 -179.263 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 46.9 tpp -80.84 -32.57 35.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.578 -176.163 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 106.35 47.83 1.03 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.047 -1.073 . . . . 0.0 112.178 -179.4 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.799 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 20.3 m-30 -108.92 168.28 9.47 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 108.083 -1.081 . . . . 0.0 108.083 176.454 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 23' ' ' SER . . . . . 0.614 ' H ' HE22 ' X' ' 48' ' ' GLN . 20.3 m -146.33 -179.33 6.67 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 119.895 -0.722 . . . . 0.0 110.832 179.45 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 24' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -77.95 132.3 37.81 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 172.125 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' X' X ' 25' ' ' GLU . . . . . 0.92 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 50.2 tt0 -76.76 -16.12 59.57 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.331 -0.548 . . . . 0.0 110.035 179.916 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -159.77 -80.11 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 111.505 -0.638 . . . . 0.0 111.505 176.637 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -162.12 32.63 0.33 Allowed Glycine 0 CA--C 1.508 -0.379 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 175.516 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.92 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 56.9 p-90 -98.37 -16.23 19.39 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -175.325 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.574 ' HA ' ' CE3' ' X' ' 28' ' ' TRP . 60.0 tp -51.16 -48.67 61.83 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -164.762 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 30' ' ' THR . . . . . 0.544 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 40.8 p -75.86 -10.85 59.77 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.823 -0.548 . . . . 0.0 111.536 178.421 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 30.9 ttt180 -94.6 -54.87 3.34 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.37 0.268 . . . . 0.0 111.677 -179.688 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -52.47 -49.9 63.76 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.385 0.674 . . . . 0.0 110.4 179.671 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.92 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 73.1 mt -62.59 -53.68 50.99 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.564 179.25 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 34' ' ' GLN . . . . . 0.544 ' HB2' ' O ' ' X' ' 30' ' ' THR . 30.2 tp60 -39.29 -56.81 1.47 Allowed 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.99 1.107 . . . . 0.0 113.99 -174.958 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 34.7 p -65.81 -17.12 64.41 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -174.859 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' X' X ' 36' ' ' LYS . . . . . 0.432 ' O ' ' HB3' ' X' ' 37' ' ' ASN . 50.9 mttm -114.33 30.32 7.38 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -176.568 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 37' ' ' ASN . . . . . 0.432 ' HB3' ' O ' ' X' ' 36' ' ' LYS . 32.2 t30 65.71 28.12 11.13 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.463 0.649 . . . . 0.0 110.311 179.438 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.92 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 50.1 m-85 60.8 68.25 0.76 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.525 -173.205 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -103.35 133.01 49.13 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.565 -174.362 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.854 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.1 OUTLIER -90.21 -3.99 10.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.136 175.805 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.41 -41.18 99.78 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 120.32 -0.943 . . . . 0.0 111.815 179.201 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -100.47 -14.88 18.09 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.949 -0.626 . . . . 0.0 111.015 175.391 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.854 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -72.26 -41.03 67.21 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.591 178.569 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.892 HD12 HD11 ' X' ' 47' ' ' ILE . 6.4 mp -56.06 -32.11 63.79 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 123.537 0.523 . . . . 0.0 111.202 179.794 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -51.76 -48.35 63.76 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.093 176.206 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 16.9 p -96.08 -20.15 18.88 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -175.453 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.892 HD11 HD12 ' X' ' 44' ' ' LEU . 7.2 pt -83.78 43.67 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 O-C-N 121.607 -0.683 . . . . 0.0 112.025 177.729 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 48' ' ' GLN . . . . . 0.614 HE22 ' H ' ' X' ' 23' ' ' SER . 2.4 mp0 82.14 34.07 0.08 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.347 1.059 . . . . 0.0 112.874 173.158 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 . . . . . 0 C--N 1.327 -0.373 0 CA-C-O 121.227 0.537 . . . . 0.0 110.768 173.307 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.289 0 CA-C-O 121.418 0.628 . . . . 0.0 109.731 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' X' X ' 7' ' ' ASP . . . . . 0.532 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 35.8 t70 -77.31 148.11 77.09 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 114.932 -1.031 . . . . 0.0 108.284 177.975 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' X' X ' 8' ' ' PRO . . . . . 0.532 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 86.4 Cg_exo -41.54 -34.97 2.26 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.645 2.23 . . . . 0.0 112.33 179.312 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 31.1 mmt-85 -77.97 -56.17 4.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.587 174.83 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' X' X ' 10' ' ' LEU . . . . . 0.484 HD22 ' HB2' ' X' ' 14' ' ' LEU . 77.4 mt -73.0 -29.78 63.28 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-N 115.348 -0.842 . . . . 0.0 112.604 -169.034 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.503 ' O ' ' HB2' ' X' ' 15' ' ' SER . 12.1 tt -64.25 -20.82 27.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.656 0.741 . . . . 0.0 109.613 175.476 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' X' X ' 12' ' ' GLU . . . . . 0.457 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 40.1 tt0 -96.26 -58.48 2.06 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.388 175.246 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 16.4 t -91.93 -23.19 19.68 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -168.56 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.717 HD11 ' HG ' ' X' ' 29' ' ' LEU . 16.1 tp -92.18 -45.72 8.11 Favored 'General case' 0 CA--C 1.504 -0.802 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 177.145 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.579 ' HA ' ' HB2' ' X' ' 18' ' ' LEU . 48.8 m -64.97 -18.38 65.22 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.158 178.017 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' X' X ' 16' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 11.8 tm0? -57.44 -42.07 81.7 Favored 'General case' 0 CA--C 1.521 -0.151 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 173.276 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.512 ' HB3' ' HB2' ' X' ' 22' ' ' PHE . 1.9 mtp -86.98 -35.7 18.69 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.722 -176.957 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' X' X ' 18' ' ' LEU . . . . . 0.579 ' HB2' ' HA ' ' X' ' 15' ' ' SER . 3.8 mm? -62.38 -44.98 95.19 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.667 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 50.6 p -86.92 -24.55 24.78 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 -175.023 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 51.0 ttm -78.77 -32.26 46.47 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.755 0.312 . . . . 0.0 110.88 -177.674 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 112.75 47.45 0.67 Allowed Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.215 -0.993 . . . . 0.0 112.081 -179.506 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.512 ' HB2' ' HB3' ' X' ' 17' ' ' MET . 12.6 m-30 -114.7 163.83 14.9 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 176.341 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' X' X ' 23' ' ' SER . . . . . 0.473 ' O ' HG22 ' X' ' 47' ' ' ILE . 72.0 m -150.1 150.46 31.72 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.499 -179.855 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.669 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 0.6 OUTLIER -71.07 129.05 37.97 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.389 0.614 . . . . 0.0 111.688 178.869 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' X' X ' 25' ' ' GLU . . . . . 0.809 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 30.8 tt0 -56.76 -30.04 63.2 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.71 178.581 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -146.3 -19.22 0.13 Allowed Glycine 0 CA--C 1.521 0.448 0 C-N-CA 120.351 -0.928 . . . . 0.0 114.113 -178.389 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' X' X ' 27' ' ' GLY . . . . . 0.402 ' H ' ' HB2' ' X' ' 24' ' ' ASP . . . 126.72 27.15 1.07 Allowed Glycine 0 C--O 1.228 -0.234 0 C-N-CA 120.409 -0.901 . . . . 0.0 112.224 -177.781 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.809 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 38.8 p-90 -96.36 -4.62 41.63 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 123.127 0.571 . . . . 0.0 111.57 -178.472 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.717 ' HG ' HD11 ' X' ' 14' ' ' LEU . 63.5 tp -47.87 -32.65 6.47 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -167.885 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 60.8 p -90.36 -40.13 12.28 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 121.917 -0.489 . . . . 0.0 111.432 175.365 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' X' X ' 31' ' ' ARG . . . . . 0.674 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -72.98 -37.27 67.1 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -173.628 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -61.99 -55.51 28.61 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.132 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.579 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 10.5 mp -56.6 -50.39 72.1 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.643 178.125 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 30.9 tp60 -48.55 -44.43 36.48 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -179.696 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 8.6 m -72.67 -37.44 67.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.921 0.391 . . . . 0.0 110.845 179.707 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' X' X ' 36' ' ' LYS . . . . . 0.467 ' O ' ' HB2' ' X' ' 39' ' ' ASP . 5.1 mptp? -90.98 37.3 0.92 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.492 179.509 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 41.91 53.88 4.06 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.669 0.788 . . . . 0.0 112.667 -178.187 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.579 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 34.6 m-85 54.72 62.91 2.33 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.374 178.009 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' X' X ' 39' ' ' ASP . . . . . 0.467 ' HB2' ' O ' ' X' ' 36' ' ' LYS . 32.4 t0 -118.05 134.27 55.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.917 -176.053 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.777 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.1 OUTLIER -89.72 -7.53 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.271 170.601 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.4 -35.02 90.38 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.306 -179.731 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -100.03 -22.16 15.34 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.527 -0.336 . . . . 0.0 110.606 175.285 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.777 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -68.25 -37.66 81.01 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.328 -179.924 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.727 HD13 ' HB ' ' X' ' 40' ' ' ILE . 9.2 mp -68.75 -17.84 64.11 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.735 0.302 . . . . 0.0 111.173 179.162 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -83.92 -29.99 26.69 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.96 0.41 . . . . 0.0 110.463 176.667 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 15.2 p -96.01 -21.69 17.84 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -172.29 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.76 HG23 ' HH2' ' X' ' 28' ' ' TRP . 1.1 pp -67.16 -26.12 35.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 119.525 -0.87 . . . . 0.0 111.476 -173.955 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' X' X ' 48' ' ' GLN . . . . . 0.616 ' HB3' ' O ' ' X' ' 47' ' ' ILE . 0.1 OUTLIER 153.95 -5.66 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.682 1.193 . . . . 0.0 110.374 169.739 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' X' X ' 49' ' ' TYR . . . . . 0.54 ' H ' HD12 ' X' ' 47' ' ' ILE . 11.3 m-30 . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.305 174.081 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.444 0 CA-C-O 121.374 0.607 . . . . 0.0 109.568 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' X' X ' 7' ' ' ASP . . . . . 0.527 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 38.7 t70 -81.36 143.56 52.1 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 179.085 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 8' ' ' PRO . . . . . 0.527 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 82.9 Cg_exo -42.53 -30.92 1.73 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.662 2.242 . . . . 0.0 112.562 179.295 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 9' ' ' ARG . . . . . 0.49 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 39.3 mmt180 -87.76 -52.07 5.51 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.021 177.324 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 10' ' ' LEU . . . . . 0.415 ' HA ' ' HB2' ' X' ' 13' ' ' SER . 91.8 mt -81.54 -14.08 57.31 Favored 'General case' 0 C--O 1.216 -0.697 0 CA-C-N 116.0 -0.546 . . . . 0.0 112.446 -171.404 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.502 ' HA ' ' CB ' ' X' ' 15' ' ' SER . 13.9 tt -66.05 -24.76 34.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.4 0.619 . . . . 0.0 109.604 175.873 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -94.47 -28.86 15.24 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.963 174.528 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' X' X ' 13' ' ' SER . . . . . 0.415 ' HB2' ' HA ' ' X' ' 10' ' ' LEU . 16.3 m -96.21 -54.33 3.33 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -171.132 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.421 ' HG ' ' HG ' ' X' ' 29' ' ' LEU . 9.9 tt -94.81 -46.74 6.76 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 -176.429 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.502 ' CB ' ' HA ' ' X' ' 11' ' ' ILE . 14.4 m -63.2 -25.53 68.38 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.178 -177.991 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 16' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' X' ' 20' ' ' MET . 2.5 tm0? -61.37 -47.68 84.74 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.029 0.442 . . . . 0.0 109.901 174.703 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.603 ' SD ' HD13 ' X' ' 47' ' ' ILE . 42.1 mtt -77.74 -39.8 43.13 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.046 -177.473 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 35.6 tp -64.47 -37.77 88.69 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.235 -177.723 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 3.7 t -85.7 -22.23 27.93 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.628 0.251 . . . . 0.0 110.932 -178.633 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' X' X ' 20' ' ' MET . . . . . 0.401 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 15.4 tpt -78.01 -32.42 51.1 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.925 0.393 . . . . 0.0 110.887 -178.733 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.6 34.53 1.55 Allowed Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.836 -177.89 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.495 ' HB2' ' HB3' ' X' ' 17' ' ' MET . 14.8 m-30 -110.33 -177.31 3.21 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 174.284 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -151.13 -178.33 6.56 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.113 178.54 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' X' X ' 24' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -94.35 144.16 25.78 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 173.973 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' X' X ' 25' ' ' GLU . . . . . 0.507 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 29.4 tt0 -107.5 57.3 0.63 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.151 0.5 . . . . 0.0 110.189 179.65 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.38 -29.31 2.29 Favored Glycine 0 CA--C 1.517 0.191 0 C-N-CA 120.65 -0.786 . . . . 0.0 113.076 179.407 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 120.03 16.16 4.95 Favored Glycine 0 CA--C 1.506 -0.528 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 -177.931 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.906 ' HH2' HG23 ' X' ' 47' ' ' ILE . 60.9 p-90 -84.97 -11.85 54.59 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.132 -0.534 . . . . 0.0 111.347 -177.91 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.421 ' HG ' ' HG ' ' X' ' 14' ' ' LEU . 30.7 tp -66.17 -19.59 65.88 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.393 -0.817 . . . . 0.0 110.018 -176.914 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 30' ' ' THR . . . . . 0.46 ' O ' ' HG3' ' X' ' 34' ' ' GLN . 0.1 OUTLIER -95.74 -31.54 13.16 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.921 167.814 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' X' X ' 31' ' ' ARG . . . . . 0.739 ' HB3' ' HA ' ' X' ' 28' ' ' TRP . 50.0 ttt-85 -87.27 -65.88 0.97 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 -174.256 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 32' ' ' LEU . . . . . 0.882 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 3.3 tm? -41.67 -59.83 1.53 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.022 0.929 . . . . 0.0 111.39 179.307 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.415 HD12 ' O ' ' X' ' 29' ' ' LEU . 65.9 mt -47.36 -68.88 0.15 Allowed 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.281 -175.754 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 34' ' ' GLN . . . . . 0.46 ' HG3' ' O ' ' X' ' 30' ' ' THR . 5.3 mt-30 -57.4 -27.37 62.28 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -171.531 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 15.4 m -71.96 -21.74 61.55 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.952 0.406 . . . . 0.0 111.034 179.22 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' X' X ' 36' ' ' LYS . . . . . 0.443 ' HB2' ' HB2' ' X' ' 39' ' ' ASP . 18.5 mtpp -121.28 37.38 4.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.953 -175.661 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 50.6 t30 63.72 39.03 8.9 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.377 0.608 . . . . 0.0 110.737 178.818 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.49 ' CD2' ' HB3' ' X' ' 9' ' ' ARG . 11.4 m-85 55.57 66.35 1.24 Allowed 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.425 -176.784 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 39' ' ' ASP . . . . . 0.443 ' HB2' ' HB2' ' X' ' 36' ' ' LYS . 17.8 t70 -88.86 124.59 34.34 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.034 -0.984 . . . . 0.0 112.177 -169.499 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.662 ' O ' HD13 ' X' ' 44' ' ' LEU . 1.5 mm -89.7 -24.32 5.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.131 175.838 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.19 -33.08 84.14 Favored Glycine 0 N--CA 1.441 -1.027 0 CA-C-N 115.264 -0.88 . . . . 0.0 112.762 -177.701 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -100.16 -21.88 15.38 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.873 0.368 . . . . 0.0 111.387 -178.632 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.617 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -70.89 -32.66 69.7 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.655 178.557 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.814 HD12 HD11 ' X' ' 47' ' ' ILE . 6.3 mp -64.65 -35.25 80.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.757 -178.99 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -52.83 -38.92 61.98 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.174 0.296 . . . . 0.0 111.683 179.779 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 2.0 p -96.07 -22.15 17.52 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -176.95 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.906 HG23 ' HH2' ' X' ' 28' ' ' TRP . 16.8 pt -83.34 42.64 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-N 118.478 0.581 . . . . 0.0 112.145 176.915 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 74.74 13.51 3.5 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.359 0.664 . . . . 0.0 112.383 173.912 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 . . . . . 0 N--CA 1.468 0.44 0 CA-C-O 120.655 0.264 . . . . 0.0 110.501 176.161 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.077 0 CA-C-O 121.152 0.501 . . . . 0.0 110.073 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' X' X ' 7' ' ' ASP . . . . . 0.45 ' O ' HG22 ' X' ' 11' ' ' ILE . 57.6 p30 -83.67 156.18 65.05 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.252 179.465 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -47.19 -14.6 0.19 Allowed 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.07 2.513 . . . . 0.0 114.244 -176.064 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 68.8 mtm180 -94.37 -42.71 8.75 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 111.987 0.365 . . . . 0.0 111.987 179.506 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' X' X ' 10' ' ' LEU . . . . . 0.409 HD22 ' HB2' ' X' ' 14' ' ' LEU . 53.1 mt -97.64 -26.08 14.89 Favored 'General case' 0 C--O 1.221 -0.446 0 O-C-N 122.213 -0.305 . . . . 0.0 111.458 -177.153 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.642 ' O ' ' HB3' ' X' ' 15' ' ' SER . 7.8 tt -70.68 -15.2 18.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 169.536 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -93.73 -59.06 2.08 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.33 174.267 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 36.7 m -82.91 -33.86 26.76 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.315 0.857 . . . . 0.0 113.315 -172.411 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.445 HD23 HD23 ' X' ' 18' ' ' LEU . 9.4 tt -93.92 -39.25 10.78 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-O 121.393 0.616 . . . . 0.0 109.444 -177.421 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.642 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 6.4 t -73.67 -21.21 60.33 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.374 -176.667 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.61 -26.16 64.3 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 120.134 -0.627 . . . . 0.0 109.311 173.863 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.523 ' HE3' HD13 ' X' ' 47' ' ' ILE . 77.4 mtp -73.28 -46.35 50.36 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.649 175.642 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' X' X ' 18' ' ' LEU . . . . . 0.445 HD23 HD23 ' X' ' 14' ' ' LEU . 4.3 mm? -63.32 -41.87 98.94 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.889 179.19 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 16.1 m -70.05 -17.25 63.24 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -178.936 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 30.4 ttm -101.84 -30.23 11.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.864 0.364 . . . . 0.0 111.136 -176.41 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.48 45.74 0.65 Allowed Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.659 -0.782 . . . . 0.0 111.627 -178.785 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.422 ' HB2' ' HB3' ' X' ' 17' ' ' MET . 41.0 m-85 -133.74 166.27 23.02 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 177.771 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 70.2 m -158.72 -123.51 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -178.601 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.644 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.3 p30 -118.78 130.98 56.09 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 169.485 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' X' X ' 25' ' ' GLU . . . . . 1.089 ' HG3' ' HE1' ' X' ' 28' ' ' TRP . 3.0 pp20? -78.73 1.62 22.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.051 0.453 . . . . 0.0 110.5 -178.534 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -152.02 -73.49 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.98 172.38 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -175.34 28.25 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.479 0 N-CA-C 110.896 -0.882 . . . . 0.0 110.896 175.486 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 1.089 ' HE1' ' HG3' ' X' ' 25' ' ' GLU . 53.3 p-90 -98.31 -19.87 17.53 Favored 'General case' 0 C--O 1.212 -0.898 0 CA-C-O 118.557 -0.735 . . . . 0.0 112.227 -175.035 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.644 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 28.5 tp -40.35 -53.21 2.62 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -168.917 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' X' X ' 30' ' ' THR . . . . . 0.425 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 60.2 p -72.78 -17.66 61.56 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -178.773 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -94.59 -48.88 5.9 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.673 -174.944 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' X' X ' 32' ' ' LEU . . . . . 0.674 ' O ' ' HD3' ' X' ' 36' ' ' LYS . 3.4 tm? -50.12 -71.99 0.06 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 123.72 0.808 . . . . 0.0 111.381 -178.166 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.719 ' HB2' ' HA ' ' X' ' 38' ' ' TYR . 0.5 OUTLIER -62.83 -25.06 68.07 Favored 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -175.292 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' X' X ' 34' ' ' GLN . . . . . 0.435 ' N ' HD12 ' X' ' 33' ' ' LEU . 41.2 tp60 -57.65 -36.21 71.56 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 -179.118 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 7.1 m -96.03 -11.48 26.37 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.927 0.394 . . . . 0.0 110.939 -178.789 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' X' X ' 36' ' ' LYS . . . . . 0.674 ' HD3' ' O ' ' X' ' 32' ' ' LEU . 4.3 mptp? -108.17 36.55 2.75 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -177.505 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 41.6 t30 59.21 37.17 23.93 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.534 0.683 . . . . 0.0 111.084 178.169 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.719 ' HA ' ' HB2' ' X' ' 33' ' ' LEU . 54.8 m-85 54.34 59.12 4.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.256 179.48 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' X' X ' 39' ' ' ASP . . . . . 0.487 ' HB2' ' O ' ' X' ' 36' ' ' LYS . 2.4 t0 -91.72 128.9 37.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.667 -1.151 . . . . 0.0 111.428 -172.415 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.472 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.12 -7.6 10.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.346 170.416 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -70.76 -42.23 62.03 Favored Glycine 0 N--CA 1.442 -0.964 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.077 -178.977 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -91.26 -22.6 20.5 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.16 -0.52 . . . . 0.0 111.216 178.444 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.491 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -69.04 -41.16 78.04 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.418 -179.387 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.472 HD13 ' O ' ' X' ' 40' ' ' ILE . 10.9 mp -75.14 -33.86 61.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.727 0.299 . . . . 0.0 110.362 178.839 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -57.32 -35.14 69.49 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.291 179.425 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 1.5 p -86.12 -44.03 12.58 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -176.206 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.653 HG23 ' CH2' ' X' ' 28' ' ' TRP . 4.5 pt -67.1 -30.35 49.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 -170.85 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -165.61 -32.07 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 111.606 0.224 . . . . 0.0 111.606 -177.488 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' X' X ' 49' ' ' TYR . . . . . 0.438 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 13.3 m-85 . . . . . 0 N--CA 1.467 0.403 0 CA-C-O 120.765 0.316 . . . . 0.0 110.834 -179.27 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.515 -0.399 0 CA-C-O 121.608 0.718 . . . . 0.0 109.453 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' X' X ' 7' ' ' ASP . . . . . 0.621 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 25.0 t70 -75.87 146.07 78.84 Favored Pre-proline 0 C--N 1.319 -0.751 0 CA-C-N 114.367 -1.288 . . . . 0.0 108.172 175.965 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' X' X ' 8' ' ' PRO . . . . . 0.621 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 80.2 Cg_exo -42.97 -25.61 0.57 Allowed 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.062 2.508 . . . . 0.0 112.982 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' X' X ' 9' ' ' ARG . . . . . 0.488 ' HB3' ' CG ' ' X' ' 38' ' ' TYR . 64.3 mmt-85 -93.41 -39.1 11.1 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.537 179.844 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' X' X ' 10' ' ' LEU . . . . . 0.571 HD22 ' HB2' ' X' ' 14' ' ' LEU . 79.3 mt -95.66 -19.55 19.63 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 122.137 -0.352 . . . . 0.0 111.631 -170.764 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' X' X ' 11' ' ' ILE . . . . . 0.52 ' O ' ' HB3' ' X' ' 15' ' ' SER . 0.0 OUTLIER -66.39 -24.62 33.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 171.635 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' X' X ' 12' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 41.4 mt-10 -95.91 -62.29 1.31 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.613 173.625 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 35.9 m -81.07 -21.25 40.18 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -169.445 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' X' X ' 14' ' ' LEU . . . . . 0.853 HD12 HD11 ' X' ' 29' ' ' LEU . 8.8 tp -92.97 -45.83 7.76 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.798 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' X' X ' 15' ' ' SER . . . . . 0.52 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 19.3 t -67.6 -26.24 66.16 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 114.004 -1.453 . . . . 0.0 111.528 -178.031 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' X' X ' 16' ' ' GLN . . . . . 0.402 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 3.9 tm0? -52.25 -52.09 54.57 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.058 0.456 . . . . 0.0 110.944 177.485 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' X' X ' 17' ' ' MET . . . . . 0.692 ' SD ' HD13 ' X' ' 29' ' ' LEU . 8.4 ptm -89.06 -26.71 21.26 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.116 -175.619 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 28.8 mt -72.08 -17.69 61.98 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 119.961 -0.696 . . . . 0.0 112.126 -179.474 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 32.4 p -94.52 -21.72 18.69 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 121.059 -0.256 . . . . 0.0 111.383 178.584 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 86.6 mtp -87.08 -31.66 20.35 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.702 0.287 . . . . 0.0 111.321 -179.13 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 108.31 35.56 2.47 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.487 -175.329 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' X' X ' 22' ' ' PHE . . . . . 0.633 ' HD2' HD12 ' X' ' 47' ' ' ILE . 15.0 m-30 -112.82 146.72 38.36 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 175.295 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 62.6 m -136.72 -177.56 4.79 Favored 'General case' 0 C--N 1.308 -1.211 0 C-N-CA 119.903 -0.719 . . . . 0.0 110.779 -174.878 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' X' X ' 24' ' ' ASP . . . . . 0.874 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 1.3 p30 -79.55 123.13 27.3 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.213 0.53 . . . . 0.0 110.117 175.251 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' X' X ' 25' ' ' GLU . . . . . 0.53 ' CB ' ' HE1' ' X' ' 28' ' ' TRP . 18.4 tp10 -68.57 -35.29 77.19 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.264 -177.089 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -139.92 20.28 2.88 Favored Glycine 0 C--N 1.32 -0.334 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.787 178.101 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' X' X ' 27' ' ' GLY . . . . . 0.574 ' O ' ' HG2' ' X' ' 31' ' ' ARG . . . 91.31 23.18 29.93 Favored Glycine 0 C--O 1.225 -0.424 0 C-N-CA 120.509 -0.853 . . . . 0.0 112.309 -179.736 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' X' X ' 28' ' ' TRP . . . . . 0.742 ' CH2' HG23 ' X' ' 47' ' ' ILE . 47.8 p-90 -89.83 -13.7 35.98 Favored 'General case' 0 C--O 1.217 -0.644 0 O-C-N 122.887 -0.184 . . . . 0.0 111.311 -178.385 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' X' X ' 29' ' ' LEU . . . . . 0.874 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 11.4 tp -63.0 -20.96 65.8 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 121.791 -0.568 . . . . 0.0 109.898 -179.259 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.5 -25.7 17.49 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.266 171.224 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' X' X ' 31' ' ' ARG . . . . . 0.574 ' HG2' ' O ' ' X' ' 27' ' ' GLY . 15.7 mmm180 -95.92 -65.47 0.97 Allowed 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -175.433 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' X' X ' 32' ' ' LEU . . . . . 0.715 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 2.8 tm? -39.12 -54.94 1.7 Allowed 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.853 1.261 . . . . 0.0 112.533 -176.197 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' X' X ' 33' ' ' LEU . . . . . 0.735 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 93.4 mt -54.63 -61.85 2.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.497 -176.796 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 45.0 mm-40 -38.1 -55.89 1.23 Allowed 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -175.653 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 6.4 p -76.46 -2.44 32.13 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -169.179 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -112.79 -27.31 8.19 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 119.995 -0.682 . . . . 0.0 111.971 -179.009 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 20.7 p30 136.87 15.86 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 125.931 1.693 . . . . 0.0 109.979 178.214 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' X' X ' 38' ' ' TYR . . . . . 0.735 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 26.0 m-85 72.42 56.25 0.15 Allowed 'General case' 0 C--N 1.341 0.217 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 -170.102 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -100.72 125.94 47.22 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.766 -171.265 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' X' X ' 40' ' ' ILE . . . . . 0.818 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.1 OUTLIER -89.58 -8.6 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.123 173.664 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.97 -37.27 92.42 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.355 -0.926 . . . . 0.0 111.915 177.279 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.08 -21.39 16.21 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.506 -0.347 . . . . 0.0 110.74 175.904 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' X' X ' 43' ' ' ALA . . . . . 0.818 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -67.23 -33.78 76.08 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.018 178.049 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' X' X ' 44' ' ' LEU . . . . . 0.84 HD12 HD11 ' X' ' 47' ' ' ILE . 7.1 mp -63.98 -30.42 71.5 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.153 179.429 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' X' X ' 45' ' ' ASP . . . . . 0.572 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 21.1 t70 -57.37 -39.55 76.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.19 0.519 . . . . 0.0 110.812 174.749 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 11.7 p -94.46 -5.53 46.01 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -175.626 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' X' X ' 47' ' ' ILE . . . . . 0.84 HD11 HD12 ' X' ' 44' ' ' LEU . 2.0 pt -102.63 43.91 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 O-C-N 121.999 -0.438 . . . . 0.0 111.666 173.804 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 82.0 33.45 0.09 Allowed 'General case' 0 N--CA 1.474 0.744 0 O-C-N 124.276 0.985 . . . . 0.0 112.549 173.009 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' X' X ' 49' ' ' TYR . . . . . 0.572 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 63.8 m-85 . . . . . 0 C--N 1.33 -0.263 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 173.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.851 0 N-CA-C 112.187 -0.365 . . . . 0.0 112.187 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' X' X ' 2' ' ' SER . . . . . 0.473 ' HB2' ' OD2' ' X' ' 7' ' ' ASP . 19.3 m -95.06 158.54 34.72 Favored Pre-proline 0 C--N 1.325 -0.487 0 C-N-CA 122.151 0.18 . . . . 0.0 110.693 -178.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 3' ' ' PRO . . . . . 0.474 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 56.9 Cg_exo -54.11 127.08 24.25 Favored 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 122.856 2.371 . . . . 0.0 112.457 -178.076 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 4' ' ' PRO . . . . . 0.474 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 7.6 Cg_exo -75.08 41.18 0.72 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 123.25 2.633 . . . . 0.0 113.389 -176.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -158.12 12.59 0.19 Allowed 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 178.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -173.19 26.64 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.444 0 CA-C-O 121.186 0.517 . . . . 0.0 109.78 -177.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 7' ' ' ASP . . . . . 0.473 ' OD2' ' HB2' ' X' ' 2' ' ' SER . 7.9 t70 -74.85 148.84 85.19 Favored Pre-proline 0 C--N 1.319 -0.749 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 174.061 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 8' ' ' PRO . . . . . 0.452 ' O ' ' HB2' ' X' ' 12' ' ' GLU . 86.9 Cg_exo -46.85 -24.18 2.94 Favored 'Trans proline' 0 CA--C 1.535 0.563 0 C-N-CA 122.158 1.905 . . . . 0.0 112.555 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 27.3 mmm180 -93.38 -23.49 18.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.881 -0.6 . . . . 0.0 112.512 179.31 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 43.5 mt -98.37 -28.3 13.71 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.633 0.254 . . . . 0.0 110.883 -176.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.602 ' O ' ' HB3' ' X' ' 15' ' ' SER . 11.2 tp -75.82 -17.39 15.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 171.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 12' ' ' GLU . . . . . 0.452 ' HB2' ' O ' ' X' ' 8' ' ' PRO . 0.3 OUTLIER -91.12 -53.7 4.26 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.894 175.643 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' X' X ' 13' ' ' SER . . . . . 0.633 ' HB3' HG23 ' X' ' 40' ' ' ILE . 4.3 m -95.31 -26.19 16.02 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -170.383 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.409 HD22 ' HA ' ' X' ' 14' ' ' LEU . 2.5 tm? -94.86 -41.94 8.95 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.602 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 23.2 t -67.2 -25.72 66.27 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.984 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 16' ' ' GLN . . . . . 0.404 ' OE1' HD11 ' X' ' 44' ' ' LEU . 4.2 tm0? -63.66 -54.88 28.84 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 121.174 0.511 . . . . 0.0 110.308 176.055 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.722 ' SD ' HD11 ' X' ' 29' ' ' LEU . 14.2 ptp -71.69 -33.62 68.96 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.459 -177.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 28.1 tp -67.61 -36.46 80.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.881 0.372 . . . . 0.0 110.81 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 20.7 t -79.75 -38.24 33.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.243 -178.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 42.2 tpp -75.75 -31.52 59.59 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.617 0.228 . . . . 0.0 111.617 -175.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.88 47.27 0.62 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.145 -1.026 . . . . 0.0 112.754 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.653 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 50.4 m-85 -119.41 169.15 10.27 Favored 'General case' 0 CA--C 1.509 -0.603 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 175.065 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 42.0 m -151.31 -148.71 0.27 Allowed 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.113 -0.635 . . . . 0.0 110.369 -179.156 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.447 ' HA ' ' HB2' ' X' ' 29' ' ' LEU . 2.3 m-20 -92.46 115.81 28.43 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 174.126 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 25' ' ' GLU . . . . . 0.629 ' HG3' ' HA ' ' X' ' 47' ' ' ILE . 48.0 mm-40 -82.9 43.26 0.84 Allowed 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.715 177.694 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 143.05 -14.33 2.36 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.581 -178.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.58 7.38 36.92 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.834 -0.698 . . . . 0.0 111.902 -178.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.639 ' HH2' HG23 ' X' ' 47' ' ' ILE . 55.9 p-90 -86.51 -13.85 44.78 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 119.046 -0.502 . . . . 0.0 111.3 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.722 HD11 ' SD ' ' X' ' 17' ' ' MET . 36.9 tp -48.21 -51.0 27.21 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -167.366 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 25.5 p -65.43 -47.83 74.86 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.739 0.304 . . . . 0.0 111.019 177.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 31' ' ' ARG . . . . . 0.505 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 10.0 mtm180 -54.97 -52.48 62.92 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.903 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 32' ' ' LEU . . . . . 0.466 ' HB2' ' HE3' ' X' ' 28' ' ' TRP . 2.6 tm? -55.94 -55.25 34.9 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 123.034 0.533 . . . . 0.0 110.808 178.129 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 84.2 mt -56.91 -65.17 0.66 Allowed 'General case' 0 C--O 1.225 -0.214 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.195 -176.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -54.76 -38.7 67.54 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -172.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 42.8 p -71.88 -13.24 61.61 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -177.119 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -120.15 38.91 3.83 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.7 -0.227 . . . . 0.0 110.537 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 43.54 46.83 6.07 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.916 0.887 . . . . 0.0 112.029 -175.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 38' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 63.18 76.62 0.36 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.247 178.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -111.88 123.63 50.66 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.299 -174.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.723 ' HB ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.87 -8.76 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.454 174.2 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.46 -44.04 95.81 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.53 -0.843 . . . . 0.0 112.338 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -93.47 -18.91 21.77 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.698 0.285 . . . . 0.0 110.865 178.158 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.603 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -71.05 -51.05 27.51 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.487 177.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.76 ' HA ' ' CG1' ' X' ' 47' ' ' ILE . 10.3 mp -62.45 -28.9 70.13 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.509 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 45' ' ' ASP . . . . . 0.521 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 17.0 t70 -51.59 -44.77 62.93 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.474 0.484 . . . . 0.0 111.691 178.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 2.0 p -96.48 -23.68 16.45 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -177.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.76 ' CG1' ' HA ' ' X' ' 44' ' ' LEU . 25.3 pt -81.94 45.44 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 N-CA-C 112.935 0.716 . . . . 0.0 112.935 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 48' ' ' GLN . . . . . 0.454 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 3.0 mt-30 88.33 15.63 0.07 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.05 0.94 . . . . 0.0 113.342 173.231 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 49' ' ' TYR . . . . . 0.521 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 32.9 m-85 -129.17 77.46 1.79 Allowed 'General case' 0 C--N 1.328 -0.365 0 O-C-N 121.985 -0.447 . . . . 0.0 110.219 171.463 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 8.0 t -76.29 20.96 0.19 Allowed 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.815 0.34 . . . . 0.0 111.632 -177.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 52.4 tttp -167.91 118.54 0.82 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 176.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 2.8 m80 . . . . . 0 C--O 1.244 0.796 0 CA-C-O 118.468 -0.777 . . . . 0.0 111.069 -179.89 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.979 0 N-CA-C 111.967 -0.453 . . . . 0.0 111.967 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 22.6 t -81.51 130.28 62.45 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.756 0.278 . . . . 0.0 110.316 179.104 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 3' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -64.49 141.78 75.37 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.639 2.226 . . . . 0.0 112.283 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_exo -72.87 33.87 0.31 Allowed 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 123.069 2.513 . . . . 0.0 113.298 -178.293 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -139.27 12.19 2.58 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.624 0.726 . . . . 0.0 109.215 177.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -173.58 26.8 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.439 0 CA-C-N 114.779 -1.101 . . . . 0.0 108.757 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 7' ' ' ASP . . . . . 0.777 ' OD2' ' HD3' ' X' ' 9' ' ' ARG . 29.5 t70 -81.7 145.82 55.2 Favored Pre-proline 0 C--N 1.321 -0.672 0 CA-C-N 114.138 -1.392 . . . . 0.0 108.18 178.502 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 8' ' ' PRO . . . . . 0.579 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 92.9 Cg_exo -42.64 -26.0 0.57 Allowed 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 123.004 2.469 . . . . 0.0 113.879 -177.355 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 9' ' ' ARG . . . . . 0.777 ' HD3' ' OD2' ' X' ' 7' ' ' ASP . 3.6 mpp_? -92.89 -38.61 11.63 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.499 HD22 ' HB2' ' X' ' 14' ' ' LEU . 87.9 mt -97.03 -15.57 20.98 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 -172.374 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.472 ' O ' ' HB3' ' X' ' 15' ' ' SER . 15.2 tt -72.48 -19.59 19.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 172.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -94.44 -51.03 4.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.317 174.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 13' ' ' SER . . . . . 0.43 ' O ' ' HG2' ' X' ' 17' ' ' MET . 34.5 m -94.73 -29.63 14.69 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -169.005 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.499 ' HB2' HD22 ' X' ' 10' ' ' LEU . 10.0 tt -94.24 -40.62 9.9 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.472 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 5.6 t -67.53 -26.1 66.16 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.708 -179.03 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 16' ' ' GLN . . . . . 0.415 ' HA ' ' OG ' ' X' ' 19' ' ' SER . 1.1 pp0? -73.64 -28.48 61.8 Favored 'General case' 0 C--O 1.224 -0.263 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 175.597 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.43 ' HG2' ' O ' ' X' ' 13' ' ' SER . 91.0 mmm -65.46 -42.29 92.48 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 174.232 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.38 -34.64 77.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.067 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 19' ' ' SER . . . . . 0.415 ' OG ' ' HA ' ' X' ' 16' ' ' GLN . 5.1 p -84.83 -34.79 22.62 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -175.595 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 20' ' ' MET . . . . . 0.447 ' HA ' ' CE ' ' X' ' 20' ' ' MET . 21.2 mmt -78.44 -15.2 58.9 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 121.141 -0.224 . . . . 0.0 111.486 -178.409 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 98.68 44.57 2.45 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.499 178.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -125.6 -177.78 4.02 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 176.058 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 23' ' ' SER . . . . . 0.41 ' O ' HG21 ' X' ' 47' ' ' ILE . 42.5 m -156.96 -134.86 0.04 OUTLIER 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 175.524 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.586 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 2.8 p30 -122.15 131.43 53.95 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 169.737 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -97.61 55.11 1.21 Allowed 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.099 -0.64 . . . . 0.0 109.868 178.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 144.31 -0.22 1.08 Allowed Glycine 0 CA--C 1.518 0.227 0 C-N-CA 120.279 -0.963 . . . . 0.0 113.632 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.0 11.22 63.58 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.004 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.798 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 42.0 p-90 -87.21 -5.62 58.89 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -176.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.586 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 53.7 tp -59.83 -26.59 65.92 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 122.075 -0.39 . . . . 0.0 111.35 -175.083 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 80.5 p -93.73 -11.47 31.37 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.816 0.341 . . . . 0.0 111.082 175.326 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 31' ' ' ARG . . . . . 0.498 ' CG ' ' HA ' ' X' ' 28' ' ' TRP . 13.3 mmm180 -94.99 -61.98 1.39 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.25 0.548 . . . . 0.0 110.746 -178.458 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -47.16 -72.37 0.05 Allowed 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 114.345 -1.298 . . . . 0.0 111.408 -177.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.583 ' H ' HD12 ' X' ' 33' ' ' LEU . 6.3 mp -53.79 -50.0 67.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.579 -175.766 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 34' ' ' GLN . . . . . 0.401 HE22 HD21 ' X' ' 10' ' ' LEU . 0.0 OUTLIER -49.22 -34.06 14.01 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -176.154 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 2.7 m -99.05 -2.86 36.11 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 111.732 0.271 . . . . 0.0 111.732 -174.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -123.86 37.75 4.34 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -177.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 47.8 t30 69.48 26.33 5.18 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.38 0.61 . . . . 0.0 110.73 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.524 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 29.4 m-85 54.54 64.9 1.66 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.268 178.254 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 39' ' ' ASP . . . . . 0.426 ' O ' ' HG ' ' X' ' 33' ' ' LEU . 33.7 p-10 -103.79 133.8 48.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.013 -0.994 . . . . 0.0 112.551 -173.594 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.645 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -91.45 -3.92 10.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.95 170.285 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.96 -36.32 81.18 Favored Glycine 0 N--CA 1.444 -0.807 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.736 177.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -96.88 -17.66 20.02 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.304 -0.448 . . . . 0.0 110.783 176.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.645 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -68.44 -45.99 71.05 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.217 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.618 ' HA ' HD11 ' X' ' 47' ' ' ILE . 10.2 mp -63.41 -34.01 76.8 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.788 0.328 . . . . 0.0 110.754 178.297 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -58.85 -38.31 78.44 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.743 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 9.6 p -96.48 -5.93 38.38 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -172.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.798 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 1.4 pp -98.81 -27.07 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 CA-C-N 119.565 1.075 . . . . 0.0 112.502 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 48' ' ' GLN . . . . . 0.494 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.6 mp0 -159.8 -35.92 0.06 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.784 0.326 . . . . 0.0 110.949 -179.11 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -80.9 34.96 0.36 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.426 -177.011 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 8.4 t -81.54 -2.61 50.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.742 0.782 . . . . 0.0 109.894 178.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -120.11 20.21 12.11 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.602 176.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 79.3 t60 . . . . . 0 C--O 1.246 0.896 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.438 -177.456 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.866 0 N-CA-C 112.165 -0.374 . . . . 0.0 112.165 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 46.1 m -91.01 127.42 51.77 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-O 120.67 0.271 . . . . 0.0 110.506 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 3' ' ' PRO . . . . . 0.414 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 58.8 Cg_endo -74.98 162.48 37.1 Favored 'Trans proline' 0 CA--C 1.53 0.28 0 C-N-CA 122.516 2.144 . . . . 0.0 112.133 -178.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 4' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 4.2 Cg_exo -76.46 14.74 1.13 Allowed 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.859 2.373 . . . . 0.0 112.438 -179.572 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 5' ' ' GLU . . . . . 0.437 ' O ' ' HB3' ' X' ' 6' ' ' ALA . 4.1 tm-20 -153.55 112.9 3.79 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 176.525 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 6' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' X' ' 5' ' ' GLU . . . 81.73 48.93 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.48 0 O-C-N 124.115 0.885 . . . . 0.0 109.837 -171.121 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -89.68 150.08 43.44 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 172.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -46.36 -25.27 3.12 Favored 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 122.339 2.026 . . . . 0.0 113.05 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 66.0 mtt85 -87.59 -38.59 15.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.661 178.121 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 98.0 mt -81.95 -26.61 33.85 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.498 -176.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.512 ' O ' ' HB3' ' X' ' 15' ' ' SER . 0.3 OUTLIER -69.48 -20.18 23.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 174.188 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -88.34 -63.99 1.21 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.186 -0.915 . . . . 0.0 111.668 173.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 11.5 m -89.67 -26.7 20.57 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -167.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.57 ' HG ' HD11 ' X' ' 29' ' ' LEU . 7.8 tt -93.4 -42.74 9.12 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.512 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 15.3 t -67.12 -31.13 71.39 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.789 -175.509 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -65.91 -33.35 75.63 Favored 'General case' 0 C--O 1.227 -0.103 0 C-N-CA 120.501 -0.48 . . . . 0.0 111.022 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.812 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 14.7 ptm -89.03 -30.31 18.81 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.046 177.597 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 53.3 tp -59.71 -41.5 90.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.935 0.398 . . . . 0.0 110.665 177.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 14.6 m -87.69 -40.1 14.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.228 -175.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 86.3 mmm -72.28 -27.18 62.31 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -175.049 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.25 46.87 0.62 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 119.901 -1.142 . . . . 0.0 113.172 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.812 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 39.7 m-85 -122.69 160.24 26.27 Favored 'General case' 0 CA--C 1.511 -0.552 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 171.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 5.0 m -147.87 178.11 8.77 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.095 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.592 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.3 p30 -85.07 130.03 34.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.201 0.524 . . . . 0.0 110.082 173.522 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 25' ' ' GLU . . . . . 0.729 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 51.7 tp10 -69.67 -25.08 63.72 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.212 -176.849 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -145.66 15.25 1.8 Allowed Glycine 0 C--O 1.228 -0.238 0 C-N-CA 120.336 -0.935 . . . . 0.0 113.597 -178.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 27' ' ' GLY . . . . . 0.423 ' O ' ' HD3' ' X' ' 31' ' ' ARG . . . 90.91 22.89 31.72 Favored Glycine 0 CA--C 1.509 -0.337 0 C-N-CA 120.468 -0.872 . . . . 0.0 111.92 179.616 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.729 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 38.8 p-90 -96.12 -5.0 41.75 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -176.343 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.592 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 3.2 tp -51.37 -38.73 54.81 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -170.226 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 30' ' ' THR . . . . . 0.768 ' O ' ' HG3' ' X' ' 34' ' ' GLN . 70.5 p -79.72 -46.2 17.5 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 119.928 -0.709 . . . . 0.0 110.195 173.185 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 31' ' ' ARG . . . . . 0.677 ' HD2' ' H ' ' X' ' 31' ' ' ARG . 1.4 mpt_? -53.34 -66.19 0.43 Allowed 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.422 0.689 . . . . 0.0 112.398 -179.065 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 32' ' ' LEU . . . . . 0.491 HD22 ' HE2' ' X' ' 36' ' ' LYS . 3.5 tm? -50.91 -60.5 3.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.437 -177.311 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.535 HD13 ' O ' ' X' ' 29' ' ' LEU . 11.0 mp -52.51 -47.8 66.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.405 -175.209 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 34' ' ' GLN . . . . . 0.768 ' HG3' ' O ' ' X' ' 30' ' ' THR . 33.2 mt-30 -64.88 -26.07 68.16 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -173.325 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 70.4 p -74.02 -16.68 61.05 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.315 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 36' ' ' LYS . . . . . 0.491 ' HE2' HD22 ' X' ' 32' ' ' LEU . 2.8 mptp? -121.33 37.08 4.43 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 121.266 -0.173 . . . . 0.0 111.462 177.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 37.9 t30 66.25 52.72 1.1 Allowed 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.161 0.505 . . . . 0.0 111.357 177.024 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.419 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 1.2 m-85 44.71 58.61 3.82 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.131 177.164 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 39' ' ' ASP . . . . . 0.489 ' O ' ' HG ' ' X' ' 33' ' ' LEU . 24.9 p-10 -111.15 151.49 28.1 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 119.167 -1.013 . . . . 0.0 113.523 -172.141 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.627 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -90.66 -2.88 10.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 114.11 -1.405 . . . . 0.0 110.119 172.245 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.31 -37.06 85.89 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.851 -0.69 . . . . 0.0 111.797 -178.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.21 -21.0 17.54 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.251 -0.474 . . . . 0.0 110.532 175.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.627 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -63.62 -47.26 82.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.303 178.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.413 ' HA ' HD11 ' X' ' 47' ' ' ILE . 1.1 tp -62.68 -26.35 68.61 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.355 -179.295 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -67.28 -45.64 76.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.057 -179.439 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 27.5 p -97.31 -20.7 17.68 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -170.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.703 HG23 ' HH2' ' X' ' 28' ' ' TRP . 4.6 pt -64.58 -30.37 50.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 118.959 0.799 . . . . 0.0 112.586 -171.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -166.42 -41.56 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.201 0.524 . . . . 0.0 109.923 177.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 -75.7 -158.48 0.09 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.007 -175.227 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 20.6 t -160.88 21.83 0.13 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.126 178.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -153.73 151.19 29.34 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.555 -179.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 . . . . . 0 C--O 1.245 0.866 0 CA-C-O 118.443 -0.789 . . . . 0.0 109.484 175.966 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.718 0 N-CA-C 112.035 -0.426 . . . . 0.0 112.035 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 30.5 m -88.09 129.27 50.59 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-O 120.709 0.29 . . . . 0.0 110.876 -178.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 3' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -55.34 126.34 22.18 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.277 2.651 . . . . 0.0 112.589 -179.305 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -75.25 25.91 0.38 Allowed 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.794 2.329 . . . . 0.0 113.597 -178.19 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 72.53 4.06 4.87 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.551 0.741 . . . . 0.0 110.518 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -134.53 22.09 3.66 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.372 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.01 154.22 41.76 Favored Pre-proline 0 C--O 1.218 -0.59 0 CA-C-N 114.785 -1.098 . . . . 0.0 108.322 174.043 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_exo -45.7 -22.46 1.19 Allowed 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 123.305 2.67 . . . . 0.0 114.55 -174.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -83.99 -42.17 16.5 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 122.055 -0.403 . . . . 0.0 112.045 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 67.9 mt -99.25 -19.45 17.09 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -175.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.598 ' O ' ' HB3' ' X' ' 15' ' ' SER . 0.1 OUTLIER -69.4 -22.73 25.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 175.653 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -93.78 -37.58 11.71 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.765 176.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 13' ' ' SER . . . . . 0.405 ' HA ' HG23 ' X' ' 40' ' ' ILE . 7.4 m -95.83 -40.72 9.19 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -171.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.422 HD23 HD11 ' X' ' 29' ' ' LEU . 3.3 tm? -94.58 -48.41 6.11 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -178.306 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.598 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 22.9 t -64.49 -27.11 68.75 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.053 -176.344 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 18.6 tm0? -62.56 -46.65 87.38 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.206 0.527 . . . . 0.0 109.812 174.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 17' ' ' MET . . . . . . . . . . . . . 77.2 mtp -71.36 -43.62 66.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.723 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 29.1 tp -62.58 -32.48 73.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.953 -176.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 8.0 t -96.33 -11.04 26.41 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.749 0.278 . . . . 0.0 111.749 -175.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 14.0 tpt -102.0 -31.71 10.53 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.777 -0.369 . . . . 0.0 111.372 -178.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.28 44.91 0.7 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.547 -0.835 . . . . 0.0 111.607 -177.37 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -128.99 146.58 50.94 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 177.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 14.9 m -146.22 -164.03 1.88 Allowed 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.915 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 9.1 p-10 -76.33 116.68 17.25 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 172.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 58.9 tt0 -100.96 65.17 1.09 Allowed 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 177.214 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 140.64 -6.07 2.64 Favored Glycine 0 N--CA 1.449 -0.478 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.268 -174.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.79 16.75 55.96 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 121.089 -0.577 . . . . 0.0 112.124 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.683 ' HH2' HG23 ' X' ' 47' ' ' ILE . 58.6 p-90 -93.32 -13.33 28.28 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -174.621 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.915 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 3.7 tp -57.01 -33.62 67.35 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.648 -0.658 . . . . 0.0 112.135 -170.35 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 30' ' ' THR . . . . . 0.5 ' O ' ' HG2' ' X' ' 34' ' ' GLN . 10.4 p -87.89 -10.41 50.77 Favored 'General case' 0 C--O 1.218 -0.599 0 C-N-CA 120.185 -0.606 . . . . 0.0 111.034 175.499 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 31' ' ' ARG . . . . . 0.53 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 20.0 mtp180 -95.6 -56.4 2.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.337 0.589 . . . . 0.0 110.868 -178.328 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -50.46 -53.31 30.69 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.948 -177.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.715 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 9.6 mp -68.31 -47.08 68.53 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -170.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 34' ' ' GLN . . . . . 0.5 ' HG2' ' O ' ' X' ' 30' ' ' THR . 50.0 mm-40 -37.98 -71.27 0.08 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 -172.024 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 33.3 p -60.81 -29.91 69.75 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.802 0.334 . . . . 0.0 111.84 -173.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 36' ' ' LYS . . . . . 0.403 ' HB3' ' HB2' ' X' ' 39' ' ' ASP . 49.8 mttp -88.01 37.07 0.79 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.409 177.898 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 46.37 34.32 2.23 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.352 1.061 . . . . 0.0 112.56 179.169 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.715 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 31.9 m-85 68.57 73.9 0.27 Allowed 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.869 -176.878 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 39' ' ' ASP . . . . . 0.403 ' HB2' ' HB3' ' X' ' 36' ' ' LYS . 35.2 t0 -100.47 125.5 46.78 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.975 -175.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.647 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.95 -13.79 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.625 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.662 169.856 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.63 -37.93 95.58 Favored Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.564 -0.827 . . . . 0.0 112.352 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.08 -18.75 19.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.436 -0.382 . . . . 0.0 111.065 176.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.646 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -70.47 -36.36 73.84 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.498 178.46 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.768 HD12 HD11 ' X' ' 47' ' ' ILE . 7.1 mp -60.7 -36.88 79.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.188 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 45' ' ' ASP . . . . . 0.543 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.1 t70 -51.93 -41.72 62.25 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 123.48 0.487 . . . . 0.0 111.354 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 5.1 p -96.23 -5.81 39.53 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -177.409 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.768 HD11 HD12 ' X' ' 44' ' ' LEU . 14.1 pt -101.95 44.33 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 CA-C-N 118.164 0.438 . . . . 0.0 111.63 174.603 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 79.04 27.1 0.43 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.94 0.896 . . . . 0.0 112.367 174.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 49' ' ' TYR . . . . . 0.543 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 62.3 m-85 -133.46 62.08 1.66 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.882 0.372 . . . . 0.0 110.173 173.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 22.7 m -82.15 47.65 1.15 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.129 0.49 . . . . 0.0 111.248 -178.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -165.38 78.71 0.3 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.346 177.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' X' X ' 52' ' ' HIS . . . . . 0.447 ' NE2' ' HB2' ' X' ' 45' ' ' ASP . 21.9 p80 . . . . . 0 C--O 1.245 0.828 0 CA-C-O 118.457 -0.782 . . . . 0.0 110.582 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.881 0 N-CA-C 112.155 -0.378 . . . . 0.0 112.155 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' X' X ' 2' ' ' SER . . . . . 0.631 ' HB3' ' HA ' ' X' ' 7' ' ' ASP . 21.3 t -118.42 152.25 50.66 Favored Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 -178.602 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 3' ' ' PRO . . . . . 0.422 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 52.4 Cg_exo -52.86 146.02 37.89 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.534 2.156 . . . . 0.0 111.948 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 4' ' ' PRO . . . . . 0.491 ' HA ' HD12 ' X' ' 10' ' ' LEU . 21.1 Cg_exo -69.88 37.5 0.25 Allowed 'Trans proline' 0 CA--C 1.532 0.402 0 C-N-CA 123.172 2.581 . . . . 0.0 114.063 -175.352 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -146.93 13.11 1.13 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.589 0.233 . . . . 0.0 110.64 176.114 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 6' ' ' ALA . . . . . 0.427 ' HA ' HG23 ' X' ' 11' ' ' ILE . . . -179.17 41.62 0.0 OUTLIER 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.554 0.692 . . . . 0.0 109.935 -178.697 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 7' ' ' ASP . . . . . 0.631 ' HA ' ' HB3' ' X' ' 2' ' ' SER . 7.6 t70 -93.94 147.96 34.41 Favored Pre-proline 0 C--N 1.314 -0.974 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 175.133 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 8' ' ' PRO . . . . . 0.455 ' HA ' HD11 ' X' ' 11' ' ' ILE . 85.0 Cg_exo -44.18 -30.32 3.41 Favored 'Trans proline' 0 CA--C 1.532 0.421 0 C-N-CA 122.903 2.402 . . . . 0.0 112.709 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 9' ' ' ARG . . . . . 0.478 ' HB3' ' HD2' ' X' ' 38' ' ' TYR . 80.3 mtm-85 -84.15 -29.49 26.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.514 178.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' X' ' 4' ' ' PRO . 88.1 mt -97.88 -20.71 17.32 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -174.704 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.49 HG12 ' O ' ' X' ' 7' ' ' ASP . 10.7 pt -73.64 -13.41 16.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 168.535 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -95.21 -53.13 3.9 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.629 174.057 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 23.7 t -93.29 -32.22 14.4 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -169.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.412 ' HB2' HD22 ' X' ' 10' ' ' LEU . 8.3 tt -93.28 -40.33 10.48 Favored 'General case' 0 CA--C 1.51 -0.592 0 O-C-N 121.395 -0.816 . . . . 0.0 109.002 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.471 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 10.5 t -70.03 -23.1 63.06 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.494 -176.556 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 16' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' X' ' 20' ' ' MET . 0.0 OUTLIER -65.3 -26.78 68.21 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.249 -179.906 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.709 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 15.9 ptm -99.14 -24.74 14.77 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 121.033 -0.267 . . . . 0.0 110.504 175.677 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 35.7 tp -62.22 -40.73 97.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.752 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 40.3 p -91.4 -25.81 19.18 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.487 -178.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 20' ' ' MET . . . . . 0.401 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 44.5 ttm -73.89 -31.26 63.04 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.499 -0.318 . . . . 0.0 111.148 -176.068 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 104.54 47.12 1.23 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.081 -1.057 . . . . 0.0 112.685 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.709 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 13.9 m-30 -114.27 175.92 5.27 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 175.366 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 23' ' ' SER . . . . . 0.607 ' O ' HG22 ' X' ' 47' ' ' ILE . 12.3 m -145.9 158.64 43.85 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 119.812 -0.755 . . . . 0.0 111.407 -178.174 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 24' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -68.68 133.74 48.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.464 173.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 25' ' ' GLU . . . . . 0.814 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 2.3 tm-20 -91.28 -16.95 26.74 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -175.107 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -170.25 21.1 0.08 OUTLIER Glycine 0 CA--C 1.519 0.32 0 C-N-CA 119.221 -1.466 . . . . 0.0 114.49 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 87.19 24.0 38.77 Favored Glycine 0 C--N 1.32 -0.311 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.402 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.814 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 59.1 p-90 -96.86 -14.65 21.69 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 119.157 -0.449 . . . . 0.0 112.179 -178.468 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.421 ' HA ' ' CE3' ' X' ' 28' ' ' TRP . 26.0 tp -52.33 -24.31 7.34 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -169.789 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 21.8 p -88.65 -61.59 1.68 Allowed 'General case' 0 C--N 1.32 -0.683 0 O-C-N 121.826 -0.546 . . . . 0.0 110.469 169.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 31' ' ' ARG . . . . . 0.73 ' HG2' ' HA ' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -49.37 -56.74 8.56 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -177.482 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' X' X ' 32' ' ' LEU . . . . . 0.603 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 2.5 tm? -54.12 -46.46 72.19 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 122.642 0.377 . . . . 0.0 110.842 -178.243 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.595 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 11.2 mp -70.04 -51.38 32.55 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.454 -178.259 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -44.37 -56.22 4.38 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -176.39 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 61.9 p -75.92 -2.7 31.55 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -175.473 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 36' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' X' ' 39' ' ' ASP . 53.7 mttp -120.59 28.27 8.07 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 40.7 t30 64.02 30.86 13.92 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.737 0.779 . . . . 0.0 110.262 178.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.595 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 8.6 m-30 59.43 63.55 1.53 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.874 -174.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 39' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' X' ' 36' ' ' LYS . 32.2 t70 -95.86 124.83 40.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.871 -173.153 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.817 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -90.44 -6.25 10.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.396 171.769 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.29 -40.81 99.5 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.442 -0.885 . . . . 0.0 111.982 177.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.5 -20.98 16.14 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.173 -0.514 . . . . 0.0 110.906 176.355 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.817 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -66.88 -39.15 87.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.646 178.584 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.854 HD12 HD11 ' X' ' 47' ' ' ILE . 5.7 mp -57.85 -37.02 73.13 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.149 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -49.78 -46.34 50.68 Favored 'General case' 0 CA--C 1.532 0.269 0 O-C-N 123.696 0.623 . . . . 0.0 111.499 178.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -88.21 -21.69 24.41 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -177.63 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.854 HD11 HD12 ' X' ' 44' ' ' LEU . 8.1 pt -88.05 43.3 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 O-C-N 121.757 -0.589 . . . . 0.0 111.639 174.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 48' ' ' GLN . . . . . 0.444 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 1.5 mp0 85.88 38.13 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.526 1.13 . . . . 0.0 112.982 174.223 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 49' ' ' TYR . . . . . 0.561 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 26.6 m-85 -134.61 39.85 3.0 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 170.012 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 6.9 p -80.09 4.47 17.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.318 0.58 . . . . 0.0 111.589 -176.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 27.0 mmtp -111.68 14.56 21.2 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.09 178.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 26.4 t-80 . . . . . 0 C--O 1.246 0.868 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.309 -177.062 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.734 0 N-CA-C 112.213 -0.355 . . . . 0.0 112.213 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 62.5 m -116.63 149.32 43.66 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 122.723 -0.281 . . . . 0.0 110.578 179.441 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 3' ' ' PRO . . . . . 0.435 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 13.4 Cg_exo -68.68 151.06 74.94 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.611 2.208 . . . . 0.0 111.466 179.053 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 4' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 9.3 Cg_exo -72.19 40.77 0.46 Allowed 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 123.207 2.605 . . . . 0.0 112.846 -179.337 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -151.73 13.06 0.62 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.322 176.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -157.09 21.38 0.31 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.252 -178.069 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 7' ' ' ASP . . . . . 0.406 ' O ' HG22 ' X' ' 11' ' ' ILE . 8.3 m-20 -77.75 154.78 80.93 Favored Pre-proline 0 C--O 1.216 -0.669 0 CA-C-N 115.448 -0.797 . . . . 0.0 109.298 176.158 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -46.04 -26.2 3.39 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 122.911 2.407 . . . . 0.0 112.675 177.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 56.0 mtm-85 -92.02 -33.96 14.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.188 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 93.7 mt -98.4 -19.52 17.68 Favored 'General case' 0 C--O 1.219 -0.519 0 O-C-N 122.223 -0.298 . . . . 0.0 111.578 -173.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.573 ' O ' ' HB3' ' X' ' 15' ' ' SER . 10.6 tt -74.08 -15.36 16.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 169.477 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 12' ' ' GLU . . . . . 0.516 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 4.7 tm-20 -94.77 -60.74 1.63 Allowed 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 114.754 -1.112 . . . . 0.0 110.277 175.605 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 36.7 m -89.77 -26.43 20.6 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -170.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 14' ' ' LEU . . . . . . . . . . . . . 7.5 tt -92.88 -40.41 10.63 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.573 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 28.1 t -70.18 -17.09 63.15 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.908 178.07 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 16' ' ' GLN . . . . . 0.516 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 12.7 tm0? -55.24 -50.73 68.71 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.509 178.383 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 17' ' ' MET . . . . . 1.014 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 0.5 OUTLIER -91.18 -23.66 20.17 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.012 179.405 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' X' X ' 18' ' ' LEU . . . . . 0.543 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 24.2 tp -63.49 -40.95 98.43 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.798 0.332 . . . . 0.0 110.805 -178.54 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 12.2 t -99.55 9.38 43.3 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.211 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 20' ' ' MET . . . . . 0.474 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 55.1 tpp -104.5 -31.2 9.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.836 0.351 . . . . 0.0 110.874 -179.31 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 108.9 45.75 1.01 Allowed Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.313 -0.946 . . . . 0.0 111.831 -177.022 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 1.014 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 46.0 m-85 -125.79 178.78 5.51 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 175.162 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 44.8 m -161.39 160.23 29.22 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 176.614 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.669 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 50.2 p-10 -78.39 160.52 27.73 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.374 -0.53 . . . . 0.0 109.89 172.157 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 25' ' ' GLU . . . . . 0.749 ' HG2' ' CD1' ' X' ' 28' ' ' TRP . 18.1 pt-20 -64.05 -20.39 65.9 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.407 178.589 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 144.24 42.56 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.217 -0.992 . . . . 0.0 114.324 174.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 154.95 -16.85 0.54 Allowed Glycine 0 C--N 1.333 0.403 0 C-N-CA 118.39 -1.862 . . . . 0.0 115.389 171.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.936 ' HH2' HG23 ' X' ' 47' ' ' ILE . 43.2 p-90 -87.03 -20.03 27.78 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 118.459 1.13 . . . . 0.0 113.033 -173.807 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.669 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 42.3 tp -55.79 -21.32 18.7 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.15 0.886 . . . . 0.0 111.401 -176.502 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.88 -31.67 17.22 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 175.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 31' ' ' ARG . . . . . 0.675 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -95.15 -52.05 4.37 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 -178.678 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' X' X ' 32' ' ' LEU . . . . . 0.561 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 3.2 tm? -49.83 -51.56 39.05 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.49 0.716 . . . . 0.0 111.535 -177.397 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.698 ' O ' ' HA ' ' X' ' 38' ' ' TYR . 8.0 mp -71.99 -9.03 57.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.751 -177.107 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.7 -38.5 10.78 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.714 0.293 . . . . 0.0 110.775 -179.134 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 9.3 p -75.21 -39.49 60.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.44 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 36' ' ' LYS . . . . . 0.407 ' HG2' ' CB ' ' X' ' 42' ' ' ALA . 5.0 mptp? -78.3 37.92 0.28 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.956 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 41.9 45.92 3.34 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.851 0.86 . . . . 0.0 112.151 -177.526 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.698 ' HA ' ' O ' ' X' ' 33' ' ' LEU . 67.7 m-85 59.78 77.86 0.3 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.312 177.227 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -134.84 138.69 44.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.931 -175.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.65 ' H ' HD13 ' X' ' 40' ' ' ILE . 0.1 OUTLIER -90.14 -9.72 10.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.919 169.294 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.57 -34.41 89.44 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.203 178.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 42' ' ' ALA . . . . . 0.407 ' CB ' ' HG2' ' X' ' 36' ' ' LYS . . . -99.01 -15.29 19.12 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.334 -0.433 . . . . 0.0 110.612 176.295 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.648 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -76.56 -35.84 57.97 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.163 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.507 HD13 ' O ' ' X' ' 40' ' ' ILE . 9.5 mp -69.7 -32.65 71.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.275 177.823 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -60.92 -31.85 71.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.157 177.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 21.8 p -98.01 -33.91 11.0 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -174.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.936 HG23 ' HH2' ' X' ' 28' ' ' TRP . 1.8 pt -65.71 -35.04 74.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 C-N-CA 119.337 -0.945 . . . . 0.0 112.837 -169.688 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 48' ' ' GLN . . . . . 0.431 ' OE1' ' HD1' ' X' ' 22' ' ' PHE . 1.0 OUTLIER -166.89 -34.95 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 120.735 0.302 . . . . 0.0 110.382 179.075 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' X' X ' 49' ' ' TYR . . . . . 0.504 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 52.7 m-85 -74.69 -173.19 1.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.978 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 20.6 p -153.06 16.77 0.56 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.835 0.35 . . . . 0.0 111.343 178.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -150.44 160.83 43.47 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 178.036 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 74.7 t60 . . . . . 0 C--O 1.244 0.79 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.376 175.744 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.894 0 N-CA-C 112.061 -0.416 . . . . 0.0 112.061 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' X' X ' 2' ' ' SER . . . . . 0.451 ' HA ' ' HD3' ' X' ' 3' ' ' PRO . 50.9 m -69.64 128.26 92.17 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 120.868 0.366 . . . . 0.0 110.964 -179.138 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 3' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' X' ' 2' ' ' SER . 14.4 Cg_exo -67.42 163.73 33.51 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.751 2.301 . . . . 0.0 111.484 178.313 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -73.02 37.77 0.39 Allowed 'Trans proline' 0 CA--C 1.533 0.436 0 C-N-CA 122.963 2.442 . . . . 0.0 112.527 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 5' ' ' GLU . . . . . 0.4 ' H ' ' C ' ' X' ' 3' ' ' PRO . 57.5 mm-40 -124.1 7.59 8.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.784 177.341 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -177.09 35.85 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.724 -1.125 . . . . 0.0 109.149 -178.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 7' ' ' ASP . . . . . 0.43 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 32.3 t70 -93.85 144.53 28.28 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 114.86 -1.064 . . . . 0.0 108.34 178.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 8' ' ' PRO . . . . . 0.43 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 93.0 Cg_exo -42.36 -23.66 0.3 Allowed 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.362 2.708 . . . . 0.0 114.054 -178.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 9' ' ' ARG . . . . . 0.469 ' HD3' ' CE2' ' X' ' 38' ' ' TYR . 60.1 mtt85 -87.73 -46.07 9.8 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.719 HD22 ' HB2' ' X' ' 14' ' ' LEU . 74.3 mt -99.41 -11.89 20.73 Favored 'General case' 0 C--O 1.219 -0.504 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -175.463 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.659 ' O ' ' HB3' ' X' ' 15' ' ' SER . 11.2 tt -69.25 -25.65 29.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 121.552 0.691 . . . . 0.0 109.202 176.087 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -96.61 -38.11 10.09 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.661 176.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 32.5 m -96.01 -33.0 12.3 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -172.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.719 ' HB2' HD22 ' X' ' 10' ' ' LEU . 10.1 tt -95.33 -49.0 5.65 Favored 'General case' 0 CA--C 1.508 -0.657 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.659 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 37.2 t -61.42 -31.4 71.33 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 114.426 -1.261 . . . . 0.0 111.403 -177.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -53.47 -55.0 29.04 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.871 0.367 . . . . 0.0 110.22 176.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.744 ' HB3' ' HB2' ' X' ' 22' ' ' PHE . 68.8 mtm -69.23 -39.91 78.24 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.493 -178.419 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.91 -32.5 74.23 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -177.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 20.7 p -86.13 -37.35 18.87 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.852 0.315 . . . . 0.0 111.852 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 13.4 tpt -69.99 -24.95 63.39 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.362 -176.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.9 34.54 1.5 Allowed Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.434 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.744 ' HB2' ' HB3' ' X' ' 17' ' ' MET . 5.6 m-85 -110.58 -176.13 2.9 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 173.056 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 23' ' ' SER . . . . . 0.6 ' O ' HG21 ' X' ' 47' ' ' ILE . 15.3 m -152.47 -149.28 0.29 Allowed 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.392 178.082 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.444 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 12.2 p-10 -122.88 131.78 53.89 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 170.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -115.69 68.05 0.71 Allowed 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.097 -0.641 . . . . 0.0 111.012 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 136.9 5.51 1.89 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.378 -0.915 . . . . 0.0 113.136 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 79.38 7.63 88.34 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.173 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.834 ' HZ2' HG23 ' X' ' 47' ' ' ILE . 46.0 p-90 -79.65 -10.1 59.74 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 111.556 0.206 . . . . 0.0 111.556 -178.435 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.675 HD11 ' HG ' ' X' ' 14' ' ' LEU . 14.5 tp -55.97 -24.65 39.76 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 122.015 -0.428 . . . . 0.0 111.283 -174.818 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 30' ' ' THR . . . . . 0.636 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 20.5 p -94.41 -47.47 6.57 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 122.072 -0.393 . . . . 0.0 110.706 169.605 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 31' ' ' ARG . . . . . 0.448 ' H ' ' HG2' ' X' ' 31' ' ' ARG . 15.6 mmm180 -55.65 -59.78 4.37 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.303 0.641 . . . . 0.0 112.012 -178.16 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 32' ' ' LEU . . . . . 0.535 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 2.8 tm? -55.97 -60.53 3.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.934 -1.03 . . . . 0.0 111.128 -176.118 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.454 HD13 ' O ' ' X' ' 29' ' ' LEU . 9.8 mp -57.32 -45.61 84.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.387 -176.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 34' ' ' GLN . . . . . 0.636 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.3 OUTLIER -49.82 -48.43 50.86 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 123.217 0.323 . . . . 0.0 111.436 179.685 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 14.1 m -67.15 -46.21 74.74 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.171 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -81.74 37.14 0.46 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.682 -179.296 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 5.5 p-10 40.33 49.92 2.6 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.806 0.842 . . . . 0.0 112.387 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.469 ' CE2' ' HD3' ' X' ' 9' ' ' ARG . 79.2 m-85 61.72 67.93 0.73 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.143 177.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -120.6 137.94 54.15 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.82 -177.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.71 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -90.9 -9.8 10.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.432 171.826 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -60.78 -38.43 95.23 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.587 -178.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.51 -15.4 18.68 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.486 -0.357 . . . . 0.0 110.594 175.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.71 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -68.41 -51.33 45.12 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.357 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.464 HD13 ' HB ' ' X' ' 40' ' ' ILE . 11.1 mp -59.52 -28.69 67.29 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.886 0.374 . . . . 0.0 110.913 178.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 45' ' ' ASP . . . . . 0.451 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 37.1 t70 -65.36 -33.09 75.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.797 -179.095 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 5.0 p -95.87 -5.81 40.77 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 -172.051 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.834 HG23 ' HZ2' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -105.03 -27.39 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-N 119.005 0.821 . . . . 0.0 112.522 -179.047 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' X' X ' 48' ' ' GLN . . . . . 0.539 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 0.0 OUTLIER -157.49 -48.84 0.07 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.282 0.563 . . . . 0.0 110.279 179.71 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' X' X ' 49' ' ' TYR . . . . . 0.451 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 48.1 m-85 -82.18 58.47 4.02 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.781 -173.33 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 50.6 m -83.09 -0.64 50.01 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.962 0.887 . . . . 0.0 109.13 171.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' X' X ' 51' ' ' LYS . . . . . 0.466 ' HD3' ' N ' ' X' ' 51' ' ' LYS . 0.2 OUTLIER -141.84 64.62 1.39 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 113.972 -1.467 . . . . 0.0 108.919 175.687 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 28.0 t-80 . . . . . 0 C--O 1.244 0.814 0 CA-C-O 118.351 -0.833 . . . . 0.0 110.76 -173.984 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.888 0 N-CA-C 112.284 -0.326 . . . . 0.0 112.284 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' X' X ' 2' ' ' SER . . . . . 0.514 ' HA ' ' HD3' ' X' ' 3' ' ' PRO . 12.3 m -76.47 120.63 82.5 Favored Pre-proline 0 C--N 1.326 -0.437 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 3' ' ' PRO . . . . . 0.609 ' HG2' HD11 ' X' ' 10' ' ' LEU . 1.1 Cg_endo -86.83 166.44 8.62 Favored 'Trans proline' 0 N--CA 1.455 -0.751 0 C-N-CA 122.976 2.451 . . . . 0.0 111.358 -179.222 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 4' ' ' PRO . . . . . 0.721 ' HB2' ' HB2' ' X' ' 7' ' ' ASP . 44.3 Cg_exo -56.55 155.27 26.75 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.503 2.135 . . . . 0.0 111.947 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -73.91 96.37 2.61 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.015 -173.109 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . 60.64 59.81 2.09 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.707 0.765 . . . . 0.0 109.376 -175.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 7' ' ' ASP . . . . . 0.721 ' HB2' ' HB2' ' X' ' 4' ' ' PRO . 21.5 t70 -75.75 154.32 85.24 Favored Pre-proline 0 C--N 1.318 -0.764 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 176.544 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 8' ' ' PRO . . . . . 0.588 ' HD2' ' CG ' ' X' ' 7' ' ' ASP . 71.1 Cg_exo -39.07 -25.41 0.1 Allowed 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 123.233 2.622 . . . . 0.0 113.627 -178.454 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 9' ' ' ARG . . . . . 0.529 ' HD3' ' OD2' ' X' ' 7' ' ' ASP . 5.6 mtp180 -77.11 -48.11 18.64 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 176.054 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.609 HD11 ' HG2' ' X' ' 3' ' ' PRO . 79.6 mt -92.05 -26.4 18.34 Favored 'General case' 0 C--O 1.217 -0.608 0 O-C-N 122.254 -0.279 . . . . 0.0 111.672 -175.03 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.525 ' O ' ' HB3' ' X' ' 15' ' ' SER . 12.7 tt -69.69 -15.32 19.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 173.065 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -91.8 -58.4 2.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.001 174.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 50.2 m -90.86 -29.96 17.22 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -169.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.407 ' O ' ' HG3' ' X' ' 17' ' ' MET . 5.2 tt -94.52 -45.05 7.58 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 -179.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.525 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 19.3 t -64.77 -25.73 68.05 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.8 -175.763 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 16' ' ' GLN . . . . . 0.669 ' O ' ' HB2' ' X' ' 20' ' ' MET . 5.2 pp0? -65.96 -24.31 66.78 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 120.952 -0.299 . . . . 0.0 111.562 -179.549 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.528 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 4.6 ppp? -101.52 -27.38 13.14 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.775 0.322 . . . . 0.0 110.564 176.19 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 24.7 tp -65.93 -43.29 88.52 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.983 -179.123 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 29.6 t -96.84 8.82 43.5 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.09 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 20' ' ' MET . . . . . 0.669 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 10.3 tpt -100.36 -31.42 11.34 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.972 0.415 . . . . 0.0 110.561 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.11 42.1 2.88 Favored Glycine 0 N--CA 1.447 -0.611 0 N-CA-C 111.058 -0.817 . . . . 0.0 111.058 -174.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.528 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 11.4 m-30 -115.76 171.23 7.88 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 23' ' ' SER . . . . . 0.477 ' O ' HG22 ' X' ' 47' ' ' ILE . 32.4 m -153.35 161.95 41.79 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.605 177.059 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.505 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 15.6 p30 -68.54 136.95 53.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.124 0.487 . . . . 0.0 110.389 174.721 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 25' ' ' GLU . . . . . 0.684 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 38.5 tt0 -61.54 -19.45 62.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.366 -0.833 . . . . 0.0 111.22 -176.166 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -149.69 -64.68 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.677 176.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 27' ' ' GLY . . . . . 0.484 ' HA2' ' OD2' ' X' ' 24' ' ' ASP . . . 179.52 32.9 0.06 OUTLIER Glycine 0 CA--C 1.506 -0.531 0 N-CA-C 110.755 -0.938 . . . . 0.0 110.755 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.754 ' HH2' HG23 ' X' ' 47' ' ' ILE . 40.5 p-90 -96.83 -4.02 41.09 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -172.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.505 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 20.9 tp -59.11 -24.08 62.67 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.746 -0.596 . . . . 0.0 112.058 -170.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 30' ' ' THR . . . . . 0.407 ' HA ' ' OE1' ' X' ' 34' ' ' GLN . 6.7 m -95.05 -11.88 27.57 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 121.368 0.604 . . . . 0.0 111.074 174.03 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -95.66 -54.84 3.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.727 -177.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -61.37 -61.04 2.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.105 -177.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.631 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 7.8 mp -60.37 -60.75 3.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.254 -172.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 34' ' ' GLN . . . . . 0.407 ' OE1' ' HA ' ' X' ' 30' ' ' THR . 12.2 mp0 -46.45 -43.01 16.21 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -173.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 40.2 p -76.9 -12.17 59.92 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 -176.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -118.69 32.97 5.85 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.624 0.231 . . . . 0.0 111.624 -177.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 45.9 t30 60.37 40.71 17.14 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.43 0.634 . . . . 0.0 110.513 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.631 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 18.1 m-85 55.86 61.03 2.96 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.649 -179.293 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -86.06 118.19 25.37 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.471 -173.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.689 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.3 OUTLIER -90.53 -4.34 10.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.37 173.72 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' X' X ' 41' ' ' GLY . . . . . 0.41 ' HA2' ' CE1' ' X' ' 52' ' ' HIS . . . -66.92 -39.96 93.43 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 120.589 -0.815 . . . . 0.0 111.73 176.394 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.16 -25.86 14.39 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.07 -0.565 . . . . 0.0 111.11 178.154 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.689 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -65.01 -41.81 95.02 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.899 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.746 HD12 HD11 ' X' ' 47' ' ' ILE . 7.1 mp -65.34 -33.73 76.67 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.381 -178.419 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 45' ' ' ASP . . . . . 0.636 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.4 t70 -58.43 -39.34 79.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.018 0.437 . . . . 0.0 110.554 178.053 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 8.8 p -94.83 -6.38 42.96 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -177.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.754 HG23 ' HH2' ' X' ' 28' ' ' TRP . 13.0 pt -100.72 42.93 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 O-C-N 121.703 -0.623 . . . . 0.0 111.382 174.138 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 48' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 0.9 OUTLIER 89.49 -6.93 0.41 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.798 1.239 . . . . 0.0 113.318 173.988 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' X' X ' 49' ' ' TYR . . . . . 0.636 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 6.9 m-85 -112.26 73.33 0.81 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.944 -0.472 . . . . 0.0 111.59 178.731 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 21.3 m -78.72 11.29 2.66 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.072 0.463 . . . . 0.0 111.344 177.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -121.95 79.39 1.57 Allowed 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 172.198 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' X' X ' 52' ' ' HIS . . . . . 0.41 ' CE1' ' HA2' ' X' ' 41' ' ' GLY . 13.5 t-160 . . . . . 0 C--O 1.241 0.626 0 CA-C-O 118.498 -0.763 . . . . 0.0 109.773 -176.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.815 0 N-CA-C 112.176 -0.37 . . . . 0.0 112.176 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 66.5 m -86.31 123.02 72.02 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 122.785 -0.244 . . . . 0.0 110.427 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 3' ' ' PRO . . . . . 0.535 ' HG2' ' HB3' ' X' ' 6' ' ' ALA . 28.1 Cg_endo -63.08 145.39 93.93 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.325 2.016 . . . . 0.0 111.913 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.7 34.23 0.38 Allowed 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.812 2.341 . . . . 0.0 112.438 179.17 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 5' ' ' GLU . . . . . 0.412 ' H ' ' C ' ' X' ' 3' ' ' PRO . 48.2 mt-10 -146.39 15.2 1.28 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.525 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 6' ' ' ALA . . . . . 0.535 ' HB3' ' HG2' ' X' ' 3' ' ' PRO . . . -169.55 51.05 0.04 OUTLIER 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 -177.537 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 7' ' ' ASP . . . . . 0.486 ' O ' HG12 ' X' ' 11' ' ' ILE . 9.0 t70 -108.34 150.22 40.29 Favored Pre-proline 0 C--N 1.316 -0.871 0 CA-C-N 114.15 -1.387 . . . . 0.0 107.416 -177.399 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 8' ' ' PRO . . . . . 0.452 ' HD2' ' CG ' ' X' ' 7' ' ' ASP . 94.8 Cg_exo -42.76 -31.99 2.32 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.906 2.404 . . . . 0.0 113.25 -177.531 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 9' ' ' ARG . . . . . 0.508 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 69.1 mtp180 -78.08 -26.56 48.21 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 178.735 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.717 HD22 ' HB2' ' X' ' 14' ' ' LEU . 56.5 mt -97.67 -22.3 16.54 Favored 'General case' 0 C--O 1.221 -0.421 0 C-N-CA 122.283 0.233 . . . . 0.0 110.788 177.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.554 ' O ' ' HB3' ' X' ' 15' ' ' SER . 43.5 mm -66.86 -13.86 17.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 108.617 -0.882 . . . . 0.0 108.617 171.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -93.73 -64.19 1.11 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.66 -1.155 . . . . 0.0 111.1 171.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 13' ' ' SER . . . . . 0.527 ' O ' ' HE2' ' X' ' 17' ' ' MET . 15.9 m -86.92 -25.65 24.29 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -168.627 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.717 ' HB2' HD22 ' X' ' 10' ' ' LEU . 60.5 tp -93.37 -43.96 8.52 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.554 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 46.3 t -63.23 -26.75 68.93 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.173 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 19.9 tm0? -57.05 -47.92 79.78 Favored 'General case' 0 N--CA 1.461 0.089 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 174.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.618 ' HB3' ' O ' ' X' ' 22' ' ' PHE . 59.1 mtm -75.79 -43.99 43.59 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.204 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 28.9 tp -57.72 -32.86 67.83 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 123.4 0.437 . . . . 0.0 111.578 -177.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 46.8 t -88.07 -30.93 19.53 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.576 -178.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 20' ' ' MET . . . . . 0.451 ' HB3' ' CE1' ' X' ' 22' ' ' PHE . 15.0 tpt -80.6 -31.51 36.69 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -176.319 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.43 24.57 4.37 Favored Glycine 0 CA--C 1.52 0.371 0 C-N-CA 119.976 -1.107 . . . . 0.0 113.939 176.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.618 ' O ' ' HB3' ' X' ' 17' ' ' MET . 0.0 OUTLIER -138.61 167.09 22.7 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 171.136 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 36.6 m -158.59 -91.57 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 119.971 -0.692 . . . . 0.0 111.926 -175.466 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.442 ' CG ' ' H ' ' X' ' 27' ' ' GLY . 56.2 t0 -119.17 122.92 43.11 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.297 -176.22 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 25' ' ' GLU . . . . . 0.799 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 54.8 tt0 -61.44 -29.45 69.95 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.249 176.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 155.84 40.33 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 119.567 -1.301 . . . . 0.0 115.294 173.032 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 27' ' ' GLY . . . . . 0.442 ' H ' ' CG ' ' X' ' 24' ' ' ASP . . . 146.09 -14.81 1.7 Allowed Glycine 0 C--N 1.332 0.342 0 C-N-CA 119.178 -1.487 . . . . 0.0 114.724 171.037 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.871 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 56.8 p-90 -96.2 -14.73 22.51 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 117.81 0.805 . . . . 0.0 113.041 -173.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.44 ' HA ' ' CE3' ' X' ' 28' ' ' TRP . 38.8 tp -54.76 -34.72 62.94 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.864 -0.523 . . . . 0.0 112.392 -170.261 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 30' ' ' THR . . . . . 0.547 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 80.3 p -85.5 -16.45 39.52 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 122.167 -0.333 . . . . 0.0 111.273 177.708 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 13.7 mtm105 -95.37 -52.6 4.09 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.971 0.415 . . . . 0.0 111.216 -176.262 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -52.07 -70.34 0.09 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.241 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.584 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 7.0 mp -58.43 -45.51 88.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.992 -175.425 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 34' ' ' GLN . . . . . 0.547 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.7 OUTLIER -53.23 -38.99 63.44 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -174.231 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 40.5 p -94.37 -2.34 52.23 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.837 0.351 . . . . 0.0 111.938 -177.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -118.29 38.05 3.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.9 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 41.64 45.12 2.86 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.744 0.817 . . . . 0.0 111.928 -176.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.584 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 53.1 m-85 60.05 78.01 0.29 Allowed 'General case' 0 C--O 1.233 0.209 0 CA-C-N 114.873 -1.058 . . . . 0.0 111.382 178.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -97.86 120.96 39.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.704 -177.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.529 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.12 -19.96 7.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 172.029 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.18 -46.37 91.15 Favored Glycine 0 N--CA 1.441 -0.973 0 C-N-CA 120.493 -0.86 . . . . 0.0 112.277 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -83.81 -22.05 31.91 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.475 -0.362 . . . . 0.0 111.002 178.08 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.711 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -68.91 -47.4 65.9 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.944 178.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.529 HD13 ' O ' ' X' ' 40' ' ' ILE . 10.8 mp -67.36 -29.12 68.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.03 -179.417 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 45' ' ' ASP . . . . . 0.748 ' OD1' ' HA ' ' X' ' 50' ' ' SER . 47.7 t0 -65.13 -28.45 69.43 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 121.284 0.564 . . . . 0.0 110.897 178.521 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 7.6 p -96.08 -32.69 12.41 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -175.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.871 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 0.9 OUTLIER -83.36 -29.43 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -173.137 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' X' X ' 48' ' ' GLN . . . . . 0.565 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.3 mt-30 -164.04 -35.9 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 -177.716 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 49' ' ' TYR . . . . . 0.513 ' CE2' ' HE2' ' X' ' 22' ' ' PHE . 37.4 m-85 -91.73 -167.44 1.78 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.809 0.338 . . . . 0.0 110.707 -177.06 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 50' ' ' SER . . . . . 0.748 ' HA ' ' OD1' ' X' ' 45' ' ' ASP . 68.3 m -155.28 35.54 0.38 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.731 178.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -126.49 89.51 3.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.263 178.475 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.88 0 CA-C-O 118.57 -0.729 . . . . 0.0 111.004 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.004 0 N-CA-C 112.128 -0.389 . . . . 0.0 112.128 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 18.0 m -80.21 135.39 54.36 Favored Pre-proline 0 C--N 1.326 -0.422 0 N-CA-C 110.448 -0.205 . . . . 0.0 110.448 179.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 3' ' ' PRO . . . . . 0.502 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 33.8 Cg_exo -60.56 118.38 5.24 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.571 2.181 . . . . 0.0 112.119 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 4' ' ' PRO . . . . . 0.502 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 3.1 Cg_exo -77.18 42.64 1.16 Allowed 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 123.162 2.574 . . . . 0.0 112.911 -177.451 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -142.56 10.99 1.87 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.707 0.289 . . . . 0.0 110.949 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -174.29 44.0 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -178.018 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -106.94 142.19 24.47 Favored Pre-proline 0 C--N 1.314 -0.955 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 -179.097 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -44.96 -20.88 0.43 Allowed 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.152 2.568 . . . . 0.0 113.325 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 87.8 mtm-85 -92.56 -37.73 12.31 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 122.901 0.48 . . . . 0.0 112.11 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.738 HD23 ' HB2' ' X' ' 13' ' ' SER . 36.7 mt -98.84 -10.66 22.63 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -175.814 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.698 ' O ' ' HB2' ' X' ' 15' ' ' SER . 12.6 tt -68.1 -21.91 27.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 175.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -95.62 -26.22 15.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.847 170.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 13' ' ' SER . . . . . 0.738 ' HB2' HD23 ' X' ' 10' ' ' LEU . 20.3 m -96.65 -48.51 5.48 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -171.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.538 ' HB2' HD22 ' X' ' 10' ' ' LEU . 2.4 tm? -93.11 -44.13 8.52 Favored 'General case' 0 CA--C 1.507 -0.709 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 -179.508 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.698 ' HB2' ' O ' ' X' ' 11' ' ' ILE . 18.9 m -64.67 -17.83 64.42 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.277 -176.541 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.28 -28.44 47.6 Favored 'General case' 0 N--CA 1.461 0.117 0 C-N-CA 120.557 -0.457 . . . . 0.0 111.091 177.288 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 17' ' ' MET . . . . . 1.046 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 23.0 ptp -94.16 -26.53 16.65 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.588 178.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 36.8 tp -57.46 -40.18 77.94 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.459 -179.329 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 25.6 m -70.8 -37.76 73.28 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -177.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -84.66 -26.24 27.93 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 111.895 0.331 . . . . 0.0 111.895 -174.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.69 46.15 0.86 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.318 -0.944 . . . . 0.0 112.277 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 1.046 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 6.5 m-85 -127.36 146.46 50.45 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 175.355 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 58.6 m -151.51 -116.89 0.04 OUTLIER 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.784 -175.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.681 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.4 p30 -122.47 142.89 50.09 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.182 172.561 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 25' ' ' GLU . . . . . 0.762 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 29.5 tt0 -67.58 -50.61 57.53 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.582 0.706 . . . . 0.0 110.054 177.225 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -133.77 -3.61 3.25 Favored Glycine 0 C--N 1.319 -0.372 0 CA-C-N 114.978 -1.01 . . . . 0.0 112.855 -178.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.05 12.16 3.66 Favored Glycine 0 C--N 1.33 0.205 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.739 178.19 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.774 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 28.2 p-90 -80.35 -6.96 58.82 Favored 'General case' 0 C--O 1.22 -0.453 0 N-CA-C 111.998 0.369 . . . . 0.0 111.998 -178.833 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.681 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 15.0 tp -56.6 -32.37 65.19 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.934 0.397 . . . . 0.0 111.627 -173.74 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 30' ' ' THR . . . . . 0.497 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 35.1 p -82.3 -19.97 38.38 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.341 176.43 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 31' ' ' ARG . . . . . 0.602 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 8.8 mtm180 -95.24 -57.03 2.53 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.694 -175.113 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -51.35 -62.35 1.67 Allowed 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.608 0.763 . . . . 0.0 111.157 -177.209 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.841 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 7.3 mp -60.62 -45.48 93.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.243 -176.558 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 34' ' ' GLN . . . . . 0.497 ' HB2' ' O ' ' X' ' 30' ' ' THR . 33.8 tp60 -39.15 -61.21 0.79 Allowed 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -175.489 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 26.7 p -85.3 -2.82 58.49 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -174.416 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -108.3 28.73 8.03 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 122.202 -0.311 . . . . 0.0 111.274 177.761 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 48.0 t30 60.31 42.7 14.57 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.09 0.471 . . . . 0.0 110.866 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.841 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 89.4 m-85 53.55 58.61 5.01 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.562 0.696 . . . . 0.0 110.177 -178.067 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -77.01 117.1 18.26 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.448 -1.251 . . . . 0.0 111.428 -172.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.634 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.78 -5.11 10.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.109 0.481 . . . . 0.0 110.291 170.958 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -80.28 -36.48 23.91 Favored Glycine 0 N--CA 1.439 -1.117 0 C-N-CA 120.476 -0.869 . . . . 0.0 111.52 178.119 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.56 -20.49 18.96 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.182 -0.509 . . . . 0.0 111.273 178.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.659 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -65.27 -45.01 86.19 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.019 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.634 HD13 ' O ' ' X' ' 40' ' ' ILE . 11.0 mp -66.26 -29.34 69.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.644 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 45' ' ' ASP . . . . . 0.557 ' OD1' ' HA ' ' X' ' 50' ' ' SER . 17.6 t70 -63.66 -29.5 70.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.281 176.612 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 3.6 p -98.04 -16.16 19.73 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -175.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.774 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 0.4 OUTLIER -94.06 -30.61 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 119.431 -0.908 . . . . 0.0 113.17 -176.292 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' X' X ' 48' ' ' GLN . . . . . 0.463 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.7 mp0 -161.22 -42.58 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.968 0.413 . . . . 0.0 110.966 -178.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 49' ' ' TYR . . . . . 0.432 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 60.0 m-85 -73.16 -175.08 1.73 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.639 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 50' ' ' SER . . . . . 0.557 ' HA ' ' OD1' ' X' ' 45' ' ' ASP . 0.4 OUTLIER -169.29 86.43 0.15 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.76 175.384 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' X' X ' 51' ' ' LYS . . . . . 0.437 ' HB2' ' O ' ' X' ' 50' ' ' SER . 74.4 mmtt 83.82 62.57 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 O-C-N 124.339 1.024 . . . . 0.0 110.338 -177.344 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 . . . . . 0 C--O 1.245 0.829 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.852 179.721 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' X' X ' 1' ' ' GLY . . . . . 0.47 ' O ' ' HD3' ' X' ' 3' ' ' PRO . . . . . . . . 0 N--CA 1.484 1.835 0 N-CA-C 112.022 -0.431 . . . . 0.0 112.022 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' X' X ' 2' ' ' SER . . . . . 0.46 ' HB3' ' OD1' ' X' ' 7' ' ' ASP . 14.2 m -107.24 98.24 21.9 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-O 120.6 0.238 . . . . 0.0 110.388 178.562 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 3' ' ' PRO . . . . . 0.47 ' HD3' ' O ' ' X' ' 1' ' ' GLY . 3.9 Cg_exo -77.36 144.95 23.46 Favored 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 122.664 2.243 . . . . 0.0 111.853 -178.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.42 35.65 0.4 Allowed 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 122.819 2.346 . . . . 0.0 112.793 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' X' X ' 5' ' ' GLU . . . . . 0.402 ' H ' ' C ' ' X' ' 3' ' ' PRO . 21.7 tt0 -162.32 23.45 0.1 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.19 178.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . 179.11 28.63 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.457 -178.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' X' X ' 7' ' ' ASP . . . . . 0.534 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 28.9 t70 -81.7 147.22 58.42 Favored Pre-proline 0 C--N 1.318 -0.771 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 176.535 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 8' ' ' PRO . . . . . 0.534 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 83.9 Cg_exo -47.06 -24.92 3.68 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.07 1.847 . . . . 0.0 112.849 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 77.8 mtm-85 -94.17 -28.46 15.64 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.501 HD22 ' HB2' ' X' ' 14' ' ' LEU . 50.2 mt -97.95 -16.97 19.48 Favored 'General case' 0 CA--C 1.514 -0.42 0 O-C-N 122.14 -0.35 . . . . 0.0 111.284 -177.175 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.536 ' HA ' ' HB2' ' X' ' 15' ' ' SER . 14.2 tt -73.02 -8.77 12.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 172.492 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 12' ' ' GLU . . . . . 0.546 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 45.8 mt-10 -93.65 -62.61 1.33 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.637 -1.165 . . . . 0.0 110.754 173.318 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 11.0 m -90.05 -27.93 19.38 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -168.363 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.501 ' HB2' HD22 ' X' ' 10' ' ' LEU . 9.5 tt -94.28 -44.39 7.97 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.536 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 12.9 t -66.71 -18.95 65.64 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.125 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 16' ' ' GLN . . . . . 0.546 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 18.8 tm0? -64.03 -44.27 93.03 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 175.239 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.614 ' SD ' HD13 ' X' ' 29' ' ' LEU . 62.1 mtt -69.86 -38.35 76.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.606 178.139 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 18' ' ' LEU . . . . . 0.437 ' HB2' ' HA ' ' X' ' 15' ' ' SER . 7.9 mp -62.12 -32.5 73.08 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.499 178.233 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 37.2 t -80.6 -44.35 19.08 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.331 -178.012 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 26.2 mmt -78.66 -32.21 47.07 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -175.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.6 46.86 0.82 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.363 -0.922 . . . . 0.0 112.124 -178.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -128.52 162.97 25.98 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 177.418 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 44.8 m -139.78 -143.25 0.16 Allowed 'General case' 0 C--N 1.315 -0.91 0 C-N-CA 120.576 -0.45 . . . . 0.0 109.789 178.33 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.715 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 21.8 p-10 -99.72 128.23 45.82 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.94 0.4 . . . . 0.0 110.272 173.395 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 25' ' ' GLU . . . . . 0.816 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 42.9 tp10 -83.71 56.99 3.86 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.751 0.786 . . . . 0.0 109.223 176.229 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 133.31 -87.33 0.27 Allowed Glycine 0 N--CA 1.446 -0.686 0 CA-C-N 114.827 -1.079 . . . . 0.0 111.476 -174.416 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -172.27 29.28 0.11 Allowed Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 121.041 -0.599 . . . . 0.0 111.741 177.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.824 ' HH2' HG23 ' X' ' 47' ' ' ILE . 53.3 p-90 -95.92 -9.66 30.74 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 -176.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.715 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 10.6 tp -59.69 -19.96 53.15 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 121.826 -0.546 . . . . 0.0 110.761 -175.663 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 30' ' ' THR . . . . . 0.649 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 38.7 p -93.83 -48.03 6.48 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 121.993 -0.442 . . . . 0.0 110.624 169.79 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 42.7 mmm-85 -63.71 -61.22 2.45 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.287 -176.367 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' X' X ' 32' ' ' LEU . . . . . 0.645 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 2.0 tm? -50.33 -52.38 37.31 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.84 -178.276 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.424 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 62.3 mt -61.06 -62.01 2.16 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.305 -179.514 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 34' ' ' GLN . . . . . 0.649 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.0 OUTLIER -42.8 -54.69 4.0 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -175.966 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 29.6 p -68.39 -24.74 64.81 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -175.089 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 61.0 mttm -105.19 37.4 2.2 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.978 178.519 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 42.05 41.86 2.16 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.715 0.806 . . . . 0.0 112.841 -178.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.424 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 74.3 m-85 65.96 66.22 0.5 Allowed 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.033 177.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -104.25 120.18 40.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.257 -179.238 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.765 ' HB ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.26 -3.6 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.155 173.719 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.8 -41.01 97.76 Favored Glycine 0 N--CA 1.443 -0.878 0 C-N-CA 120.402 -0.904 . . . . 0.0 111.961 177.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.99 -20.27 16.84 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.156 -0.522 . . . . 0.0 111.18 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.698 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -74.33 -31.71 62.54 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.011 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.765 HD13 ' HB ' ' X' ' 40' ' ' ILE . 6.5 mp -75.43 -19.15 59.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.199 179.428 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 45' ' ' ASP . . . . . 0.544 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.5 t70 -70.33 -27.14 64.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.87 0.367 . . . . 0.0 110.502 177.287 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 17.9 p -95.83 -23.44 16.92 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.824 HG23 ' HH2' ' X' ' 28' ' ' TRP . 2.4 pp -84.09 42.55 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 178.336 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 84.67 7.55 0.5 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.164 0.985 . . . . 0.0 112.801 172.552 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' X' X ' 49' ' ' TYR . . . . . 0.544 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 15.9 m-85 -122.36 68.57 0.95 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.082 0.468 . . . . 0.0 110.944 176.051 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 14.2 m -81.13 43.63 0.72 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.147 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -127.14 92.06 3.45 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 . . . . . 0 C--O 1.244 0.774 0 CA-C-O 118.584 -0.722 . . . . 0.0 109.82 -177.529 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.959 0 N-CA-C 112.013 -0.435 . . . . 0.0 112.013 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' X' X ' 2' ' ' SER . . . . . 0.491 ' HA ' ' HD3' ' X' ' 3' ' ' PRO . 27.2 m -81.13 115.58 57.11 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.742 0.306 . . . . 0.0 110.974 -178.087 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 3' ' ' PRO . . . . . 0.491 ' HD3' ' HA ' ' X' ' 2' ' ' SER . 2.9 Cg_exo -78.13 151.97 27.33 Favored 'Trans proline' 0 N--CA 1.463 -0.272 0 C-N-CA 123.106 2.537 . . . . 0.0 112.296 -178.241 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -75.63 38.12 0.55 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.825 2.35 . . . . 0.0 112.313 177.139 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -153.48 15.24 0.51 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.106 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -162.78 24.72 0.1 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.868 -179.292 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -78.36 147.3 72.05 Favored Pre-proline 0 C--O 1.216 -0.678 0 CA-C-N 114.462 -1.245 . . . . 0.0 108.17 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -44.99 -23.14 0.85 Allowed 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 122.728 2.285 . . . . 0.0 113.272 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' X' X ' 9' ' ' ARG . . . . . 0.646 ' HD2' ' CE2' ' X' ' 38' ' ' TYR . 78.3 mtm180 -93.2 -33.93 13.8 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.996 -0.547 . . . . 0.0 112.315 -179.583 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.493 HD22 ' HB2' ' X' ' 14' ' ' LEU . 83.8 mt -97.82 -19.02 18.41 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 122.212 -0.305 . . . . 0.0 111.019 -176.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.421 ' O ' HD13 ' X' ' 11' ' ' ILE . 0.3 OUTLIER -75.54 -9.9 13.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 170.826 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -96.44 -58.28 2.1 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.549 171.079 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' X' X ' 13' ' ' SER . . . . . 0.426 ' HA ' HG23 ' X' ' 40' ' ' ILE . 45.9 t -96.35 -24.9 15.95 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 -167.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.493 ' HB2' HD22 ' X' ' 10' ' ' LEU . 9.8 tt -95.77 -43.87 7.68 Favored 'General case' 0 CA--C 1.508 -0.659 0 CA-C-N 118.997 0.817 . . . . 0.0 109.823 -176.566 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.601 ' HA ' ' HB3' ' X' ' 18' ' ' LEU . 61.4 p -74.91 -9.78 58.87 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.968 -178.476 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 5.1 tm0? -57.45 -60.54 3.5 Favored 'General case' 0 C--N 1.339 0.111 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 174.519 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.843 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 0.6 OUTLIER -73.77 -29.08 61.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.654 178.614 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' X' X ' 18' ' ' LEU . . . . . 0.601 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 26.4 tp -61.77 -30.97 71.15 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.504 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 23.1 t -97.42 -34.18 11.13 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 120.586 0.231 . . . . 0.0 111.254 -177.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 81.1 mtp -79.61 -12.88 59.82 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -176.373 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.68 42.1 3.21 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.272 -0.966 . . . . 0.0 113.264 176.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.843 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 46.0 m-85 -129.16 161.13 30.81 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 174.448 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 55.0 m -139.77 -177.83 5.14 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.707 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.568 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 6.2 p-10 -77.12 115.85 17.26 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.293 0.568 . . . . 0.0 109.983 175.347 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -86.11 59.68 5.78 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.117 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.73 -4.68 2.21 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.27 -0.967 . . . . 0.0 113.189 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' X' X ' 27' ' ' GLY . . . . . 0.404 ' HA2' ' OD2' ' X' ' 24' ' ' ASP . . . 86.09 21.04 53.95 Favored Glycine 0 N--CA 1.445 -0.744 0 C-N-CA 120.44 -0.886 . . . . 0.0 111.546 -177.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.615 ' HH2' HG23 ' X' ' 47' ' ' ILE . 46.2 p-90 -84.85 -10.74 56.84 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-O 119.625 -0.226 . . . . 0.0 111.432 -179.309 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.568 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 48.5 tp -59.01 -28.27 66.24 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.896 -0.503 . . . . 0.0 111.785 -170.028 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 28.9 m -94.37 -11.08 30.66 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 120.948 0.404 . . . . 0.0 111.118 174.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' X' X ' 31' ' ' ARG . . . . . 0.553 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 5.0 mtp-105 -96.04 -53.12 3.77 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.148 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 8.8 tp -64.85 -77.54 0.06 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.867 0.692 . . . . 0.0 112.867 -172.126 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.754 ' HA ' ' HB2' ' X' ' 36' ' ' LYS . 1.6 pp -69.4 -16.93 63.61 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -171.278 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 34' ' ' GLN . . . . . 0.456 ' N ' HD12 ' X' ' 33' ' ' LEU . 25.9 tp60 -64.33 -33.75 76.57 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.5 0.191 . . . . 0.0 110.98 178.156 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 78.1 p -95.69 -16.88 21.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.972 0.415 . . . . 0.0 110.383 175.703 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' X' X ' 36' ' ' LYS . . . . . 0.754 ' HB2' ' HA ' ' X' ' 33' ' ' LEU . 43.9 mttp -87.81 38.71 0.85 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.603 177.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 43.73 40.08 2.85 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.842 0.857 . . . . 0.0 112.953 -178.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.646 ' CE2' ' HD2' ' X' ' 9' ' ' ARG . 72.8 m-85 58.74 71.35 0.59 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.713 173.368 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -125.59 142.43 51.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.736 0.779 . . . . 0.0 112.705 -179.168 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.806 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.1 OUTLIER -91.39 -3.98 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.27 173.594 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.12 -42.96 97.85 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.967 -178.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -94.17 -23.73 17.8 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.272 -0.464 . . . . 0.0 110.549 175.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.806 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -66.53 -32.57 74.0 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.093 178.355 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.608 HD12 HD11 ' X' ' 47' ' ' ILE . 3.3 tp -66.24 -35.87 81.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.236 0.541 . . . . 0.0 110.616 -179.513 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 45' ' ' ASP . . . . . 0.552 ' OD1' ' HA ' ' X' ' 50' ' ' SER . 18.9 t70 -69.1 -34.27 74.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.019 178.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 44.9 p -91.63 -24.31 19.58 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -174.618 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.615 HG23 ' HH2' ' X' ' 28' ' ' TRP . 5.7 pt -72.19 -26.14 24.49 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 119.886 -0.726 . . . . 0.0 111.504 -176.444 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -173.94 -45.37 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 O-C-N 123.12 0.262 . . . . 0.0 111.081 178.679 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 49' ' ' TYR . . . . . 0.546 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 51.9 m-85 -84.47 76.25 10.17 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -173.79 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 50' ' ' SER . . . . . 0.552 ' HA ' ' OD1' ' X' ' 45' ' ' ASP . 26.0 m -87.73 9.6 21.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.33 0.586 . . . . 0.0 110.608 175.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' X' X ' 51' ' ' LYS . . . . . 0.426 ' O ' ' HD2' ' X' ' 51' ' ' LYS . 0.0 OUTLIER -146.92 122.55 10.48 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.575 175.07 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 80.9 m-70 . . . . . 0 C--O 1.245 0.835 0 CA-C-O 118.302 -0.856 . . . . 0.0 110.469 -175.571 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.889 0 N-CA-C 112.082 -0.407 . . . . 0.0 112.082 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 29.6 m -125.33 110.15 26.46 Favored Pre-proline 0 C--N 1.328 -0.334 0 O-C-N 122.68 -0.306 . . . . 0.0 111.445 -179.076 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 3' ' ' PRO . . . . . 0.498 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 7.5 Cg_exo -69.04 137.24 37.06 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.695 2.264 . . . . 0.0 110.95 175.545 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' X' X ' 4' ' ' PRO . . . . . 0.498 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 16.4 Cg_exo -71.07 17.2 0.27 Allowed 'Trans proline' 0 N--CA 1.475 0.411 0 C-N-CA 122.935 2.423 . . . . 0.0 114.081 -175.017 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -139.31 15.93 2.59 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.476 0.655 . . . . 0.0 109.687 173.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -162.64 46.55 0.15 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.843 -1.071 . . . . 0.0 108.726 178.342 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 7' ' ' ASP . . . . . 0.552 ' HB2' ' H ' ' X' ' 10' ' ' LEU . 2.9 m-20 -71.26 156.05 92.23 Favored Pre-proline 0 CA--C 1.505 -0.77 0 CA-C-N 114.895 -1.048 . . . . 0.0 108.622 178.791 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -58.44 -12.26 13.27 Favored 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 121.084 1.189 . . . . 0.0 110.489 169.102 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 37.3 mtp85 -93.34 -43.04 8.98 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 114.784 -1.098 . . . . 0.0 111.551 174.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.625 HD22 ' HB2' ' X' ' 14' ' ' LEU . 32.0 mt -88.13 -21.94 24.37 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -173.709 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.492 ' O ' ' HB3' ' X' ' 15' ' ' SER . 15.1 tt -69.52 -17.12 21.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 172.528 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 50.9 mm-40 -95.05 -64.95 1.01 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.684 173.114 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 13.2 m -81.6 -26.55 34.8 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -169.139 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.625 ' HB2' HD22 ' X' ' 10' ' ' LEU . 0.2 OUTLIER -94.98 -49.32 5.6 Favored 'General case' 0 CA--C 1.506 -0.741 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 -179.823 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.492 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 21.9 t -62.59 -27.03 68.91 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.521 -176.639 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' X' X ' 16' ' ' GLN . . . . . 0.408 ' O ' ' HB2' ' X' ' 20' ' ' MET . 4.7 tm0? -51.14 -49.24 61.23 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 120.938 0.399 . . . . 0.0 110.662 176.343 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.798 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 10.5 ptm -97.96 -31.45 12.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.828 -176.186 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 29.2 tp -64.35 -31.94 73.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.822 0.344 . . . . 0.0 111.071 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 15.8 m -98.73 -7.52 27.56 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.443 -178.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 20' ' ' MET . . . . . 0.432 ' HA ' ' CE ' ' X' ' 20' ' ' MET . 0.1 OUTLIER -92.63 -31.66 15.06 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.841 0.353 . . . . 0.0 110.808 -179.122 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.58 31.49 2.14 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.671 -0.776 . . . . 0.0 111.826 -176.318 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.798 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 20.4 m-30 -116.46 155.97 27.66 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 175.362 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -140.04 -159.43 0.96 Allowed 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 120.101 -0.639 . . . . 0.0 110.261 -179.137 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.997 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 18.8 p-10 -85.93 114.73 23.07 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.396 0.617 . . . . 0.0 109.542 172.164 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' X' X ' 25' ' ' GLU . . . . . 0.516 ' HB2' ' HE1' ' X' ' 28' ' ' TRP . 5.7 mm-40 -84.01 54.42 2.92 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.571 -178.344 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 139.77 -17.23 3.03 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.405 -177.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 111.65 7.69 23.65 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.173 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.761 ' HH2' HG23 ' X' ' 47' ' ' ILE . 51.7 p-90 -83.55 -22.26 32.45 Favored 'General case' 0 C--O 1.208 -1.112 0 CA-C-O 119.087 -0.483 . . . . 0.0 111.992 -178.285 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.997 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 11.6 tp -50.13 -34.67 22.97 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 118.898 0.772 . . . . 0.0 111.577 -174.73 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.53 -30.24 52.71 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 175.597 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 16.4 mtp180 -92.36 -55.52 3.38 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -175.579 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 32' ' ' LEU . . . . . 0.453 ' HB3' HD12 ' X' ' 33' ' ' LEU . 2.8 tm? -43.15 -59.89 1.88 Allowed 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.29 1.036 . . . . 0.0 111.996 -178.267 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.782 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.8 mp -70.58 -36.67 73.72 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.569 -174.377 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 32.7 tp60 -52.63 -46.74 67.22 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -173.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 22.5 p -77.76 -12.09 59.94 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.801 0.334 . . . . 0.0 111.694 -178.007 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 50.1 mttp -112.51 37.66 2.99 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.114 -178.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 41.62 39.77 1.22 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.628 0.771 . . . . 0.0 112.172 -177.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.782 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 31.2 m-85 66.94 77.76 0.27 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.907 -179.329 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -106.19 126.7 52.54 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.675 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.585 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -90.22 -12.97 9.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 120.932 0.396 . . . . 0.0 110.201 172.208 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -60.22 -41.13 98.13 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.631 179.154 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.87 -17.43 21.11 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.751 0.31 . . . . 0.0 111.085 177.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.585 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -69.97 -42.97 72.43 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.658 177.207 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.739 HD12 HD11 ' X' ' 47' ' ' ILE . 8.9 mp -62.47 -27.34 69.06 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.085 -178.391 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' X' X ' 45' ' ' ASP . . . . . 0.481 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 33.5 t70 -55.13 -39.6 69.61 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.814 0.34 . . . . 0.0 111.709 179.026 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 1.1 p -95.99 -24.48 16.35 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 -177.273 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.761 HG23 ' HH2' ' X' ' 28' ' ' TRP . 8.3 pt -82.78 44.66 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 178.586 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 82.68 25.5 0.15 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.135 0.974 . . . . 0.0 113.14 171.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 49' ' ' TYR . . . . . 0.481 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 66.2 m-85 -141.6 63.99 1.41 Allowed 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 110.34 -0.244 . . . . 0.0 110.34 174.098 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 2.6 t -81.79 8.95 8.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.953 0.406 . . . . 0.0 112.053 -174.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -134.34 25.77 3.81 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.63 173.304 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 12.8 p80 . . . . . 0 C--O 1.247 0.924 0 O-C-N 124.593 1.183 . . . . 0.0 112.816 -178.406 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.735 0 N-CA-C 112.155 -0.378 . . . . 0.0 112.155 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 65.7 m -72.06 133.79 83.56 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.571 0.224 . . . . 0.0 110.787 179.035 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' X' X ' 3' ' ' PRO . . . . . 0.415 ' C ' ' H ' ' X' ' 5' ' ' GLU . 66.5 Cg_endo -76.73 151.91 32.4 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.21 1.94 . . . . 0.0 111.46 177.107 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.64 22.94 0.24 Allowed 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.71 2.273 . . . . 0.0 113.278 -177.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' X' X ' 5' ' ' GLU . . . . . 0.415 ' H ' ' C ' ' X' ' 3' ' ' PRO . 51.6 mt-10 -108.89 -0.28 19.83 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.389 0.614 . . . . 0.0 109.929 174.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -172.98 37.95 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.472 -1.24 . . . . 0.0 109.706 -178.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' X' X ' 7' ' ' ASP . . . . . 0.502 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 0.3 OUTLIER -67.35 152.86 95.75 Favored Pre-proline 0 CA--C 1.512 -0.505 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.026 177.248 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' X' X ' 8' ' ' PRO . . . . . 0.502 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 23.6 Cg_endo -59.45 -13.17 19.6 Favored 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 121.452 1.435 . . . . 0.0 110.574 171.486 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 9' ' ' ARG . . . . . 0.419 ' H ' ' HB3' ' X' ' 7' ' ' ASP . 36.5 mmt180 -93.78 -50.0 5.57 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.424 -1.262 . . . . 0.0 111.823 175.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.791 HD22 ' HB2' ' X' ' 14' ' ' LEU . 89.5 mt -94.68 -17.02 22.62 Favored 'General case' 0 C--O 1.217 -0.608 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -169.779 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.521 ' O ' ' HB2' ' X' ' 15' ' ' SER . 0.2 OUTLIER -65.91 -25.23 35.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 175.471 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -94.87 -42.58 8.62 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.508 174.274 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' X' X ' 13' ' ' SER . . . . . 0.478 ' HA ' HG23 ' X' ' 40' ' ' ILE . 4.0 t -94.97 -36.98 11.36 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 -166.807 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.791 ' HB2' HD22 ' X' ' 10' ' ' LEU . 8.4 tt -94.63 -42.82 8.59 Favored 'General case' 0 CA--C 1.51 -0.558 0 CA-C-O 121.51 0.671 . . . . 0.0 109.209 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.549 ' HA ' ' HB3' ' X' ' 18' ' ' LEU . 46.3 m -64.8 -17.27 64.07 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.123 -179.299 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -58.46 -63.04 1.42 Allowed 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.116 175.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.861 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 0.9 OUTLIER -76.13 -25.24 55.15 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.799 -0.361 . . . . 0.0 111.172 179.884 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' X' X ' 18' ' ' LEU . . . . . 0.549 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 37.2 tp -61.54 -34.8 76.18 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.817 0.342 . . . . 0.0 110.865 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 29.9 p -89.07 -42.21 11.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.574 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 91.4 mmm -66.53 -32.81 74.4 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -176.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 109.83 46.37 0.9 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.218 -0.991 . . . . 0.0 111.931 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.861 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 95.4 m-85 -130.63 172.21 12.2 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 175.679 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 23' ' ' SER . . . . . 0.419 ' O ' HG22 ' X' ' 47' ' ' ILE . 50.2 m -155.27 -173.86 4.73 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.571 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 30.7 p30 -83.39 154.11 24.19 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.939 0.4 . . . . 0.0 110.125 172.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 25' ' ' GLU . . . . . 0.505 ' HG2' ' CD1' ' X' ' 28' ' ' TRP . 7.5 pt-20 -82.59 -7.41 59.65 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.197 -174.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -170.66 -28.91 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.713 -178.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' X' X ' 27' ' ' GLY . . . . . 0.455 ' HA2' ' OD2' ' X' ' 24' ' ' ASP . . . 148.39 31.09 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 119.983 -1.103 . . . . 0.0 112.937 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.848 ' HH2' HG23 ' X' ' 47' ' ' ILE . 40.4 p-90 -96.17 -13.89 23.19 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 178.865 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.576 HD21 ' HG ' ' X' ' 14' ' ' LEU . 30.4 tp -58.11 -15.2 8.65 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 122.019 -0.426 . . . . 0.0 111.584 -174.769 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 82.7 p -94.46 -56.35 2.84 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 121.823 -0.548 . . . . 0.0 110.614 169.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' X' X ' 31' ' ' ARG . . . . . 0.689 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -69.72 -51.4 34.65 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -174.761 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' X' X ' 32' ' ' LEU . . . . . 0.845 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 3.4 tm? -51.05 -54.79 21.61 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.582 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.757 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 10.8 mp -54.95 -60.12 3.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.825 177.017 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 22.8 tp60 -40.0 -48.98 2.49 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.868 0.73 . . . . 0.0 112.556 -179.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 7.6 m -59.57 -51.28 70.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.022 -0.536 . . . . 0.0 112.017 -174.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.57 37.4 1.2 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 40.2 t30 61.98 61.01 1.43 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.4 176.051 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.757 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 81.0 m-85 43.9 52.86 6.5 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.351 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -82.37 130.74 35.17 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.46 -173.159 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.579 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.69 -12.2 9.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.058 169.688 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.51 -41.73 83.62 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.457 -0.877 . . . . 0.0 112.135 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -91.31 -19.57 22.82 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.339 -0.431 . . . . 0.0 110.943 177.567 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.531 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -71.58 -39.69 70.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.789 178.555 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.727 ' HA ' HG12 ' X' ' 47' ' ' ILE . 7.0 mp -65.55 -37.09 85.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.886 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -54.14 -35.92 62.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.233 176.189 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 7.4 p -96.25 -22.12 17.44 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -177.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.848 HG23 ' HH2' ' X' ' 28' ' ' TRP . 28.0 pt -83.97 42.78 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.8 -0.562 . . . . 0.0 111.715 176.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 72.85 20.46 3.59 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.405 0.682 . . . . 0.0 112.094 174.377 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 49' ' ' TYR . . . . . 0.497 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 9.7 m-30 -121.74 55.81 1.09 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 173.658 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 6.8 t -83.44 3.67 31.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.353 0.596 . . . . 0.0 110.673 -178.316 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' X' X ' 51' ' ' LYS . . . . . 0.447 ' HD3' ' C ' ' X' ' 51' ' ' LYS . 0.5 OUTLIER -156.75 129.41 7.65 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.006 -0.997 . . . . 0.0 108.551 173.128 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 . . . . . 0 C--O 1.247 0.93 0 CA-C-O 118.331 -0.842 . . . . 0.0 110.233 -178.522 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.665 0 N-CA-C 112.044 -0.422 . . . . 0.0 112.044 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 35.1 t -111.14 107.77 57.4 Favored Pre-proline 0 C--N 1.326 -0.423 0 O-C-N 122.817 -0.226 . . . . 0.0 110.679 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' X' X ' 3' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -71.14 117.26 5.06 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.599 2.199 . . . . 0.0 112.398 -178.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -90.03 28.64 0.43 Allowed 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 122.501 2.134 . . . . 0.0 112.679 -179.328 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' X' X ' 5' ' ' GLU . . . . . 0.573 ' HA ' ' HG ' ' X' ' 10' ' ' LEU . 26.0 tt0 63.84 12.77 7.0 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.871 0.843 . . . . 0.0 109.844 -173.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -138.4 30.13 2.4 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.599 -1.182 . . . . 0.0 107.995 173.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' X' X ' 7' ' ' ASP . . . . . 0.545 ' O ' HG12 ' X' ' 11' ' ' ILE . 23.6 t70 -80.27 154.54 74.55 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 113.35 -1.75 . . . . 0.0 107.901 178.359 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 8' ' ' PRO . . . . . 0.457 ' HD2' ' CG ' ' X' ' 7' ' ' ASP . 68.8 Cg_exo -49.31 -21.66 4.9 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 121.98 1.787 . . . . 0.0 112.461 177.693 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 9' ' ' ARG . . . . . 0.44 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 34.6 mmt180 -87.27 -26.62 23.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.35 177.31 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.573 ' HG ' ' HA ' ' X' ' 5' ' ' GLU . 4.4 mm? -98.01 -33.39 11.21 Favored 'General case' 0 C--O 1.222 -0.38 0 O-C-N 122.292 -0.255 . . . . 0.0 110.75 -175.653 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.545 HG12 ' O ' ' X' ' 7' ' ' ASP . 18.1 pt -68.97 -12.53 16.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 170.287 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -96.56 -66.49 0.9 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.148 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' X' X ' 13' ' ' SER . . . . . 0.472 ' OG ' HG23 ' X' ' 40' ' ' ILE . 34.6 t -83.77 -23.23 31.62 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -170.163 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.464 ' HB2' HD12 ' X' ' 10' ' ' LEU . 2.6 tm? -92.51 -42.53 9.66 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 177.684 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.527 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 43.9 t -62.75 -24.93 67.95 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.209 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 19.7 tm0? -55.17 -43.57 74.41 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.908 0.385 . . . . 0.0 110.551 176.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.651 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 9.5 ptm -96.66 -27.78 14.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.545 -178.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 18' ' ' LEU . . . . . 0.479 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 35.6 tp -64.22 -40.5 96.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.942 0.401 . . . . 0.0 110.815 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 19.0 m -91.72 -4.51 54.99 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.71 -176.573 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 16.7 tpt -102.78 -33.24 9.45 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.379 -179.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.65 46.52 0.67 Allowed Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.211 -0.995 . . . . 0.0 112.266 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.651 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 47.5 m-85 -125.63 163.62 22.38 Favored 'General case' 0 CA--C 1.507 -0.695 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 175.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 23' ' ' SER . . . . . 0.478 ' O ' HG22 ' X' ' 47' ' ' ILE . 41.4 m -145.82 171.09 15.3 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 120.426 -0.51 . . . . 0.0 109.95 -179.561 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.472 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.6 p30 -69.51 134.0 48.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.2 0.524 . . . . 0.0 110.628 177.012 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 25' ' ' GLU . . . . . 0.591 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 33.3 tt0 -87.18 55.54 3.6 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.546 0.688 . . . . 0.0 109.379 177.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 136.01 -95.05 0.24 Allowed Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.371 -0.832 . . . . 0.0 111.918 -176.131 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -166.73 29.78 0.19 Allowed Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.991 -0.623 . . . . 0.0 111.673 178.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.629 ' HH2' HG23 ' X' ' 47' ' ' ILE . 53.6 p-90 -92.96 -14.08 27.96 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -176.877 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.472 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 13.8 tp -57.1 -24.52 54.67 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -168.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 77.1 p -82.71 -48.56 10.73 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.298 170.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 31.8 mtt-85 -60.07 -57.97 10.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.977 -177.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -50.28 -51.12 47.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.064 -176.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.46 HD13 ' O ' ' X' ' 29' ' ' LEU . 11.0 mp -62.64 -64.31 0.96 Allowed 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.27 179.554 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -43.42 -43.11 5.06 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -178.463 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 28.0 m -64.65 -52.24 58.4 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -176.119 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' X' X ' 36' ' ' LYS . . . . . 0.631 ' HB2' ' HB2' ' X' ' 39' ' ' ASP . 0.0 OUTLIER -93.38 40.28 1.06 Allowed 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -176.638 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 5.7 p-10 44.29 51.11 7.65 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.324 0.649 . . . . 0.0 111.84 -176.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.44 ' CD2' ' HB3' ' X' ' 9' ' ' ARG . 57.8 m-85 64.37 73.39 0.43 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 114.467 -1.242 . . . . 0.0 111.003 178.147 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 39' ' ' ASP . . . . . 0.631 ' HB2' ' HB2' ' X' ' 36' ' ' LYS . 2.5 t0 -97.35 117.72 32.23 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.045 -0.979 . . . . 0.0 111.127 -176.379 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.586 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.1 -18.38 7.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 121.102 0.477 . . . . 0.0 109.791 171.367 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.18 -34.12 89.08 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.543 179.151 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -100.01 -20.61 15.99 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.729 0.3 . . . . 0.0 111.282 177.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.471 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -72.47 -36.22 68.41 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.45 179.246 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.72 ' HA ' HG12 ' X' ' 47' ' ' ILE . 7.0 mp -63.68 -31.64 72.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.098 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 45' ' ' ASP . . . . . 0.54 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.9 t70 -55.18 -48.71 73.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.949 177.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 3.3 p -85.98 -5.61 59.19 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 -177.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.72 HG12 ' HA ' ' X' ' 44' ' ' LEU . 30.1 pt -106.24 43.3 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 O-C-N 121.902 -0.499 . . . . 0.0 111.272 175.151 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 48' ' ' GLN . . . . . 0.415 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 1.1 mp0 85.05 22.86 0.09 Allowed 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.657 1.183 . . . . 0.0 113.308 173.171 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 49' ' ' TYR . . . . . 0.645 ' HE1' ' CZ ' ' X' ' 22' ' ' PHE . 32.2 m-85 -130.11 49.05 2.32 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 110.224 -0.288 . . . . 0.0 110.224 172.413 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 8.4 t -75.74 2.63 11.62 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.095 0.474 . . . . 0.0 111.611 -175.138 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 59.4 tttm -130.39 94.78 3.74 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.55 173.054 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 49.2 m-70 . . . . . 0 C--O 1.243 0.734 0 CA-C-O 118.321 -0.847 . . . . 0.0 110.375 -177.586 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.832 0 N-CA-C 112.296 -0.322 . . . . 0.0 112.296 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' X' X ' 2' ' ' SER . . . . . 0.846 ' HB2' ' HA ' ' X' ' 7' ' ' ASP . 20.1 m -122.78 158.85 55.78 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 179.517 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' X' X ' 3' ' ' PRO . . . . . 0.419 ' HD2' ' HB3' ' X' ' 2' ' ' SER . 29.9 Cg_endo -63.46 127.34 19.67 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.077 1.852 . . . . 0.0 110.894 177.4 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' X' X ' 4' ' ' PRO . . . . . 0.625 ' O ' ' HB2' ' X' ' 5' ' ' GLU . 87.7 Cg_exo -51.92 91.18 0.03 OUTLIER 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 123.388 2.726 . . . . 0.0 113.711 -174.423 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' X' X ' 5' ' ' GLU . . . . . 0.625 ' HB2' ' O ' ' X' ' 4' ' ' PRO . 60.5 tt0 156.93 -23.82 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.756 1.222 . . . . 0.0 108.892 179.042 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -130.26 31.99 4.54 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.259 -1.337 . . . . 0.0 110.397 179.613 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' X' X ' 7' ' ' ASP . . . . . 0.846 ' HA ' ' HB2' ' X' ' 2' ' ' SER . 1.2 m-20 -73.14 156.8 89.15 Favored Pre-proline 0 CA--C 1.509 -0.601 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.966 177.825 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -55.07 -12.76 5.5 Favored 'Trans proline' 0 CA--C 1.536 0.576 0 C-N-CA 121.307 1.338 . . . . 0.0 110.987 169.529 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -90.99 -49.13 6.59 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.01 177.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.517 HD22 ' HB2' ' X' ' 14' ' ' LEU . 53.9 mt -97.85 -17.55 19.24 Favored 'General case' 0 C--O 1.22 -0.491 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -173.168 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.608 ' O ' ' HB3' ' X' ' 15' ' ' SER . 0.5 OUTLIER -66.75 -21.33 28.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.876 0.846 . . . . 0.0 108.932 174.083 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -95.15 -45.83 7.04 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.584 175.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 8.1 t -94.05 -36.3 12.18 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -169.399 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.566 HD13 HD21 ' X' ' 29' ' ' LEU . 42.1 tp -92.71 -43.44 9.06 Favored 'General case' 0 CA--C 1.51 -0.582 0 O-C-N 121.682 -0.636 . . . . 0.0 109.791 179.711 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.608 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 33.4 t -61.43 -25.64 67.34 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.818 -175.86 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.01 -30.58 63.87 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 120.584 -0.446 . . . . 0.0 111.21 179.22 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.781 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 23.7 ptp -90.14 -27.86 19.33 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.28 177.819 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 27.7 tp -63.93 -28.59 69.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.795 178.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 8.9 p -93.69 -44.21 8.28 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.901 -179.174 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 25.0 mmt -69.99 -24.09 63.26 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -175.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.82 47.39 1.27 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.087 -1.054 . . . . 0.0 112.555 -179.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.781 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 47.5 m-85 -127.06 144.5 51.01 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 176.274 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 14.3 m -144.39 169.95 16.95 Favored 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 119.855 -0.738 . . . . 0.0 111.233 -173.373 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.578 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 8.4 p-10 -71.73 131.19 42.76 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.798 173.687 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' X' X ' 25' ' ' GLU . . . . . 0.569 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 16.0 tp10 -69.21 -69.18 0.35 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.718 -177.475 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -97.47 -20.29 22.88 Favored Glycine 0 C--N 1.316 -0.539 0 C-N-CA 120.951 -0.643 . . . . 0.0 113.169 -179.236 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.52 32.67 0.81 Allowed Glycine 0 CA--C 1.507 -0.407 0 C-N-CA 120.537 -0.839 . . . . 0.0 111.211 -176.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.637 ' HH2' HG23 ' X' ' 47' ' ' ILE . 23.9 p-90 -96.15 -3.79 43.86 Favored 'General case' 0 C--O 1.217 -0.647 0 CA-C-N 115.173 -0.513 . . . . 0.0 111.452 -176.695 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.777 HD12 HD13 ' X' ' 33' ' ' LEU . 11.0 tp -60.19 -32.26 70.92 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 122.176 -0.328 . . . . 0.0 111.348 -172.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' X' X ' 30' ' ' THR . . . . . 0.401 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 4.6 m -79.89 -15.39 57.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.965 0.412 . . . . 0.0 110.821 175.353 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' X' X ' 31' ' ' ARG . . . . . 0.547 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 11.3 mtm180 -96.33 -60.24 1.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.033 0.444 . . . . 0.0 111.168 -178.122 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -49.31 -72.63 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.773 -178.065 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.777 HD13 HD12 ' X' ' 29' ' ' LEU . 6.9 mp -56.75 -45.77 81.82 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.787 -174.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' X' X ' 34' ' ' GLN . . . . . 0.401 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.5 OUTLIER -49.59 -51.76 34.98 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -176.972 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 2.2 m -77.64 -7.44 56.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.073 0.463 . . . . 0.0 111.107 -177.264 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -115.06 37.83 3.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.362 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 11.7 p30 49.74 33.04 5.73 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.02 0.928 . . . . 0.0 112.777 179.127 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.505 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 67.8 m-85 63.83 70.15 0.52 Allowed 'General case' 0 C--O 1.234 0.267 0 C-N-CA 122.955 0.502 . . . . 0.0 110.818 178.196 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 44.7 p-10 -111.42 141.04 45.49 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.683 0.754 . . . . 0.0 112.72 -178.157 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.577 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -92.6 -6.17 10.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.385 170.244 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.21 -44.19 76.83 Favored Glycine 0 CA--C 1.505 -0.565 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.435 -177.053 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.84 -18.49 20.33 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 120.827 0.346 . . . . 0.0 110.831 177.225 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.577 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -71.63 -31.92 67.4 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.778 177.797 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.806 HD12 HD11 ' X' ' 47' ' ' ILE . 6.1 tp -65.14 -31.54 72.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.111 0.481 . . . . 0.0 110.443 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -73.94 -27.55 61.07 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.847 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 22.9 p -97.15 -31.12 12.63 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 -175.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.806 HD11 HD12 ' X' ' 44' ' ' LEU . 2.1 pt -64.63 -26.93 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -171.368 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -167.74 -39.09 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 120.77 0.319 . . . . 0.0 111.077 177.024 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 60.2 m-85 -78.87 -159.22 0.17 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.94 -177.578 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 17.1 p -178.73 41.76 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.297 -179.54 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -138.96 16.22 2.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.049 0.452 . . . . 0.0 110.791 -175.436 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 . . . . . 0 C--O 1.245 0.819 0 CA-C-O 118.281 -0.866 . . . . 0.0 111.549 179.596 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.829 0 N-CA-C 112.3 -0.32 . . . . 0.0 112.3 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 5.1 p -83.91 113.13 45.68 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 120.667 0.27 . . . . 0.0 110.613 178.54 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' X' X ' 3' ' ' PRO . . . . . 0.701 ' HG2' ' HB3' ' X' ' 6' ' ' ALA . 71.8 Cg_endo -86.23 142.44 7.38 Favored 'Trans proline' 0 C--O 1.236 0.39 0 C-N-CA 122.427 2.085 . . . . 0.0 113.091 -175.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' X' X ' 4' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 4.5 Cg_exo -78.29 44.13 1.55 Allowed 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.455 2.77 . . . . 0.0 112.024 177.015 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -162.33 26.32 0.11 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' X' X ' 6' ' ' ALA . . . . . 0.701 ' HB3' ' HG2' ' X' ' 3' ' ' PRO . . . -174.32 42.42 0.01 OUTLIER 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 -177.823 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -102.02 150.03 37.08 Favored Pre-proline 0 C--N 1.317 -0.822 0 CA-C-N 114.191 -1.368 . . . . 0.0 108.127 -176.367 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -45.24 -25.87 2.15 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.33 2.02 . . . . 0.0 113.11 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 50.5 mtp85 -92.95 -35.0 13.54 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 178.728 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 97.1 mt -88.28 -18.03 29.43 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 116.8 -0.182 . . . . 0.0 110.81 -177.365 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.481 ' HA ' ' HB2' ' X' ' 15' ' ' SER . 0.4 OUTLIER -63.83 -26.04 39.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.639 0.733 . . . . 0.0 109.272 171.318 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' X' X ' 12' ' ' GLU . . . . . 0.555 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 5.3 mm-40 -85.81 -45.24 11.77 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.368 176.596 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' X' X ' 13' ' ' SER . . . . . 0.579 ' HB2' HD23 ' X' ' 33' ' ' LEU . 11.2 p -96.09 -43.14 7.9 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 113.858 1.058 . . . . 0.0 113.858 -169.44 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.592 ' HG ' HD11 ' X' ' 29' ' ' LEU . 2.9 tt -93.09 -45.44 7.9 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -176.224 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.481 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 33.1 m -68.5 -14.56 63.09 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.414 179.532 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' X' X ' 16' ' ' GLN . . . . . 0.555 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 1.0 OUTLIER -62.3 -65.95 0.61 Allowed 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 171.106 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.488 ' CB ' ' HB2' ' X' ' 22' ' ' PHE . 70.5 mtm -62.71 -39.46 94.08 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.874 -179.051 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 30.0 tp -61.09 -34.4 74.87 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -177.087 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 27.8 t -94.99 -8.44 36.9 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.602 0.239 . . . . 0.0 111.563 -177.248 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 50.5 tpp -101.74 -31.81 10.6 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.495 -178.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.26 34.31 1.64 Allowed Glycine 0 CA--C 1.511 -0.214 0 C-N-CA 120.581 -0.818 . . . . 0.0 111.501 -177.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.508 ' HB3' HD12 ' X' ' 47' ' ' ILE . 4.5 m-85 -121.76 138.77 54.23 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 176.415 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 68.8 m -134.83 -128.15 0.16 Allowed 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.687 -176.268 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.589 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.6 p30 -120.98 136.96 54.86 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.751 173.124 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' X' X ' 25' ' ' GLU . . . . . 0.413 ' HB2' ' HE1' ' X' ' 28' ' ' TRP . 23.2 tt0 -68.46 -38.49 81.13 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.002 0.429 . . . . 0.0 110.385 -177.557 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -144.15 -0.14 1.07 Allowed Glycine 0 CA--C 1.519 0.33 0 C-N-CA 120.739 -0.743 . . . . 0.0 113.57 -178.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 123.09 28.67 1.33 Allowed Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.253 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.812 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 32.9 p-90 -96.53 -8.76 31.16 Favored 'General case' 0 C--O 1.218 -0.597 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -178.523 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.592 HD11 ' HG ' ' X' ' 14' ' ' LEU . 20.3 tp -65.48 -17.39 64.52 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.069 0.461 . . . . 0.0 110.342 -176.124 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -93.8 -16.34 24.23 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.799 172.052 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' X' X ' 31' ' ' ARG . . . . . 0.428 ' HD3' ' HA ' ' X' ' 28' ' ' TRP . 19.8 mtp85 -97.33 -66.07 0.92 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.213 0.53 . . . . 0.0 112.106 -177.729 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -46.92 -73.47 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 114.093 -1.412 . . . . 0.0 112.682 -172.135 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.678 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.8 mp -50.49 -51.94 42.74 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-O 121.027 0.441 . . . . 0.0 111.346 -174.697 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 15.0 mp0 -50.67 -38.55 47.19 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.69 -178.391 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 5.3 m -86.46 -6.77 58.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.986 0.422 . . . . 0.0 110.993 -177.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -125.41 38.83 4.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.891 -177.485 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 56.91 22.45 7.15 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.247 1.019 . . . . 0.0 113.061 178.917 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.678 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 15.1 m-85 72.34 73.25 0.15 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.608 0.763 . . . . 0.0 110.11 177.777 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 45.4 p-10 -115.11 142.92 45.99 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.558 0.694 . . . . 0.0 112.581 -177.32 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.612 ' H ' HD13 ' X' ' 40' ' ' ILE . 0.1 OUTLIER -91.54 -19.5 7.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.082 173.09 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.12 -39.42 97.61 Favored Glycine 0 CA--C 1.506 -0.526 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.598 -177.262 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' X' X ' 42' ' ' ALA . . . . . 0.446 ' O ' ' HB3' ' X' ' 45' ' ' ASP . . . -96.39 -10.36 27.8 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.47 -0.365 . . . . 0.0 110.642 176.627 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.527 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -73.69 -47.4 39.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.039 178.11 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' X' X ' 44' ' ' LEU . . . . . . . . . . . . . 10.7 mp -58.81 -33.55 70.5 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.72 0.295 . . . . 0.0 110.616 177.405 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' X' X ' 45' ' ' ASP . . . . . 0.446 ' HB3' ' O ' ' X' ' 42' ' ' ALA . 15.4 t0 -55.19 -45.78 75.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.197 175.739 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 1.2 p -86.13 -6.04 59.09 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 114.187 1.18 . . . . 0.0 114.187 -171.317 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.812 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 0.1 OUTLIER -109.58 -26.78 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-N 119.371 0.987 . . . . 0.0 112.893 178.685 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' X' X ' 48' ' ' GLN . . . . . 0.479 ' OE1' ' HB ' ' X' ' 47' ' ' ILE . 0.0 OUTLIER -155.59 -44.75 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.83 0.347 . . . . 0.0 111.54 -176.747 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -84.01 49.86 1.72 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.29 -174.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 14.0 p -82.55 2.94 30.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.354 0.597 . . . . 0.0 110.961 178.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -117.81 124.72 49.07 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.774 -1.103 . . . . 0.0 108.026 172.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 54.3 m-70 . . . . . 0 C--O 1.243 0.734 0 CA-C-O 118.333 -0.841 . . . . 0.0 110.632 -173.92 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.777 0 N-CA-C 111.847 -0.501 . . . . 0.0 111.847 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' X' X ' 2' ' ' SER . . . . . 0.419 ' HA ' ' HD3' ' X' ' 3' ' ' PRO . 67.9 m -106.74 148.01 36.07 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-O 120.857 0.36 . . . . 0.0 111.333 -178.156 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 3' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' X' ' 2' ' ' SER . 4.3 Cg_exo -75.52 154.51 40.14 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.953 2.436 . . . . 0.0 111.901 178.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -74.25 21.66 0.39 Allowed 'Trans proline' 0 CA--C 1.532 0.39 0 C-N-CA 122.412 2.075 . . . . 0.0 112.777 177.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' X' X ' 5' ' ' GLU . . . . . 0.403 ' H ' ' C ' ' X' ' 3' ' ' PRO . 13.6 mp0 -137.6 12.05 2.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.505 175.212 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -166.81 50.72 0.07 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.227 -177.395 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' X' X ' 7' ' ' ASP . . . . . 0.516 ' H ' ' HB2' ' X' ' 10' ' ' LEU . 0.3 OUTLIER -85.83 155.48 58.6 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-N 114.823 -1.081 . . . . 0.0 109.24 -178.924 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.65 -14.31 30.63 Favored 'Trans proline' 0 CA--C 1.533 0.434 0 C-N-CA 121.144 1.229 . . . . 0.0 110.293 170.528 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 80.2 mtm180 -93.73 -30.67 14.76 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.245 175.679 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.516 ' HB2' ' H ' ' X' ' 7' ' ' ASP . 96.5 mt -98.44 -18.43 18.25 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -174.597 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.485 ' O ' ' HB3' ' X' ' 15' ' ' SER . 44.8 mm -68.35 -16.24 20.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 170.29 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 12' ' ' GLU . . . . . 0.569 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 38.2 tt0 -93.4 -54.79 3.54 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.253 174.838 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 13' ' ' SER . . . . . 0.418 ' HA ' HG23 ' X' ' 40' ' ' ILE . 22.8 t -94.49 -27.94 15.72 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -169.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 14' ' ' LEU . . . . . . . . . . . . . 9.3 tt -94.5 -47.6 6.48 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 -179.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.485 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 35.1 t -62.87 -28.82 70.3 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.094 -179.397 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 16' ' ' GLN . . . . . 0.569 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 16.3 tm0? -50.11 -43.08 51.51 Favored 'General case' 0 N--CA 1.463 0.186 0 O-C-N 123.507 0.505 . . . . 0.0 110.993 178.326 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.806 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 18.9 ptp -99.26 -30.46 12.23 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.736 -176.05 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -65.44 -33.91 77.06 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -176.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 57.6 p -98.78 -12.16 21.16 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -178.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 12.3 tpt -88.04 -23.84 23.64 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.046 -178.005 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.93 44.93 0.72 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.621 179.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.806 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 4.0 m-85 -116.77 -174.26 2.54 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 176.36 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 23' ' ' SER . . . . . 0.557 ' O ' HG21 ' X' ' 47' ' ' ILE . 50.6 m -150.47 -161.03 1.25 Allowed 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.126 -0.63 . . . . 0.0 111.143 178.143 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.479 ' HA ' ' HE1' ' X' ' 28' ' ' TRP . 7.6 t70 -116.63 123.99 48.68 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 177.056 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -119.24 78.98 1.35 Allowed 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 120.829 0.347 . . . . 0.0 110.493 -177.114 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 124.74 -6.79 8.38 Favored Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.524 -0.846 . . . . 0.0 113.831 176.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.37 12.16 63.43 Favored Glycine 0 C--O 1.23 -0.13 0 C-N-CA 120.61 -0.805 . . . . 0.0 111.663 -177.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.712 ' HE3' ' HB3' ' X' ' 32' ' ' LEU . 31.2 p-90 -65.1 -34.52 78.6 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-N 115.127 -0.537 . . . . 0.0 111.572 -179.116 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 29' ' ' LEU . . . . . . . . . . . . . 51.8 tp -55.11 -22.5 16.78 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -165.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 51.2 p -94.66 -32.52 13.35 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.697 -0.627 . . . . 0.0 111.774 175.192 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' X' X ' 31' ' ' ARG . . . . . 0.44 ' CG ' ' HA ' ' X' ' 28' ' ' TRP . 31.8 ptt180 -94.22 -40.1 10.18 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -173.286 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 32' ' ' LEU . . . . . 0.712 ' HB3' ' HE3' ' X' ' 28' ' ' TRP . 2.9 tm? -61.91 -56.27 21.04 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 123.401 0.68 . . . . 0.0 110.24 -178.615 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 10.5 mp -55.06 -50.4 69.21 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.504 177.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -47.35 -53.24 14.26 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.421 -177.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 19.7 m -73.62 -23.98 59.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.918 0.39 . . . . 0.0 110.966 -178.185 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' X' X ' 36' ' ' LYS . . . . . 0.53 ' HB3' ' HB3' ' X' ' 39' ' ' ASP . 14.7 mptt -95.33 33.67 1.54 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.515 178.27 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 46.73 35.5 3.15 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.519 0.728 . . . . 0.0 112.446 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' X' X ' 38' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 66.94 69.9 0.39 Allowed 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.364 0.666 . . . . 0.0 110.038 -178.167 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' X' X ' 39' ' ' ASP . . . . . 0.53 ' HB3' ' HB3' ' X' ' 36' ' ' LYS . 30.2 t70 -121.9 137.6 54.72 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.449 -173.272 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.756 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -90.43 -8.5 10.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.735 173.096 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' X' X ' 41' ' ' GLY . . . . . 0.419 ' H ' ' CG ' ' X' ' 39' ' ' ASP . . . -62.85 -48.35 81.61 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.124 -177.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -93.48 -10.56 34.56 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.898 -0.651 . . . . 0.0 110.818 175.782 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.756 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -68.29 -47.55 67.32 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.674 -179.245 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.414 HD13 ' O ' ' X' ' 40' ' ' ILE . 10.3 mp -71.57 -20.2 62.04 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.119 -178.408 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -70.45 -23.05 62.64 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.431 -178.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 33.0 p -95.3 -23.55 17.16 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -174.594 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.62 ' O ' ' HG3' ' X' ' 48' ' ' GLN . 1.7 pt -102.8 -26.75 3.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -172.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 48' ' ' GLN . . . . . 0.62 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.7 mt-30 -157.31 -53.36 0.07 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 118.351 0.523 . . . . 0.0 111.412 -176.819 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 49' ' ' TYR . . . . . 0.432 ' O ' ' HB2' ' X' ' 50' ' ' SER . 15.3 m-85 -78.07 175.98 9.61 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 176.573 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 50' ' ' SER . . . . . 0.432 ' HB2' ' O ' ' X' ' 49' ' ' TYR . 2.1 t 174.75 71.98 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 176.888 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -162.32 143.64 10.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.006 -176.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 37.8 m80 . . . . . 0 C--N 1.32 -0.693 0 CA-C-O 118.739 -0.648 . . . . 0.0 109.757 175.937 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.985 0 N-CA-C 112.287 -0.325 . . . . 0.0 112.287 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 26.6 m -83.1 157.89 65.21 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 179.231 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' X' X ' 3' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -92.31 170.91 2.58 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 122.536 2.158 . . . . 0.0 112.446 -175.713 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' X' X ' 4' ' ' PRO . . . . . 1.06 ' HB2' ' HB2' ' X' ' 7' ' ' ASP . 23.4 Cg_exo -61.52 159.21 32.9 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.397 2.064 . . . . 0.0 111.766 176.647 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -77.04 93.14 3.8 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.179 -174.124 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . 56.59 64.4 1.69 Allowed 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 121.807 0.813 . . . . 0.0 109.987 -176.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' X' X ' 7' ' ' ASP . . . . . 1.06 ' HB2' ' HB2' ' X' ' 4' ' ' PRO . 13.3 t70 -94.28 149.47 36.78 Favored Pre-proline 0 C--N 1.315 -0.904 0 CA-C-N 114.606 -1.179 . . . . 0.0 108.237 -178.485 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 8' ' ' PRO . . . . . 0.749 ' O ' ' HB2' ' X' ' 12' ' ' GLU . 63.2 Cg_exo -48.28 -13.37 0.23 Allowed 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.022 2.482 . . . . 0.0 113.033 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 9' ' ' ARG . . . . . 0.449 ' HB3' ' CD1' ' X' ' 38' ' ' TYR . 10.4 mmt-85 -71.5 -48.81 46.61 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.394 173.873 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.548 HD22 ' HB2' ' X' ' 14' ' ' LEU . 24.3 mt -100.08 -41.16 7.26 Favored 'General case' 0 C--O 1.222 -0.366 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -178.2 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.621 ' O ' ' HB3' ' X' ' 15' ' ' SER . 11.2 tt -63.01 -22.3 30.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.1 0.476 . . . . 0.0 110.112 -179.057 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 12' ' ' GLU . . . . . 0.749 ' HB2' ' O ' ' X' ' 8' ' ' PRO . 0.4 OUTLIER -94.26 -59.58 1.92 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.809 172.378 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' X' X ' 13' ' ' SER . . . . . 0.434 ' HB2' ' O ' ' X' ' 9' ' ' ARG . 49.4 m -85.62 -25.72 26.48 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -169.24 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.548 ' HB2' HD22 ' X' ' 10' ' ' LEU . 10.4 tt -93.0 -40.7 10.4 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 178.637 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.621 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 32.1 t -68.08 -16.65 64.11 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.867 177.211 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 16' ' ' GLN . . . . . 0.539 ' O ' ' HB2' ' X' ' 20' ' ' MET . 19.1 tm0? -55.24 -45.4 76.04 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.067 0.461 . . . . 0.0 110.316 174.464 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.668 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 15.0 ptm -99.9 -20.29 16.21 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.668 -176.305 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 18' ' ' LEU . . . . . 0.451 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 46.0 tp -60.12 -49.34 78.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.772 0.32 . . . . 0.0 111.005 -179.459 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 16.0 p -98.86 9.26 43.83 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -178.442 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' X' X ' 20' ' ' MET . . . . . 0.539 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 27.4 ttt -91.43 -28.33 17.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.035 0.445 . . . . 0.0 111.022 -178.82 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.35 34.55 1.59 Allowed Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.572 -0.823 . . . . 0.0 111.179 -174.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.668 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 14.9 m-30 -117.83 -174.72 2.69 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 175.803 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 71.7 p -161.38 -163.35 0.99 Allowed 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 119.621 -0.832 . . . . 0.0 111.043 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.634 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 0.7 OUTLIER -112.64 115.18 28.17 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 166.882 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' X' X ' 25' ' ' GLU . . . . . 0.563 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 62.9 tt0 -51.65 -34.88 39.88 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.007 -175.607 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -124.16 -68.65 0.21 Allowed Glycine 0 C--N 1.318 -0.465 0 N-CA-C 111.24 -0.744 . . . . 0.0 111.24 173.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -176.31 29.97 0.08 OUTLIER Glycine 0 CA--C 1.508 -0.379 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 177.661 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.759 ' HH2' HG23 ' X' ' 47' ' ' ILE . 45.7 p-90 -97.33 -9.73 26.95 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -172.281 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.634 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 12.5 tp -52.52 -25.71 11.07 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -169.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 30' ' ' THR . . . . . 0.456 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 32.1 p -84.44 -55.9 3.91 Favored 'General case' 0 C--N 1.322 -0.604 0 O-C-N 121.876 -0.515 . . . . 0.0 110.421 170.509 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.4 -51.9 50.63 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.785 -177.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -51.26 -60.36 3.21 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 123.266 0.626 . . . . 0.0 111.114 -177.319 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.462 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 8.8 mp -62.86 -44.83 95.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.134 -179.114 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 34' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.2 OUTLIER -49.47 -47.06 48.68 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -178.45 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 4.7 m -80.8 -23.92 38.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.957 0.408 . . . . 0.0 111.25 -176.404 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -102.5 39.72 1.47 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -175.243 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 50.4 29.32 3.81 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.728 0.811 . . . . 0.0 112.512 179.422 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.462 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 92.6 m-85 71.27 71.46 0.18 Allowed 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.825 177.876 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -114.52 130.16 56.72 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.891 -174.327 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.565 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -90.92 -17.9 7.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.077 169.87 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.26 -34.78 90.28 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.219 179.192 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.82 -15.68 19.16 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.38 -0.41 . . . . 0.0 111.002 176.675 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.565 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -72.48 -38.94 68.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.939 0.4 . . . . 0.0 110.777 178.623 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.545 ' HG ' HD11 ' X' ' 47' ' ' ILE . 9.0 mp -76.75 -18.3 58.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.486 178.2 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -69.29 -34.73 75.16 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.547 175.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 7.1 p -95.75 -6.04 40.65 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -174.333 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.759 HG23 ' HH2' ' X' ' 28' ' ' TRP . 6.6 pt -100.2 -30.22 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 119.613 -0.835 . . . . 0.0 113.205 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' X' X ' 48' ' ' GLN . . . . . 0.543 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 0.0 OUTLIER -165.79 -48.01 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.256 0.55 . . . . 0.0 110.595 -177.57 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -82.61 -165.96 1.18 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.977 -1.01 . . . . 0.0 110.53 -172.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 20.2 m -143.61 74.45 1.43 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 176.593 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 2.4 tppp? 66.68 45.36 2.0 Allowed 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 -174.218 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 45.1 m80 . . . . . 0 C--O 1.245 0.855 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.675 -174.892 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.658 0 N-CA-C 111.734 -0.546 . . . . 0.0 111.734 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 20.2 m -95.13 110.03 47.9 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 116.788 0.294 . . . . 0.0 110.926 179.101 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 3' ' ' PRO . . . . . 0.436 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 27.0 Cg_exo -61.17 136.83 67.21 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.468 2.112 . . . . 0.0 111.288 178.771 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' X' X ' 4' ' ' PRO . . . . . 0.476 ' O ' HD22 ' X' ' 10' ' ' LEU . 23.3 Cg_exo -69.18 29.85 0.16 Allowed 'Trans proline' 0 CA--C 1.534 0.479 0 C-N-CA 122.977 2.451 . . . . 0.0 114.019 -174.543 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' X' X ' 5' ' ' GLU . . . . . 0.411 ' H ' ' C ' ' X' ' 3' ' ' PRO . 30.9 tt0 -140.16 9.29 2.3 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.801 0.81 . . . . 0.0 109.399 173.356 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -150.96 25.0 0.74 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.861 -1.063 . . . . 0.0 108.841 176.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -84.4 144.97 44.23 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 114.31 -1.313 . . . . 0.0 107.893 177.169 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -41.6 -26.77 0.42 Allowed 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 123.253 2.635 . . . . 0.0 113.764 -178.175 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 9' ' ' ARG . . . . . 0.524 ' HD2' ' CE2' ' X' ' 38' ' ' TYR . 83.9 mtm180 -83.45 -42.58 16.77 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 178.931 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.476 HD22 ' O ' ' X' ' 4' ' ' PRO . 3.9 mp -97.28 -17.08 20.02 Favored 'General case' 0 C--O 1.216 -0.659 0 O-C-N 122.277 -0.264 . . . . 0.0 111.55 -174.65 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.562 ' O ' ' HB3' ' X' ' 15' ' ' SER . 10.5 tt -73.93 -12.95 15.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 170.484 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -93.81 -50.23 5.45 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 114.396 -1.275 . . . . 0.0 110.761 174.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 13' ' ' SER . . . . . 0.582 ' HA ' HG23 ' X' ' 40' ' ' ILE . 44.1 p -95.01 -34.09 12.47 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -171.236 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.522 ' HG ' HD11 ' X' ' 29' ' ' LEU . 6.4 tt -93.36 -44.54 8.23 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 -178.284 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.562 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 16.1 t -66.72 -21.72 66.07 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.924 -178.392 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 7.0 tm0? -56.54 -55.39 34.44 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.341 174.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.786 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 23.6 ptp -80.37 -26.91 38.36 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.926 -178.268 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' X' X ' 18' ' ' LEU . . . . . 0.436 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 33.5 tp -64.83 -29.38 70.34 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.03 0.443 . . . . 0.0 110.613 178.265 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 14.1 t -94.64 -14.23 25.1 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.892 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 35.9 tpp -96.05 -32.22 12.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.154 -176.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.27 38.0 1.16 Allowed Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.706 -0.759 . . . . 0.0 111.876 -179.163 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.786 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 51.8 m-85 -136.05 160.88 37.29 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 50.7 m -151.6 -161.95 1.43 Allowed 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.148 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.965 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 11.3 p-10 -69.17 120.63 15.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.926 0.394 . . . . 0.0 109.997 173.328 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -102.64 58.25 0.79 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.447 0.641 . . . . 0.0 109.305 179.193 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 145.29 -8.1 1.63 Allowed Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.404 -176.411 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 96.82 15.48 39.5 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 121.193 -0.527 . . . . 0.0 111.847 -178.647 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.874 ' HH2' HG23 ' X' ' 47' ' ' ILE . 46.9 p-90 -95.7 -7.05 38.45 Favored 'General case' 0 C--O 1.221 -0.437 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -174.871 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.965 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 6.1 tp -59.06 -24.92 63.3 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.686 0.675 . . . . 0.0 111.11 -175.011 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 38.5 p -93.59 -40.2 10.41 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 121.853 -0.529 . . . . 0.0 110.855 170.673 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 15.8 mmm180 -60.61 -64.41 0.96 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.076 0.465 . . . . 0.0 111.339 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -53.22 -60.46 3.26 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.903 -178.295 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 10.9 mp -54.08 -68.01 0.22 Allowed 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.352 -174.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -47.71 -46.46 29.67 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -176.378 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 23.4 m -66.89 -33.02 74.69 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.7 0.286 . . . . 0.0 111.616 -178.575 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 36' ' ' LYS . . . . . 0.534 ' O ' ' HB2' ' X' ' 39' ' ' ASP . 5.6 mptp? -95.43 26.44 3.86 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 178.876 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 39.0 t30 62.82 50.1 3.43 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 121.238 0.542 . . . . 0.0 110.832 179.315 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.524 ' CE2' ' HD2' ' X' ' 9' ' ' ARG . 92.0 m-85 48.23 53.91 11.09 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.862 -179.623 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' X' X ' 39' ' ' ASP . . . . . 0.534 ' HB2' ' O ' ' X' ' 36' ' ' LYS . 1.8 t0 -93.27 128.78 39.4 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.394 -173.086 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.582 HG23 ' HA ' ' X' ' 13' ' ' SER . 0.0 OUTLIER -89.61 -12.01 9.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.413 171.829 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.97 -36.51 93.16 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.603 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.02 -24.7 14.82 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.875 0.369 . . . . 0.0 110.988 177.552 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.577 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -64.84 -37.99 89.47 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.154 178.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.704 ' HA ' ' CG1' ' X' ' 47' ' ' ILE . 7.2 mp -68.28 -37.35 80.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.292 -178.319 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' X' X ' 45' ' ' ASP . . . . . 0.602 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.0 t70 -55.18 -37.32 66.91 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.832 0.349 . . . . 0.0 110.828 179.274 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 14.3 p -88.73 -29.05 20.11 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.874 HG23 ' HH2' ' X' ' 28' ' ' TRP . 24.6 pt -79.93 43.91 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 O-C-N 121.644 -0.66 . . . . 0.0 112.084 175.788 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 78.79 8.7 1.99 Allowed 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 172.418 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 49' ' ' TYR . . . . . 0.602 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 14.0 m-85 -105.3 55.34 0.69 Allowed 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 170.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 16.2 m -73.07 -6.62 46.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.117 0.484 . . . . 0.0 111.866 -174.252 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 72.0 tttt -125.74 -129.22 0.24 Allowed 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.26 -0.882 . . . . 0.0 108.929 173.506 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 6.8 p80 . . . . . 0 C--N 1.317 -0.839 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.457 177.347 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.749 0 N-CA-C 111.997 -0.441 . . . . 0.0 111.997 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 50.7 m -124.57 113.3 27.36 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-O 120.775 0.321 . . . . 0.0 111.157 179.278 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 3' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -69.56 140.16 42.76 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.373 2.049 . . . . 0.0 111.688 178.597 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -75.42 37.18 0.49 Allowed 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.522 2.148 . . . . 0.0 112.775 179.913 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -134.57 -5.9 2.54 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.247 -178.617 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -168.6 37.5 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.443 -178.157 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -86.0 145.91 41.94 Favored Pre-proline 0 C--N 1.32 -0.675 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 173.74 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -43.08 -26.79 0.83 Allowed 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.189 2.593 . . . . 0.0 113.191 -179.119 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 9' ' ' ARG . . . . . 0.506 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 69.1 mtt85 -80.03 -44.22 20.52 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.927 177.992 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.671 HD22 ' HB2' ' X' ' 14' ' ' LEU . 86.1 mt -98.07 -15.43 20.01 Favored 'General case' 0 C--O 1.217 -0.652 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -172.367 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.515 ' O ' ' HB2' ' X' ' 15' ' ' SER . 11.7 tt -71.8 -17.09 19.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 169.348 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 46.5 tp10 -94.46 -58.63 2.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.4 -1.273 . . . . 0.0 111.191 175.412 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 14.1 m -91.89 -22.66 19.95 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -170.251 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.671 ' HB2' HD22 ' X' ' 10' ' ' LEU . 53.4 tp -94.3 -48.03 6.35 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 177.679 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.515 ' HB2' ' O ' ' X' ' 11' ' ' ILE . 45.0 m -66.89 -18.87 65.59 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.689 -176.345 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 5.0 tm0? -60.39 -49.19 78.55 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.161 0.505 . . . . 0.0 110.333 173.944 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.648 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 4.5 ppp? -91.31 -21.07 21.23 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.325 -177.04 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' X' X ' 18' ' ' LEU . . . . . 0.412 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 28.6 tp -69.62 -39.56 77.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.835 -179.985 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 21.0 p -72.7 -41.95 64.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.637 -179.571 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 15.5 tpt -71.61 -29.53 64.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.475 -176.198 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.48 47.23 1.7 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.041 -1.076 . . . . 0.0 112.066 -178.947 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.648 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 31.5 m-85 -106.96 172.2 6.95 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 174.345 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' X' X ' 23' ' ' SER . . . . . 0.435 ' O ' HG22 ' X' ' 47' ' ' ILE . 10.7 m -148.24 169.95 18.96 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 119.976 -0.69 . . . . 0.0 110.254 179.187 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.637 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 8.2 p-10 -71.24 140.92 50.58 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 170.98 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -116.35 65.85 0.71 Allowed 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.87 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 139.1 -3.56 2.78 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.662 -175.942 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 83.13 26.23 45.25 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.978 -179.575 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.775 ' HH2' HG23 ' X' ' 47' ' ' ILE . 55.0 p-90 -96.94 -17.93 19.79 Favored 'General case' 0 C--O 1.216 -0.683 0 CA-C-O 119.081 -0.485 . . . . 0.0 112.152 -176.353 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.637 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 35.3 tp -47.46 -45.55 26.01 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -168.303 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 30.2 p -69.05 -49.16 59.97 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.746 0.307 . . . . 0.0 110.878 176.017 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 31' ' ' ARG . . . . . 0.567 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 4.2 mtm180 -57.47 -60.59 3.42 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.617 -178.647 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' X' X ' 32' ' ' LEU . . . . . 0.479 ' O ' ' HB2' ' X' ' 36' ' ' LYS . 2.1 tm? -48.67 -55.03 12.46 Favored 'General case' 0 C--O 1.23 0.079 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.25 -178.543 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 92.6 mt -59.88 -67.7 0.36 Allowed 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.751 -178.373 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -43.19 -56.15 3.58 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -175.166 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 32.3 p -67.12 -27.54 67.41 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -175.917 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 36' ' ' LYS . . . . . 0.479 ' HB2' ' O ' ' X' ' 32' ' ' LEU . 1.9 tttm -97.45 37.55 1.35 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.171 179.951 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 43.1 45.83 4.75 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.483 0.713 . . . . 0.0 112.119 -176.866 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.506 ' CD2' ' HB3' ' X' ' 9' ' ' ARG . 24.4 m-85 56.84 68.28 0.88 Allowed 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.987 178.924 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -106.92 122.53 46.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.1 -178.651 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.656 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -89.85 -8.14 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.95 173.614 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.38 -43.0 97.73 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.214 177.666 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -94.45 -22.28 18.38 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.473 -0.364 . . . . 0.0 111.212 177.776 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.656 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -68.0 -38.83 83.1 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.792 178.741 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.779 HD12 HD11 ' X' ' 47' ' ' ILE . 6.9 mp -62.83 -33.26 74.86 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.654 -179.076 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' X' X ' 45' ' ' ASP . . . . . 0.474 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 18.9 t70 -53.15 -45.44 68.43 Favored 'General case' 0 C--N 1.33 -0.245 0 O-C-N 123.333 0.396 . . . . 0.0 111.468 178.272 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 3.2 p -96.45 -5.23 40.11 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 -176.124 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.779 HD11 HD12 ' X' ' 44' ' ' LEU . 23.6 pt -96.75 42.28 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 O-C-N 121.572 -0.705 . . . . 0.0 111.322 173.547 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 80.94 30.82 0.16 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.034 0.933 . . . . 0.0 112.634 174.453 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 49' ' ' TYR . . . . . 0.527 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 33.3 m-85 -136.03 56.3 1.83 Allowed 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 170.49 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 4.2 t -91.02 20.5 4.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.985 0.421 . . . . 0.0 111.282 -174.564 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 47.2 mttm -119.2 19.01 12.96 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.319 177.761 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 36.0 m170 . . . . . 0 C--O 1.244 0.806 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.823 -179.596 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' X' X ' 1' ' ' GLY . . . . . 0.498 ' O ' ' HD3' ' X' ' 3' ' ' PRO . . . . . . . . 0 N--CA 1.483 1.805 0 N-CA-C 112.003 -0.439 . . . . 0.0 112.003 . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 24.6 m -106.79 98.36 20.75 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-O 120.685 0.278 . . . . 0.0 110.858 -179.285 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' X' X ' 3' ' ' PRO . . . . . 0.498 ' HD3' ' O ' ' X' ' 1' ' ' GLY . 1.4 Cg_endo -82.27 179.33 5.57 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 123.217 2.611 . . . . 0.0 110.227 175.981 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 4' ' ' PRO . . . . . 0.479 ' O ' ' HB2' ' X' ' 7' ' ' ASP . 78.2 Cg_exo -48.85 134.41 28.41 Favored 'Trans proline' 0 C--N 1.355 0.915 0 C-N-CA 121.936 1.757 . . . . 0.0 111.341 177.208 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 5' ' ' GLU . . . . . 0.448 ' O ' ' HB3' ' X' ' 6' ' ' ALA . 23.7 tt0 -78.41 107.97 11.43 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 -175.341 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 6' ' ' ALA . . . . . 0.448 ' HB3' ' O ' ' X' ' 5' ' ' GLU . . . 80.01 50.43 0.03 OUTLIER 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 -168.067 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 7' ' ' ASP . . . . . 0.654 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 54.5 t0 -80.19 133.44 57.31 Favored Pre-proline 0 CA--C 1.506 -0.732 0 CA-C-N 113.693 -1.594 . . . . 0.0 107.521 177.916 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 8' ' ' PRO . . . . . 0.654 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 80.6 Cg_exo -40.56 -26.14 0.21 Allowed 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.908 2.405 . . . . 0.0 112.818 179.814 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 77.9 mtm180 -72.48 -53.03 13.26 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.41 175.263 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.498 ' HA ' ' HB3' ' X' ' 13' ' ' SER . 4.5 mp -95.72 -23.77 16.83 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -174.318 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.573 ' HA ' ' HB2' ' X' ' 15' ' ' SER . 0.0 OUTLIER -62.73 -28.01 44.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.76 0.79 . . . . 0.0 109.016 177.086 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' X' X ' 12' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' X' ' 16' ' ' GLN . 81.9 mt-10 -93.9 -22.09 18.83 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.576 174.937 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 13' ' ' SER . . . . . 0.498 ' HB3' ' HA ' ' X' ' 10' ' ' LEU . 29.7 t -98.56 -61.03 1.43 Allowed 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -175.824 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.506 ' HG ' HD11 ' X' ' 29' ' ' LEU . 8.3 tt -92.58 -40.26 10.88 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-O 121.074 0.464 . . . . 0.0 109.749 -174.09 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.573 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 23.2 m -66.5 -26.91 67.39 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.009 -176.031 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 16' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' X' ' 12' ' ' GLU . 5.3 pp0? -69.3 -30.22 68.25 Favored 'General case' 0 C--O 1.228 -0.067 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.046 -179.425 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.948 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 18.9 ptm -96.39 -32.95 12.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.25 -179.517 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 61.1 tp -55.13 -43.65 74.33 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 123.427 0.454 . . . . 0.0 111.592 -178.215 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 16.3 p -98.93 9.74 42.86 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -177.157 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 35.0 ttp -111.22 -12.85 14.07 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.63 -176.413 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 115.19 19.82 5.77 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.336 -0.935 . . . . 0.0 112.398 179.604 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.948 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 28.0 m-85 -116.63 163.11 16.6 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 107.734 -1.209 . . . . 0.0 107.734 170.892 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 47.5 m -154.65 -138.01 0.07 Allowed 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 120.201 -0.599 . . . . 0.0 109.919 179.96 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.773 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 25.0 p-10 -110.75 116.29 31.03 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.238 0.542 . . . . 0.0 110.907 176.298 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 25' ' ' GLU . . . . . 0.738 ' HG3' ' HA ' ' X' ' 47' ' ' ILE . 1.9 mm-40 -83.76 54.18 2.8 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.218 0.532 . . . . 0.0 110.9 177.631 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 136.08 2.65 2.67 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.561 -179.188 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' X' X ' 27' ' ' GLY . . . . . 0.459 ' HA2' ' OD2' ' X' ' 24' ' ' ASP . . . 87.86 13.6 64.35 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.645 179.39 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.77 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 42.4 p-90 -85.49 -13.24 49.72 Favored 'General case' 0 C--O 1.217 -0.657 0 O-C-N 122.629 -0.336 . . . . 0.0 111.046 179.64 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.773 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 54.5 tp -56.06 -24.26 38.63 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.366 -175.723 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 53.2 p -93.86 -21.81 19.02 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.793 -0.185 . . . . 0.0 111.43 176.339 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' X' X ' 31' ' ' ARG . . . . . 0.618 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 0.2 OUTLIER -95.02 -56.36 2.77 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 120.568 0.223 . . . . 0.0 111.528 -177.339 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -44.97 -68.85 0.16 Allowed 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 124.046 0.938 . . . . 0.0 112.063 -174.507 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.795 ' HB2' ' HA ' ' X' ' 38' ' ' TYR . 0.9 OUTLIER -67.59 -25.61 65.85 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.873 -0.331 . . . . 0.0 111.785 -176.153 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' X' X ' 34' ' ' GLN . . . . . 0.459 ' N ' HD12 ' X' ' 33' ' ' LEU . 10.4 tp60 -63.7 -31.43 72.6 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 122.21 -0.307 . . . . 0.0 111.685 179.481 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 35' ' ' THR . . . . . 0.43 HG22 ' O ' ' X' ' 31' ' ' ARG . 4.9 t -99.26 -10.77 21.97 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 122.229 -0.294 . . . . 0.0 111.701 -179.214 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -114.39 39.92 2.66 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -174.868 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 50.29 34.84 9.45 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.666 0.786 . . . . 0.0 112.025 -178.129 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.795 ' HA ' ' HB2' ' X' ' 33' ' ' LEU . 68.8 m-85 64.69 69.39 0.5 Allowed 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.786 178.512 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -93.26 107.21 19.07 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 113.972 -1.467 . . . . 0.0 111.176 -172.698 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.635 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.5 OUTLIER -92.24 -4.07 10.75 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.432 172.671 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -74.64 -34.23 54.15 Favored Glycine 0 N--CA 1.441 -1.014 0 C-N-CA 120.003 -1.094 . . . . 0.0 111.027 175.391 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.73 -25.0 15.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.778 -0.711 . . . . 0.0 110.979 177.327 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.689 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -64.52 -42.72 95.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.234 179.859 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.631 HD13 ' O ' ' X' ' 40' ' ' ILE . 10.9 mp -67.03 -27.68 67.6 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.909 179.614 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 45' ' ' ASP . . . . . 0.535 ' O ' ' HB2' ' X' ' 50' ' ' SER . 2.5 t70 -66.82 -58.01 5.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.193 174.798 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 21.2 p -61.9 -20.15 63.45 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 -174.064 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.77 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 1.8 pt -89.62 -30.05 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 C-N-CA 119.395 -0.922 . . . . 0.0 112.635 179.438 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 48' ' ' GLN . . . . . 0.631 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 0.4 OUTLIER -163.28 -43.65 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 117.671 0.214 . . . . 0.0 111.542 -177.924 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -78.03 34.58 0.2 Allowed 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -172.737 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' X' X ' 50' ' ' SER . . . . . 0.535 ' HB2' ' O ' ' X' ' 45' ' ' ASP . 1.1 t -98.19 36.47 1.58 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 175.493 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -155.05 141.8 18.99 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.98 -175.567 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 . . . . . 0 C--O 1.244 0.798 0 CA-C-O 118.312 -0.852 . . . . 0.0 110.551 -179.427 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.783 0 N-CA-C 112.322 -0.311 . . . . 0.0 112.322 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 15.0 m -79.89 119.18 75.85 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-O 120.576 0.227 . . . . 0.0 110.662 -178.997 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' X' X ' 3' ' ' PRO . . . . . 0.475 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 56.6 Cg_endo -72.73 128.5 13.42 Favored 'Trans proline' 0 N--CA 1.464 -0.241 0 C-N-CA 122.468 2.112 . . . . 0.0 112.275 -179.485 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 4' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 10.4 Cg_exo -71.7 24.08 0.24 Allowed 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 122.961 2.441 . . . . 0.0 113.309 -178.604 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -143.35 18.03 1.89 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.255 177.043 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' X' X ' 6' ' ' ALA . . . . . 0.417 ' HA ' ' HB ' ' X' ' 11' ' ' ILE . . . -170.17 15.19 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.038 -177.692 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 7' ' ' ASP . . . . . 0.751 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 37.3 t0 -71.37 136.54 83.96 Favored Pre-proline 0 C--N 1.318 -0.77 0 N-CA-C 106.948 -1.501 . . . . 0.0 106.948 174.88 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 8' ' ' PRO . . . . . 0.751 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 78.5 Cg_exo -38.78 -28.48 0.14 Allowed 'Trans proline' 0 CA--C 1.534 0.507 0 C-N-CA 123.507 2.805 . . . . 0.0 113.186 -177.81 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 28.9 mmm180 -90.44 -50.55 5.89 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.958 176.15 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.712 HD22 ' HB2' ' X' ' 14' ' ' LEU . 96.0 mt -79.09 -15.22 58.48 Favored 'General case' 0 C--O 1.221 -0.446 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -173.284 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.552 ' O ' ' HB3' ' X' ' 15' ' ' SER . 11.8 tt -69.59 -25.92 29.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 174.033 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 12' ' ' GLU . . . . . 0.555 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 48.4 mt-10 -95.9 -45.91 6.76 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.531 174.307 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 13' ' ' SER . . . . . 0.467 ' HA ' HG23 ' X' ' 40' ' ' ILE . 20.4 m -89.67 -34.14 16.37 Favored 'General case' 0 C--O 1.222 -0.373 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -168.757 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.766 ' HG ' HD11 ' X' ' 29' ' ' LEU . 8.7 tt -95.94 -41.78 8.62 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.745 0.783 . . . . 0.0 109.017 -179.676 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.552 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 9.4 t -71.24 -16.08 62.47 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 114.73 -1.123 . . . . 0.0 111.243 -176.935 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 16' ' ' GLN . . . . . 0.555 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 3.8 tm0? -57.58 -58.77 6.84 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-O 120.786 0.327 . . . . 0.0 110.224 177.028 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 17' ' ' MET . . . . . 1.013 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 0.9 OUTLIER -82.91 -22.09 33.99 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.089 -179.298 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' X' X ' 18' ' ' LEU . . . . . 0.482 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 29.4 tp -66.41 -34.79 78.75 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.773 0.32 . . . . 0.0 110.775 -179.376 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 10.7 m -98.63 -36.16 9.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.546 -176.811 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 26.6 ttt -68.33 -31.81 71.48 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -176.209 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.79 46.58 0.6 Allowed Glycine 0 CA--C 1.508 -0.38 0 C-N-CA 119.938 -1.125 . . . . 0.0 113.196 178.617 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 1.013 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 8.9 m-30 -111.97 -174.48 2.47 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 170.758 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 49.9 m -144.66 -161.28 1.26 Allowed 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 119.7 -0.8 . . . . 0.0 111.401 -179.109 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.561 ' HA ' ' CD1' ' X' ' 28' ' ' TRP . 10.5 t0 -115.28 121.23 42.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.422 -177.946 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 25' ' ' GLU . . . . . 0.553 ' OE2' ' HB ' ' X' ' 46' ' ' THR . 4.5 pt-20 -61.61 -25.02 67.08 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -178.214 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 148.63 30.91 0.06 OUTLIER Glycine 0 CA--C 1.519 0.311 0 C-N-CA 120.351 -0.928 . . . . 0.0 113.665 178.948 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' X' X ' 27' ' ' GLY . . . . . 0.564 ' O ' ' HB3' ' X' ' 31' ' ' ARG . . . 126.21 33.91 0.65 Allowed Glycine 0 N--CA 1.446 -0.7 0 C-N-CA 121.026 -0.606 . . . . 0.0 111.674 178.742 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.604 ' HE3' ' HB3' ' X' ' 32' ' ' LEU . 8.5 p-90 -97.67 -39.97 8.82 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-O 120.666 0.269 . . . . 0.0 110.98 -178.263 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.766 HD11 ' HG ' ' X' ' 14' ' ' LEU . 46.1 tp -69.83 -19.15 63.47 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 121.767 -0.583 . . . . 0.0 110.986 -166.45 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 1.7 t -95.0 -31.01 13.82 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.992 170.796 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' X' X ' 31' ' ' ARG . . . . . 0.564 ' HB3' ' O ' ' X' ' 27' ' ' GLY . 40.8 ttt180 -96.36 -62.26 1.3 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -173.191 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 32' ' ' LEU . . . . . 0.604 ' HB3' ' HE3' ' X' ' 28' ' ' TRP . 2.8 tm? -50.62 -63.25 1.18 Allowed 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.441 0.696 . . . . 0.0 111.563 -176.472 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 31.4 mt -45.77 -58.86 3.15 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.574 0.546 . . . . 0.0 111.739 -177.439 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 46.4 mm-40 -46.71 -58.78 3.53 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 123.83 0.707 . . . . 0.0 112.542 -178.947 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 60.9 p -62.5 -28.57 69.93 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.547 -176.889 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' X' X ' 36' ' ' LYS . . . . . 0.514 ' HB3' ' HB2' ' X' ' 39' ' ' ASP . 5.4 mptp? -94.63 39.3 1.1 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.548 176.606 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 52.0 p30 31.82 53.12 0.24 Allowed 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.862 1.265 . . . . 0.0 113.744 -174.358 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' X' X ' 38' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 60.0 56.11 3.53 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.276 178.142 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' X' X ' 39' ' ' ASP . . . . . 0.514 ' HB2' ' HB3' ' X' ' 36' ' ' LYS . 24.5 m-20 -107.14 128.01 54.02 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.277 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.634 ' H ' HD13 ' X' ' 40' ' ' ILE . 0.1 OUTLIER -84.36 -3.13 7.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.732 169.239 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -69.67 -36.44 75.62 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.289 179.248 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.11 -12.49 20.45 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.951 0.405 . . . . 0.0 110.214 175.088 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.605 ' CB ' ' HA ' ' X' ' 40' ' ' ILE . . . -57.2 -53.22 60.52 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.821 -179.666 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.505 ' HG ' ' HE2' ' X' ' 22' ' ' PHE . 10.2 mp -61.35 -38.77 88.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.619 -179.258 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -52.16 -46.05 65.3 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.252 -179.654 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' X' X ' 46' ' ' THR . . . . . 0.553 ' HB ' ' OE2' ' X' ' 25' ' ' GLU . 36.7 p -78.12 -35.11 49.53 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -171.44 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.544 HG12 ' O ' ' X' ' 43' ' ' ALA . 6.7 pt -96.25 -25.19 4.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 -168.999 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -153.64 -26.68 0.14 Allowed 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -178.207 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -101.33 54.7 0.83 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -178.284 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 17.3 m -92.12 8.24 38.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.72 -174.964 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' X' X ' 51' ' ' LYS . . . . . 0.684 ' HE2' ' HA ' ' X' ' 51' ' ' LYS . 10.0 mmpt? -130.75 133.13 45.76 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 176.041 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 60.1 t60 . . . . . 0 C--O 1.247 0.925 0 CA-C-O 118.491 -0.766 . . . . 0.0 110.596 -176.729 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.712 0 N-CA-C 112.219 -0.353 . . . . 0.0 112.219 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' X' X ' 2' ' ' SER . . . . . 0.406 ' HA ' ' HD3' ' X' ' 3' ' ' PRO . 66.2 m -109.43 123.95 35.23 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 120.62 0.248 . . . . 0.0 110.777 179.759 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' X' X ' 3' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' X' ' 2' ' ' SER . 6.9 Cg_exo -73.42 133.93 19.9 Favored 'Trans proline' 0 CA--C 1.529 0.24 0 C-N-CA 122.795 2.33 . . . . 0.0 111.776 179.565 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -53.77 127.32 25.03 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 122.981 2.454 . . . . 0.0 112.931 -178.43 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 71.03 23.62 4.17 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 123.737 0.648 . . . . 0.0 110.953 -178.781 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -154.95 36.37 0.4 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 177.943 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 7' ' ' ASP . . . . . 0.454 ' O ' HG22 ' X' ' 11' ' ' ILE . 80.9 m-20 -70.38 155.49 93.35 Favored Pre-proline 0 CA--C 1.507 -0.703 0 CA-C-N 114.605 -1.18 . . . . 0.0 109.179 179.564 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -53.0 -18.37 9.45 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 122.134 1.889 . . . . 0.0 111.438 172.086 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 15.1 mmm180 -93.71 -35.82 12.61 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.353 179.744 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.684 HD22 ' HG ' ' X' ' 14' ' ' LEU . 63.9 mt -98.26 -25.33 14.9 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.792 -171.671 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.529 ' HA ' ' HB2' ' X' ' 15' ' ' SER . 10.6 tt -70.48 -14.53 18.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 171.032 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -96.58 -52.29 4.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.673 -1.148 . . . . 0.0 111.2 175.341 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 7.7 t -94.46 -32.71 13.4 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -168.963 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.684 ' HG ' HD22 ' X' ' 10' ' ' LEU . 32.3 mt -92.51 -39.16 11.54 Favored 'General case' 0 CA--C 1.506 -0.721 0 O-C-N 121.556 -0.715 . . . . 0.0 109.63 178.481 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.529 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 8.2 t -63.3 -22.31 66.8 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.519 -175.905 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.73 -29.17 63.13 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 120.411 -0.516 . . . . 0.0 109.997 176.919 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' X' X ' 17' ' ' MET . . . . . . . . . . . . . 26.2 mtt -72.21 -40.13 68.06 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.325 171.886 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 11.1 mp -68.43 -14.13 62.79 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.453 178.911 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 2.8 t -98.92 -40.98 7.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.934 -178.389 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 83.8 mtp -83.92 -32.4 25.13 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -176.986 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.32 46.91 0.67 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.384 -0.912 . . . . 0.0 112.396 -179.548 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -117.14 160.94 20.23 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 174.134 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 13.8 m -140.9 -136.71 0.11 Allowed 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 120.196 -0.602 . . . . 0.0 110.145 -179.659 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.551 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 7.9 p-10 -121.77 122.3 39.2 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.164 173.001 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' X' X ' 25' ' ' GLU . . . . . 0.784 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 40.1 tt0 -67.68 -48.02 67.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.36 0.6 . . . . 0.0 110.377 -179.325 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -129.02 19.88 5.43 Favored Glycine 0 C--N 1.32 -0.326 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.992 -178.838 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 87.93 4.87 78.16 Favored Glycine 0 C--O 1.228 -0.256 0 C-N-CA 120.539 -0.839 . . . . 0.0 112.688 178.462 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.786 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 36.3 p-90 -75.04 -9.16 58.28 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -178.985 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.551 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 59.0 tp -53.85 -23.56 12.85 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 -171.316 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' X' X ' 30' ' ' THR . . . . . 0.638 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 43.9 p -84.59 -63.82 1.27 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.646 170.79 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' X' X ' 31' ' ' ARG . . . . . 0.568 ' CG ' ' HA ' ' X' ' 28' ' ' TRP . 12.1 ptm180 -57.07 -45.72 83.05 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -175.434 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -53.23 -64.4 0.83 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.782 0.325 . . . . 0.0 110.653 -178.347 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.545 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.7 mp -65.76 -43.69 88.11 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.891 -175.671 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' X' X ' 34' ' ' GLN . . . . . 0.638 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.0 OUTLIER -54.81 -38.92 67.94 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -178.293 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 19.3 m -85.05 -12.31 53.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.304 0.574 . . . . 0.0 110.892 -178.681 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -112.37 37.9 2.89 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.354 179.768 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 43.37 40.62 2.72 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.648 0.779 . . . . 0.0 112.733 -178.345 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.545 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 64.4 m-85 64.04 67.89 0.59 Allowed 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.688 177.771 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -105.67 120.1 40.81 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.13 -176.443 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.708 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -91.26 -9.54 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 CA-C-O 121.033 0.444 . . . . 0.0 110.198 170.771 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.23 -34.65 81.14 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.394 -0.907 . . . . 0.0 111.517 176.978 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.27 -14.86 19.07 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.947 -0.626 . . . . 0.0 110.987 176.062 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.708 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -75.84 -33.57 60.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.242 -179.16 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.631 ' HA ' HD11 ' X' ' 47' ' ' ILE . 10.9 mp -72.89 -23.56 60.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.946 0.403 . . . . 0.0 110.053 177.359 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' X' X ' 45' ' ' ASP . . . . . 0.471 ' OD1' ' HA ' ' X' ' 50' ' ' SER . 17.3 t70 -68.62 -29.07 67.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.009 174.981 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 13.3 p -96.84 -14.96 21.51 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 -172.669 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.786 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 1.2 pp -97.84 -28.77 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 119.715 1.143 . . . . 0.0 113.104 -179.41 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' X' X ' 48' ' ' GLN . . . . . 0.489 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 2.0 mp0 -161.19 -59.35 0.05 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.014 0.435 . . . . 0.0 110.573 179.853 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -69.96 -179.15 1.78 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.919 -175.668 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' X' X ' 50' ' ' SER . . . . . 0.472 ' C ' ' HD2' ' X' ' 51' ' ' LYS . 28.1 m -153.33 26.42 0.52 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.79 0.328 . . . . 0.0 111.436 -177.851 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' X' X ' 51' ' ' LYS . . . . . 0.472 ' HD2' ' C ' ' X' ' 50' ' ' SER . 12.7 mptt -132.42 129.43 39.28 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 178.055 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 60.1 m170 . . . . . 0 C--O 1.245 0.821 0 CA-C-O 118.652 -0.689 . . . . 0.0 110.68 -177.265 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.822 0 N-CA-C 112.095 -0.402 . . . . 0.0 112.095 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 48.2 m -64.2 119.96 60.38 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-O 120.862 0.363 . . . . 0.0 111.066 -179.582 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' X' X ' 3' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -95.05 176.02 1.0 Allowed 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 123.254 2.636 . . . . 0.0 112.63 -177.148 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' X' X ' 4' ' ' PRO . . . . . 0.92 ' HB2' ' HB2' ' X' ' 7' ' ' ASP . 31.8 Cg_exo -58.28 167.09 5.06 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.617 2.211 . . . . 0.0 112.47 178.405 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -84.1 90.02 7.39 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.242 -176.539 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . 59.05 63.54 1.6 Allowed 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.63 0.729 . . . . 0.0 109.929 -177.549 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' X' X ' 7' ' ' ASP . . . . . 0.92 ' HB2' ' HB2' ' X' ' 4' ' ' PRO . 9.2 t70 -91.44 147.29 35.05 Favored Pre-proline 0 C--N 1.317 -0.812 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 179.211 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 8' ' ' PRO . . . . . 0.621 ' HA ' HG22 ' X' ' 11' ' ' ILE . 79.0 Cg_exo -42.07 -23.77 0.27 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.115 2.543 . . . . 0.0 113.169 179.824 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 9' ' ' ARG . . . . . 0.436 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 63.5 mtp180 -64.53 -55.59 19.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.946 173.792 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.451 ' HA ' ' OG ' ' X' ' 13' ' ' SER . 5.1 mp -99.41 -26.26 14.19 Favored 'General case' 0 C--O 1.22 -0.465 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -176.739 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.621 HG22 ' HA ' ' X' ' 8' ' ' PRO . 11.6 tt -64.64 -21.23 28.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.337 0.589 . . . . 0.0 109.467 178.751 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -93.63 -33.82 13.54 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.041 175.683 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' X' X ' 13' ' ' SER . . . . . 0.636 ' HA ' HG23 ' X' ' 40' ' ' ILE . 56.6 p -96.54 -48.62 5.47 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -173.402 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.442 ' HG ' HD11 ' X' ' 29' ' ' LEU . 8.2 tt -93.49 -42.18 9.38 Favored 'General case' 0 CA--C 1.507 -0.706 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -175.798 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.532 ' CB ' ' HA ' ' X' ' 11' ' ' ILE . 7.3 t -69.78 -22.69 63.32 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.754 -178.497 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 4.5 tm0? -56.33 -59.95 4.22 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.21 0.529 . . . . 0.0 109.993 173.694 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.758 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 11.8 ptm -77.09 -22.52 52.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.457 -176.303 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 20.8 tp -68.4 -39.42 81.68 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.912 0.387 . . . . 0.0 110.382 176.715 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 15.7 t -83.69 -31.35 26.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.186 -179.603 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 37.9 tpp -69.26 -29.23 67.09 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.886 0.374 . . . . 0.0 111.249 -177.259 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.21 38.48 1.23 Allowed Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.339 -0.934 . . . . 0.0 112.15 -178.858 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.758 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 14.2 m-30 -117.4 -173.61 2.45 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 176.595 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 60.2 m -159.28 -135.28 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 176.63 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.611 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.2 p30 -121.67 133.75 54.97 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.854 0.359 . . . . 0.0 110.036 171.804 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 25' ' ' GLU . . . . . 0.496 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 21.7 tt0 -87.37 48.47 1.65 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.043 0.449 . . . . 0.0 110.038 178.233 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 148.97 -8.21 0.93 Allowed Glycine 0 CA--C 1.518 0.278 0 C-N-CA 120.281 -0.961 . . . . 0.0 113.646 179.849 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 101.05 15.54 28.08 Favored Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.008 -179.126 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.718 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 43.2 p-90 -91.67 -5.11 54.35 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -176.438 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.611 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 28.4 tp -56.83 -34.14 67.46 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.543 -172.293 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 70.5 p -89.32 -10.54 46.38 Favored 'General case' 0 C--N 1.321 -0.637 0 O-C-N 122.164 -0.335 . . . . 0.0 111.293 176.491 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' X' X ' 31' ' ' ARG . . . . . 0.49 ' HG2' ' HA ' ' X' ' 28' ' ' TRP . 22.6 mmm-85 -94.89 -53.04 3.99 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.021 0.439 . . . . 0.0 111.241 -177.545 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.71 -67.21 0.29 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.656 -177.727 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.557 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.8 mp -54.88 -52.45 62.8 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.531 -177.299 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -41.78 -60.0 1.5 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -177.743 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 2.9 m -66.59 -31.3 71.92 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.242 -176.622 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' X' X ' 36' ' ' LYS . . . . . 0.595 ' HE3' ' OD2' ' X' ' 39' ' ' ASP . 24.4 mtpp -96.56 39.38 1.16 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.968 -176.433 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 45.96 39.95 6.24 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.209 1.003 . . . . 0.0 113.086 179.859 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.557 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 43.5 m-85 59.89 74.12 0.46 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.599 175.69 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 39' ' ' ASP . . . . . 0.595 ' OD2' ' HE3' ' X' ' 36' ' ' LYS . 41.4 p-10 -112.45 138.91 48.52 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.756 0.789 . . . . 0.0 112.437 178.763 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.636 HG23 ' HA ' ' X' ' 13' ' ' SER . 0.0 OUTLIER -90.46 -13.42 9.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.084 175.025 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.5 -50.91 61.63 Favored Glycine 0 N--CA 1.444 -0.813 0 CA-C-N 115.517 -0.765 . . . . 0.0 112.511 -176.774 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -88.5 -16.97 31.32 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.216 -0.492 . . . . 0.0 111.137 178.054 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.502 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -67.66 -46.24 72.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.388 -179.781 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.556 HD13 ' OH ' ' X' ' 49' ' ' TYR . 37.5 mt -72.11 -25.54 61.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.985 0.421 . . . . 0.0 110.524 -179.189 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 45' ' ' ASP . . . . . 0.655 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 9.6 t70 -61.64 -36.86 82.0 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.729 178.507 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 10.7 p -96.03 -3.71 44.38 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 -172.486 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.718 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 1.5 pp -99.78 -27.36 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 C-N-CA 118.379 -1.328 . . . . 0.0 112.614 -177.942 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 48' ' ' GLN . . . . . 0.446 ' N ' HD12 ' X' ' 47' ' ' ILE . 0.0 OUTLIER -158.74 -58.32 0.07 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.753 0.311 . . . . 0.0 110.801 178.701 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' X' X ' 49' ' ' TYR . . . . . 0.655 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 1.3 p90 -105.4 109.6 21.64 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.055 0.455 . . . . 0.0 112.226 -175.303 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 3.2 p -82.06 49.89 1.47 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.836 175.554 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 62.3 mmtt -140.15 129.17 23.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.229 179.57 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 47.1 m170 . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.339 -0.839 . . . . 0.0 110.649 -178.609 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.761 0 N-CA-C 112.4 -0.28 . . . . 0.0 112.4 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' X' X ' 2' ' ' SER . . . . . 0.515 ' HB3' ' OD1' ' X' ' 7' ' ' ASP . 45.9 t -82.86 146.77 53.15 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 178.846 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 3' ' ' PRO . . . . . 0.527 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 77.9 Cg_exo -50.4 137.98 38.96 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.666 2.244 . . . . 0.0 112.031 179.221 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 4' ' ' PRO . . . . . 0.527 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 16.9 Cg_exo -70.92 38.48 0.32 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.995 2.464 . . . . 0.0 113.846 -175.087 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 59.0 mm-40 -132.98 8.07 4.05 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 175.676 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . 173.25 66.2 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.004 -0.998 . . . . 0.0 108.671 -178.671 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' X' X ' 7' ' ' ASP . . . . . 0.589 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 39.2 t70 -107.22 149.72 39.04 Favored Pre-proline 0 C--N 1.315 -0.906 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 -177.88 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 8' ' ' PRO . . . . . 0.589 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 72.2 Cg_exo -47.4 -22.24 2.51 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 122.167 1.911 . . . . 0.0 112.5 179.58 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 9' ' ' ARG . . . . . 0.734 ' HB3' ' HB2' ' X' ' 38' ' ' TYR . 66.1 mtt85 -87.1 -28.82 22.3 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.272 178.185 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.554 HD22 ' HB2' ' X' ' 14' ' ' LEU . 95.7 mt -97.78 -27.58 14.25 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 122.218 -0.301 . . . . 0.0 110.696 -175.569 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.468 ' O ' ' HB3' ' X' ' 15' ' ' SER . 61.1 mt -61.88 -25.37 37.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 174.518 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 12' ' ' GLU . . . . . 0.467 ' HG2' ' O ' ' X' ' 8' ' ' PRO . 6.3 pt-20 -96.39 -58.75 1.99 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.828 171.494 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 13' ' ' SER . . . . . 0.601 ' HB3' HG23 ' X' ' 40' ' ' ILE . 30.8 m -81.18 -26.73 35.78 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -168.275 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.554 ' HB2' HD22 ' X' ' 10' ' ' LEU . 30.6 tp -93.13 -40.29 10.57 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.169 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.468 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 24.4 t -65.16 -26.33 68.12 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.825 -177.762 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.35 -26.96 60.45 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.461 -179.211 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.799 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 20.8 ptm -93.73 -28.1 16.13 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.614 177.878 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 4.2 mp -66.89 -35.63 80.45 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.176 179.374 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 22.4 p -87.49 -27.62 22.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.62 -0.263 . . . . 0.0 111.648 -179.263 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 46.9 tpp -80.84 -32.57 35.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.578 -176.163 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 106.35 47.83 1.03 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.047 -1.073 . . . . 0.0 112.178 -179.4 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.799 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 20.3 m-30 -108.92 168.28 9.47 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 108.083 -1.081 . . . . 0.0 108.083 176.454 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 23' ' ' SER . . . . . 0.614 ' H ' HE22 ' X' ' 48' ' ' GLN . 20.3 m -146.33 -179.33 6.67 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 119.895 -0.722 . . . . 0.0 110.832 179.45 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 24' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -77.95 132.3 37.81 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 172.125 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' X' X ' 25' ' ' GLU . . . . . 0.92 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 50.2 tt0 -76.76 -16.12 59.57 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.331 -0.548 . . . . 0.0 110.035 179.916 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -159.77 -80.11 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 111.505 -0.638 . . . . 0.0 111.505 176.637 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -162.12 32.63 0.33 Allowed Glycine 0 CA--C 1.508 -0.379 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 175.516 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.92 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 56.9 p-90 -98.37 -16.23 19.39 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -175.325 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.574 ' HA ' ' CE3' ' X' ' 28' ' ' TRP . 60.0 tp -51.16 -48.67 61.83 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -164.762 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 30' ' ' THR . . . . . 0.544 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 40.8 p -75.86 -10.85 59.77 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.823 -0.548 . . . . 0.0 111.536 178.421 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 30.9 ttt180 -94.6 -54.87 3.34 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.37 0.268 . . . . 0.0 111.677 -179.688 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -52.47 -49.9 63.76 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.385 0.674 . . . . 0.0 110.4 179.671 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.92 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 73.1 mt -62.59 -53.68 50.99 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.564 179.25 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 34' ' ' GLN . . . . . 0.544 ' HB2' ' O ' ' X' ' 30' ' ' THR . 30.2 tp60 -39.29 -56.81 1.47 Allowed 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.99 1.107 . . . . 0.0 113.99 -174.958 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 34.7 p -65.81 -17.12 64.41 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -174.859 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' X' X ' 36' ' ' LYS . . . . . 0.432 ' O ' ' HB3' ' X' ' 37' ' ' ASN . 50.9 mttm -114.33 30.32 7.38 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -176.568 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 37' ' ' ASN . . . . . 0.432 ' HB3' ' O ' ' X' ' 36' ' ' LYS . 32.2 t30 65.71 28.12 11.13 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.463 0.649 . . . . 0.0 110.311 179.438 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.92 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 50.1 m-85 60.8 68.25 0.76 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.525 -173.205 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -103.35 133.01 49.13 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.565 -174.362 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.854 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.1 OUTLIER -90.21 -3.99 10.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.136 175.805 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.41 -41.18 99.78 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 120.32 -0.943 . . . . 0.0 111.815 179.201 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -100.47 -14.88 18.09 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.949 -0.626 . . . . 0.0 111.015 175.391 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.854 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -72.26 -41.03 67.21 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.591 178.569 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.892 HD12 HD11 ' X' ' 47' ' ' ILE . 6.4 mp -56.06 -32.11 63.79 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 123.537 0.523 . . . . 0.0 111.202 179.794 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -51.76 -48.35 63.76 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.093 176.206 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 16.9 p -96.08 -20.15 18.88 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -175.453 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.892 HD11 HD12 ' X' ' 44' ' ' LEU . 7.2 pt -83.78 43.67 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 O-C-N 121.607 -0.683 . . . . 0.0 112.025 177.729 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 48' ' ' GLN . . . . . 0.614 HE22 ' H ' ' X' ' 23' ' ' SER . 2.4 mp0 82.14 34.07 0.08 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.347 1.059 . . . . 0.0 112.874 173.158 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -146.16 55.36 1.16 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.227 0.537 . . . . 0.0 110.768 173.307 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 4.0 t -91.84 54.05 2.35 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.141 179.071 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' X' X ' 51' ' ' LYS . . . . . 0.483 ' HD3' ' N ' ' X' ' 52' ' ' HIS . 8.5 tmtt? -136.68 123.76 21.62 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.168 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' X' X ' 52' ' ' HIS . . . . . 0.483 ' N ' ' HD3' ' X' ' 51' ' ' LYS . 55.9 m170 . . . . . 0 C--O 1.247 0.926 0 CA-C-O 118.431 -0.795 . . . . 0.0 110.332 179.681 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.836 0 N-CA-C 111.827 -0.509 . . . . 0.0 111.827 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' X' X ' 2' ' ' SER . . . . . 0.539 ' HB3' ' HA ' ' X' ' 7' ' ' ASP . 15.2 m -110.27 100.82 45.9 Favored Pre-proline 0 C--N 1.324 -0.54 0 O-C-N 122.66 -0.318 . . . . 0.0 111.129 -177.511 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 3' ' ' PRO . . . . . 0.413 ' C ' ' H ' ' X' ' 5' ' ' GLU . 7.3 Cg_exo -72.82 155.63 53.47 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 123.019 2.479 . . . . 0.0 111.74 179.194 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 4' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 14.4 Cg_exo -69.95 24.0 0.18 Allowed 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 123.098 2.532 . . . . 0.0 113.615 -178.802 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 5' ' ' GLU . . . . . 0.413 ' H ' ' C ' ' X' ' 3' ' ' PRO . 97.4 mt-10 -143.58 15.45 1.8 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.03 174.728 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -167.74 31.32 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.731 -178.686 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' X' X ' 7' ' ' ASP . . . . . 0.539 ' HA ' ' HB3' ' X' ' 2' ' ' SER . 35.8 t70 -77.31 148.11 77.09 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 114.932 -1.031 . . . . 0.0 108.284 177.975 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 8' ' ' PRO . . . . . 0.532 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 86.4 Cg_exo -41.54 -34.97 2.26 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.645 2.23 . . . . 0.0 112.33 179.312 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 31.1 mmt-85 -77.97 -56.17 4.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.587 174.83 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.484 HD22 ' HB2' ' X' ' 14' ' ' LEU . 77.4 mt -73.0 -29.78 63.28 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-N 115.348 -0.842 . . . . 0.0 112.604 -169.034 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.503 ' O ' ' HB2' ' X' ' 15' ' ' SER . 12.1 tt -64.25 -20.82 27.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.656 0.741 . . . . 0.0 109.613 175.476 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 12' ' ' GLU . . . . . 0.457 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 40.1 tt0 -96.26 -58.48 2.06 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.388 175.246 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 16.4 t -91.93 -23.19 19.68 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -168.56 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.717 HD11 ' HG ' ' X' ' 29' ' ' LEU . 16.1 tp -92.18 -45.72 8.11 Favored 'General case' 0 CA--C 1.504 -0.802 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 177.145 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.579 ' HA ' ' HB2' ' X' ' 18' ' ' LEU . 48.8 m -64.97 -18.38 65.22 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.158 178.017 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 16' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 11.8 tm0? -57.44 -42.07 81.7 Favored 'General case' 0 CA--C 1.521 -0.151 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 173.276 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.512 ' HB3' ' HB2' ' X' ' 22' ' ' PHE . 1.9 mtp -86.98 -35.7 18.69 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.722 -176.957 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 18' ' ' LEU . . . . . 0.579 ' HB2' ' HA ' ' X' ' 15' ' ' SER . 3.8 mm? -62.38 -44.98 95.19 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.667 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 50.6 p -86.92 -24.55 24.78 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 -175.023 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 51.0 ttm -78.77 -32.26 46.47 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.755 0.312 . . . . 0.0 110.88 -177.674 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 112.75 47.45 0.67 Allowed Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.215 -0.993 . . . . 0.0 112.081 -179.506 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.512 ' HB2' ' HB3' ' X' ' 17' ' ' MET . 12.6 m-30 -114.7 163.83 14.9 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 176.341 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 23' ' ' SER . . . . . 0.473 ' O ' HG22 ' X' ' 47' ' ' ILE . 72.0 m -150.1 150.46 31.72 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.499 -179.855 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.669 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 0.6 OUTLIER -71.07 129.05 37.97 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.389 0.614 . . . . 0.0 111.688 178.869 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' X' X ' 25' ' ' GLU . . . . . 0.809 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 30.8 tt0 -56.76 -30.04 63.2 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.71 178.581 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -146.3 -19.22 0.13 Allowed Glycine 0 CA--C 1.521 0.448 0 C-N-CA 120.351 -0.928 . . . . 0.0 114.113 -178.389 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' X' X ' 27' ' ' GLY . . . . . 0.402 ' H ' ' HB2' ' X' ' 24' ' ' ASP . . . 126.72 27.15 1.07 Allowed Glycine 0 C--O 1.228 -0.234 0 C-N-CA 120.409 -0.901 . . . . 0.0 112.224 -177.781 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.809 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 38.8 p-90 -96.36 -4.62 41.63 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 123.127 0.571 . . . . 0.0 111.57 -178.472 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.717 ' HG ' HD11 ' X' ' 14' ' ' LEU . 63.5 tp -47.87 -32.65 6.47 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -167.885 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 60.8 p -90.36 -40.13 12.28 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 121.917 -0.489 . . . . 0.0 111.432 175.365 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' X' X ' 31' ' ' ARG . . . . . 0.674 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -72.98 -37.27 67.1 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -173.628 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -61.99 -55.51 28.61 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.132 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.579 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 10.5 mp -56.6 -50.39 72.1 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.643 178.125 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 30.9 tp60 -48.55 -44.43 36.48 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -179.696 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 8.6 m -72.67 -37.44 67.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.921 0.391 . . . . 0.0 110.845 179.707 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' X' X ' 36' ' ' LYS . . . . . 0.467 ' O ' ' HB2' ' X' ' 39' ' ' ASP . 5.1 mptp? -90.98 37.3 0.92 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.492 179.509 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 41.91 53.88 4.06 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.669 0.788 . . . . 0.0 112.667 -178.187 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.579 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 34.6 m-85 54.72 62.91 2.33 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.374 178.009 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 39' ' ' ASP . . . . . 0.467 ' HB2' ' O ' ' X' ' 36' ' ' LYS . 32.4 t0 -118.05 134.27 55.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.917 -176.053 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.777 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.1 OUTLIER -89.72 -7.53 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.271 170.601 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.4 -35.02 90.38 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.306 -179.731 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -100.03 -22.16 15.34 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.527 -0.336 . . . . 0.0 110.606 175.285 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.777 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -68.25 -37.66 81.01 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.328 -179.924 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.727 HD13 ' HB ' ' X' ' 40' ' ' ILE . 9.2 mp -68.75 -17.84 64.11 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.735 0.302 . . . . 0.0 111.173 179.162 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -83.92 -29.99 26.69 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.96 0.41 . . . . 0.0 110.463 176.667 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 15.2 p -96.01 -21.69 17.84 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -172.29 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.76 HG23 ' HH2' ' X' ' 28' ' ' TRP . 1.1 pp -67.16 -26.12 35.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 119.525 -0.87 . . . . 0.0 111.476 -173.955 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 48' ' ' GLN . . . . . 0.616 ' HB3' ' O ' ' X' ' 47' ' ' ILE . 0.1 OUTLIER 153.95 -5.66 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.682 1.193 . . . . 0.0 110.374 169.739 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' X' X ' 49' ' ' TYR . . . . . 0.54 ' H ' HD12 ' X' ' 47' ' ' ILE . 11.3 m-30 -86.66 57.76 4.68 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.305 174.081 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 7.6 m -86.27 26.22 1.07 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.556 -176.843 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 5.0 tmtp? 72.46 68.54 0.13 Allowed 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 -176.082 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 72.2 t60 . . . . . 0 C--O 1.244 0.802 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.414 -175.201 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.97 0 N-CA-C 112.117 -0.393 . . . . 0.0 112.117 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 14.5 p -63.53 126.48 89.63 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.544 0.172 . . . . 0.0 111.148 -178.184 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' X' X ' 3' ' ' PRO . . . . . 0.464 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 33.0 Cg_exo -59.23 118.1 4.94 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.722 2.281 . . . . 0.0 111.796 -179.947 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 4' ' ' PRO . . . . . 0.522 ' HA ' HD12 ' X' ' 10' ' ' LEU . 3.5 Cg_exo -82.14 32.9 0.52 Allowed 'Trans proline' 0 CA--C 1.53 0.303 0 C-N-CA 123.041 2.494 . . . . 0.0 113.891 -173.492 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -137.79 15.68 2.89 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 121.108 -0.237 . . . . 0.0 111.304 178.14 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -179.42 31.91 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.444 0 CA-C-O 121.374 0.607 . . . . 0.0 109.568 178.574 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' X' X ' 7' ' ' ASP . . . . . 0.527 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 38.7 t70 -81.36 143.56 52.1 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 179.085 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 8' ' ' PRO . . . . . 0.527 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 82.9 Cg_exo -42.53 -30.92 1.73 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.662 2.242 . . . . 0.0 112.562 179.295 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 9' ' ' ARG . . . . . 0.49 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 39.3 mmt180 -87.76 -52.07 5.51 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.021 177.324 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.522 HD12 ' HA ' ' X' ' 4' ' ' PRO . 91.8 mt -81.54 -14.08 57.31 Favored 'General case' 0 C--O 1.216 -0.697 0 CA-C-N 116.0 -0.546 . . . . 0.0 112.446 -171.404 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.502 ' HA ' ' CB ' ' X' ' 15' ' ' SER . 13.9 tt -66.05 -24.76 34.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.4 0.619 . . . . 0.0 109.604 175.873 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -94.47 -28.86 15.24 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.963 174.528 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' X' X ' 13' ' ' SER . . . . . 0.415 ' HB2' ' HA ' ' X' ' 10' ' ' LEU . 16.3 m -96.21 -54.33 3.33 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -171.132 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.421 ' HG ' ' HG ' ' X' ' 29' ' ' LEU . 9.9 tt -94.81 -46.74 6.76 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 -176.429 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.502 ' CB ' ' HA ' ' X' ' 11' ' ' ILE . 14.4 m -63.2 -25.53 68.38 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.178 -177.991 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 16' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' X' ' 20' ' ' MET . 2.5 tm0? -61.37 -47.68 84.74 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.029 0.442 . . . . 0.0 109.901 174.703 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.603 ' SD ' HD13 ' X' ' 47' ' ' ILE . 42.1 mtt -77.74 -39.8 43.13 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.046 -177.473 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 35.6 tp -64.47 -37.77 88.69 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.235 -177.723 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 3.7 t -85.7 -22.23 27.93 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.628 0.251 . . . . 0.0 110.932 -178.633 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' X' X ' 20' ' ' MET . . . . . 0.401 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 15.4 tpt -78.01 -32.42 51.1 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.925 0.393 . . . . 0.0 110.887 -178.733 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.6 34.53 1.55 Allowed Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.836 -177.89 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.495 ' HB2' ' HB3' ' X' ' 17' ' ' MET . 14.8 m-30 -110.33 -177.31 3.21 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 174.284 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -151.13 -178.33 6.56 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.113 178.54 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' X' X ' 24' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -94.35 144.16 25.78 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 173.973 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' X' X ' 25' ' ' GLU . . . . . 0.507 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 29.4 tt0 -107.5 57.3 0.63 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.151 0.5 . . . . 0.0 110.189 179.65 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.38 -29.31 2.29 Favored Glycine 0 CA--C 1.517 0.191 0 C-N-CA 120.65 -0.786 . . . . 0.0 113.076 179.407 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 120.03 16.16 4.95 Favored Glycine 0 CA--C 1.506 -0.528 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 -177.931 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.906 ' HH2' HG23 ' X' ' 47' ' ' ILE . 60.9 p-90 -84.97 -11.85 54.59 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.132 -0.534 . . . . 0.0 111.347 -177.91 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.421 ' HG ' ' HG ' ' X' ' 14' ' ' LEU . 30.7 tp -66.17 -19.59 65.88 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.393 -0.817 . . . . 0.0 110.018 -176.914 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 30' ' ' THR . . . . . 0.46 ' O ' ' HG3' ' X' ' 34' ' ' GLN . 0.1 OUTLIER -95.74 -31.54 13.16 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.921 167.814 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' X' X ' 31' ' ' ARG . . . . . 0.739 ' HB3' ' HA ' ' X' ' 28' ' ' TRP . 50.0 ttt-85 -87.27 -65.88 0.97 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 -174.256 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 32' ' ' LEU . . . . . 0.882 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 3.3 tm? -41.67 -59.83 1.53 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.022 0.929 . . . . 0.0 111.39 179.307 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.415 HD12 ' O ' ' X' ' 29' ' ' LEU . 65.9 mt -47.36 -68.88 0.15 Allowed 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.281 -175.754 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 34' ' ' GLN . . . . . 0.46 ' HG3' ' O ' ' X' ' 30' ' ' THR . 5.3 mt-30 -57.4 -27.37 62.28 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -171.531 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 15.4 m -71.96 -21.74 61.55 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.952 0.406 . . . . 0.0 111.034 179.22 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' X' X ' 36' ' ' LYS . . . . . 0.443 ' HB2' ' HB2' ' X' ' 39' ' ' ASP . 18.5 mtpp -121.28 37.38 4.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.953 -175.661 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 50.6 t30 63.72 39.03 8.9 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.377 0.608 . . . . 0.0 110.737 178.818 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.49 ' CD2' ' HB3' ' X' ' 9' ' ' ARG . 11.4 m-85 55.57 66.35 1.24 Allowed 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.425 -176.784 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 39' ' ' ASP . . . . . 0.443 ' HB2' ' HB2' ' X' ' 36' ' ' LYS . 17.8 t70 -88.86 124.59 34.34 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.034 -0.984 . . . . 0.0 112.177 -169.499 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.662 ' O ' HD13 ' X' ' 44' ' ' LEU . 1.5 mm -89.7 -24.32 5.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.131 175.838 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.19 -33.08 84.14 Favored Glycine 0 N--CA 1.441 -1.027 0 CA-C-N 115.264 -0.88 . . . . 0.0 112.762 -177.701 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -100.16 -21.88 15.38 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.873 0.368 . . . . 0.0 111.387 -178.632 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.617 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -70.89 -32.66 69.7 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.655 178.557 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.814 HD12 HD11 ' X' ' 47' ' ' ILE . 6.3 mp -64.65 -35.25 80.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.757 -178.99 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 45' ' ' ASP . . . . . 0.47 ' HA ' ' HA ' ' X' ' 50' ' ' SER . 2.9 t70 -52.83 -38.92 61.98 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.174 0.296 . . . . 0.0 111.683 179.779 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 2.0 p -96.07 -22.15 17.52 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -176.95 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.906 HG23 ' HH2' ' X' ' 28' ' ' TRP . 16.8 pt -83.34 42.64 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-N 118.478 0.581 . . . . 0.0 112.145 176.915 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 74.74 13.51 3.5 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.359 0.664 . . . . 0.0 112.383 173.912 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -120.59 52.59 1.16 Allowed 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 120.655 0.264 . . . . 0.0 110.501 176.161 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' X' X ' 50' ' ' SER . . . . . 0.47 ' HA ' ' HA ' ' X' ' 45' ' ' ASP . 8.5 t -80.97 9.08 7.01 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.086 0.47 . . . . 0.0 111.723 -176.449 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -140.86 21.25 2.31 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.691 176.645 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 17.4 t-160 . . . . . 0 C--O 1.244 0.775 0 CA-C-O 118.035 -0.983 . . . . 0.0 109.887 -177.193 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.701 0 N-CA-C 111.949 -0.46 . . . . 0.0 111.949 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' X' X ' 2' ' ' SER . . . . . 0.419 ' HA ' ' HD3' ' X' ' 3' ' ' PRO . 35.3 t -90.64 140.47 26.59 Favored Pre-proline 0 C--N 1.322 -0.612 0 O-C-N 122.96 -0.141 . . . . 0.0 110.671 -178.076 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 3' ' ' PRO . . . . . 0.444 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 19.5 Cg_exo -63.8 146.38 91.81 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.657 2.238 . . . . 0.0 111.563 177.497 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 4' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 16.0 Cg_exo -71.31 30.65 0.23 Allowed 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.999 2.466 . . . . 0.0 113.863 -176.36 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -134.23 6.97 3.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.021 0.439 . . . . 0.0 110.451 176.114 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -165.99 28.35 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.073 178.16 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' X' X ' 7' ' ' ASP . . . . . 0.45 ' O ' HG22 ' X' ' 11' ' ' ILE . 57.6 p30 -83.67 156.18 65.05 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.252 179.465 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -47.19 -14.6 0.19 Allowed 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.07 2.513 . . . . 0.0 114.244 -176.064 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 68.8 mtm180 -94.37 -42.71 8.75 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 111.987 0.365 . . . . 0.0 111.987 179.506 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.409 HD22 ' HB2' ' X' ' 14' ' ' LEU . 53.1 mt -97.64 -26.08 14.89 Favored 'General case' 0 C--O 1.221 -0.446 0 O-C-N 122.213 -0.305 . . . . 0.0 111.458 -177.153 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.642 ' O ' ' HB3' ' X' ' 15' ' ' SER . 7.8 tt -70.68 -15.2 18.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 169.536 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -93.73 -59.06 2.08 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.33 174.267 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 36.7 m -82.91 -33.86 26.76 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.315 0.857 . . . . 0.0 113.315 -172.411 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.445 HD23 HD23 ' X' ' 18' ' ' LEU . 9.4 tt -93.92 -39.25 10.78 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-O 121.393 0.616 . . . . 0.0 109.444 -177.421 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.642 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 6.4 t -73.67 -21.21 60.33 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.374 -176.667 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.61 -26.16 64.3 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 120.134 -0.627 . . . . 0.0 109.311 173.863 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.523 ' HE3' HD13 ' X' ' 47' ' ' ILE . 77.4 mtp -73.28 -46.35 50.36 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.649 175.642 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 18' ' ' LEU . . . . . 0.445 HD23 HD23 ' X' ' 14' ' ' LEU . 4.3 mm? -63.32 -41.87 98.94 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.889 179.19 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 16.1 m -70.05 -17.25 63.24 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -178.936 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 30.4 ttm -101.84 -30.23 11.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.864 0.364 . . . . 0.0 111.136 -176.41 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.48 45.74 0.65 Allowed Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.659 -0.782 . . . . 0.0 111.627 -178.785 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.422 ' HB2' ' HB3' ' X' ' 17' ' ' MET . 41.0 m-85 -133.74 166.27 23.02 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 177.771 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 70.2 m -158.72 -123.51 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -178.601 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.644 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.3 p30 -118.78 130.98 56.09 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 169.485 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 25' ' ' GLU . . . . . 1.089 ' HG3' ' HE1' ' X' ' 28' ' ' TRP . 3.0 pp20? -78.73 1.62 22.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.051 0.453 . . . . 0.0 110.5 -178.534 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -152.02 -73.49 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.98 172.38 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -175.34 28.25 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.479 0 N-CA-C 110.896 -0.882 . . . . 0.0 110.896 175.486 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 1.089 ' HE1' ' HG3' ' X' ' 25' ' ' GLU . 53.3 p-90 -98.31 -19.87 17.53 Favored 'General case' 0 C--O 1.212 -0.898 0 CA-C-O 118.557 -0.735 . . . . 0.0 112.227 -175.035 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.644 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 28.5 tp -40.35 -53.21 2.62 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -168.917 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 30' ' ' THR . . . . . 0.425 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 60.2 p -72.78 -17.66 61.56 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -178.773 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -94.59 -48.88 5.9 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.673 -174.944 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 32' ' ' LEU . . . . . 0.674 ' O ' ' HD3' ' X' ' 36' ' ' LYS . 3.4 tm? -50.12 -71.99 0.06 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 123.72 0.808 . . . . 0.0 111.381 -178.166 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.719 ' HB2' ' HA ' ' X' ' 38' ' ' TYR . 0.5 OUTLIER -62.83 -25.06 68.07 Favored 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -175.292 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' X' X ' 34' ' ' GLN . . . . . 0.435 ' N ' HD12 ' X' ' 33' ' ' LEU . 41.2 tp60 -57.65 -36.21 71.56 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 -179.118 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 7.1 m -96.03 -11.48 26.37 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.927 0.394 . . . . 0.0 110.939 -178.789 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' X' X ' 36' ' ' LYS . . . . . 0.674 ' HD3' ' O ' ' X' ' 32' ' ' LEU . 4.3 mptp? -108.17 36.55 2.75 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -177.505 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 41.6 t30 59.21 37.17 23.93 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.534 0.683 . . . . 0.0 111.084 178.169 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.719 ' HA ' ' HB2' ' X' ' 33' ' ' LEU . 54.8 m-85 54.34 59.12 4.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.256 179.48 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 39' ' ' ASP . . . . . 0.487 ' HB2' ' O ' ' X' ' 36' ' ' LYS . 2.4 t0 -91.72 128.9 37.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.667 -1.151 . . . . 0.0 111.428 -172.415 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.472 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.12 -7.6 10.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.346 170.416 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -70.76 -42.23 62.03 Favored Glycine 0 N--CA 1.442 -0.964 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.077 -178.977 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -91.26 -22.6 20.5 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.16 -0.52 . . . . 0.0 111.216 178.444 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.491 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -69.04 -41.16 78.04 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.418 -179.387 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.472 HD13 ' O ' ' X' ' 40' ' ' ILE . 10.9 mp -75.14 -33.86 61.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.727 0.299 . . . . 0.0 110.362 178.839 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -57.32 -35.14 69.49 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.291 179.425 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 1.5 p -86.12 -44.03 12.58 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -176.206 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.653 HG23 ' CH2' ' X' ' 28' ' ' TRP . 4.5 pt -67.1 -30.35 49.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 -170.85 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -165.61 -32.07 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 111.606 0.224 . . . . 0.0 111.606 -177.488 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' X' X ' 49' ' ' TYR . . . . . 0.438 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 13.3 m-85 -77.88 42.31 0.38 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 120.765 0.316 . . . . 0.0 110.834 -179.27 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 14.6 m -87.5 20.94 2.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.966 0.413 . . . . 0.0 111.192 -177.219 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 1.7 mmmp? -111.69 38.07 2.74 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 174.996 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 49.5 t-80 . . . . . 0 C--O 1.245 0.831 0 CA-C-N 114.819 -1.082 . . . . 0.0 109.841 -173.924 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.885 0 N-CA-C 112.208 -0.357 . . . . 0.0 112.208 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' X' X ' 2' ' ' SER . . . . . 0.418 ' HA ' ' HD3' ' X' ' 3' ' ' PRO . 5.6 p -92.26 137.03 25.02 Favored Pre-proline 0 C--N 1.326 -0.451 0 O-C-N 122.815 -0.227 . . . . 0.0 111.046 -179.053 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 3' ' ' PRO . . . . . 0.431 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 37.0 Cg_exo -60.6 133.96 51.65 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.029 2.486 . . . . 0.0 112.073 -179.869 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 4' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 8.8 Cg_exo -73.8 24.39 0.33 Allowed 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 122.892 2.394 . . . . 0.0 113.382 -177.482 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -141.05 13.49 2.24 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.228 0.537 . . . . 0.0 109.948 175.242 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -162.57 21.75 0.1 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.453 -178.783 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' X' X ' 7' ' ' ASP . . . . . 0.621 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 25.0 t70 -75.87 146.07 78.84 Favored Pre-proline 0 C--N 1.319 -0.751 0 CA-C-N 114.367 -1.288 . . . . 0.0 108.172 175.965 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 8' ' ' PRO . . . . . 0.621 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 80.2 Cg_exo -42.97 -25.61 0.57 Allowed 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.062 2.508 . . . . 0.0 112.982 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 9' ' ' ARG . . . . . 0.488 ' HB3' ' CG ' ' X' ' 38' ' ' TYR . 64.3 mmt-85 -93.41 -39.1 11.1 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.537 179.844 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 10' ' ' LEU . . . . . 0.571 HD22 ' HB2' ' X' ' 14' ' ' LEU . 79.3 mt -95.66 -19.55 19.63 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 122.137 -0.352 . . . . 0.0 111.631 -170.764 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 11' ' ' ILE . . . . . 0.52 ' O ' ' HB3' ' X' ' 15' ' ' SER . 0.0 OUTLIER -66.39 -24.62 33.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 171.635 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' X' X ' 12' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 41.4 mt-10 -95.91 -62.29 1.31 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.613 173.625 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 35.9 m -81.07 -21.25 40.18 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -169.445 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' X' X ' 14' ' ' LEU . . . . . 0.853 HD12 HD11 ' X' ' 29' ' ' LEU . 8.8 tp -92.97 -45.83 7.76 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.798 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 15' ' ' SER . . . . . 0.52 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 19.3 t -67.6 -26.24 66.16 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 114.004 -1.453 . . . . 0.0 111.528 -178.031 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 16' ' ' GLN . . . . . 0.402 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 3.9 tm0? -52.25 -52.09 54.57 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.058 0.456 . . . . 0.0 110.944 177.485 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 17' ' ' MET . . . . . 0.692 ' SD ' HD13 ' X' ' 29' ' ' LEU . 8.4 ptm -89.06 -26.71 21.26 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.116 -175.619 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 28.8 mt -72.08 -17.69 61.98 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 119.961 -0.696 . . . . 0.0 112.126 -179.474 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 32.4 p -94.52 -21.72 18.69 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 121.059 -0.256 . . . . 0.0 111.383 178.584 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 86.6 mtp -87.08 -31.66 20.35 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.702 0.287 . . . . 0.0 111.321 -179.13 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 108.31 35.56 2.47 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.487 -175.329 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' X' X ' 22' ' ' PHE . . . . . 0.633 ' HD2' HD12 ' X' ' 47' ' ' ILE . 15.0 m-30 -112.82 146.72 38.36 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 175.295 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 62.6 m -136.72 -177.56 4.79 Favored 'General case' 0 C--N 1.308 -1.211 0 C-N-CA 119.903 -0.719 . . . . 0.0 110.779 -174.878 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' X' X ' 24' ' ' ASP . . . . . 0.874 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 1.3 p30 -79.55 123.13 27.3 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.213 0.53 . . . . 0.0 110.117 175.251 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 25' ' ' GLU . . . . . 0.53 ' CB ' ' HE1' ' X' ' 28' ' ' TRP . 18.4 tp10 -68.57 -35.29 77.19 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.264 -177.089 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -139.92 20.28 2.88 Favored Glycine 0 C--N 1.32 -0.334 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.787 178.101 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' X' X ' 27' ' ' GLY . . . . . 0.574 ' O ' ' HG2' ' X' ' 31' ' ' ARG . . . 91.31 23.18 29.93 Favored Glycine 0 C--O 1.225 -0.424 0 C-N-CA 120.509 -0.853 . . . . 0.0 112.309 -179.736 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 28' ' ' TRP . . . . . 0.742 ' CH2' HG23 ' X' ' 47' ' ' ILE . 47.8 p-90 -89.83 -13.7 35.98 Favored 'General case' 0 C--O 1.217 -0.644 0 O-C-N 122.887 -0.184 . . . . 0.0 111.311 -178.385 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 29' ' ' LEU . . . . . 0.874 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 11.4 tp -63.0 -20.96 65.8 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 121.791 -0.568 . . . . 0.0 109.898 -179.259 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.5 -25.7 17.49 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.266 171.224 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 31' ' ' ARG . . . . . 0.574 ' HG2' ' O ' ' X' ' 27' ' ' GLY . 15.7 mmm180 -95.92 -65.47 0.97 Allowed 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -175.433 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 32' ' ' LEU . . . . . 0.715 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 2.8 tm? -39.12 -54.94 1.7 Allowed 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.853 1.261 . . . . 0.0 112.533 -176.197 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 33' ' ' LEU . . . . . 0.735 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 93.4 mt -54.63 -61.85 2.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.497 -176.796 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 45.0 mm-40 -38.1 -55.89 1.23 Allowed 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -175.653 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 6.4 p -76.46 -2.44 32.13 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -169.179 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -112.79 -27.31 8.19 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 119.995 -0.682 . . . . 0.0 111.971 -179.009 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 20.7 p30 136.87 15.86 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 125.931 1.693 . . . . 0.0 109.979 178.214 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' X' X ' 38' ' ' TYR . . . . . 0.735 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 26.0 m-85 72.42 56.25 0.15 Allowed 'General case' 0 C--N 1.341 0.217 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 -170.102 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -100.72 125.94 47.22 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.766 -171.265 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' X' X ' 40' ' ' ILE . . . . . 0.818 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.1 OUTLIER -89.58 -8.6 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.123 173.664 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.97 -37.27 92.42 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.355 -0.926 . . . . 0.0 111.915 177.279 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.08 -21.39 16.21 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.506 -0.347 . . . . 0.0 110.74 175.904 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' X' X ' 43' ' ' ALA . . . . . 0.818 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -67.23 -33.78 76.08 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.018 178.049 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 44' ' ' LEU . . . . . 0.84 HD12 HD11 ' X' ' 47' ' ' ILE . 7.1 mp -63.98 -30.42 71.5 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.153 179.429 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 45' ' ' ASP . . . . . 0.572 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 21.1 t70 -57.37 -39.55 76.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.19 0.519 . . . . 0.0 110.812 174.749 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 11.7 p -94.46 -5.53 46.01 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -175.626 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' X' X ' 47' ' ' ILE . . . . . 0.84 HD11 HD12 ' X' ' 44' ' ' LEU . 2.0 pt -102.63 43.91 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 O-C-N 121.999 -0.438 . . . . 0.0 111.666 173.804 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 82.0 33.45 0.09 Allowed 'General case' 0 N--CA 1.474 0.744 0 O-C-N 124.276 0.985 . . . . 0.0 112.549 173.009 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' X' X ' 49' ' ' TYR . . . . . 0.572 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 63.8 m-85 -141.58 58.16 1.51 Allowed 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 173.855 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 50' ' ' SER . . . . . 0.526 ' HA ' ' OD1' ' X' ' 45' ' ' ASP . 8.1 p -97.35 23.78 7.19 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -174.493 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 28.6 ttpp -126.06 92.19 3.53 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 178.855 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 . . . . . 0 C--O 1.245 0.84 0 CA-C-O 118.351 -0.833 . . . . 0.0 110.255 -178.288 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.444 0 CA-C-O 121.186 0.517 . . . . 0.0 109.78 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -74.85 148.84 85.19 Favored Pre-proline 0 C--N 1.319 -0.749 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 174.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . 0.452 ' O ' ' HB2' ' X' ' 12' ' ' GLU . 86.9 Cg_exo -46.85 -24.18 2.94 Favored 'Trans proline' 0 CA--C 1.535 0.563 0 C-N-CA 122.158 1.905 . . . . 0.0 112.555 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 27.3 mmm180 -93.38 -23.49 18.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.881 -0.6 . . . . 0.0 112.512 179.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 43.5 mt -98.37 -28.3 13.71 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.633 0.254 . . . . 0.0 110.883 -176.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.602 ' O ' ' HB3' ' X' ' 15' ' ' SER . 11.2 tp -75.82 -17.39 15.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 171.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . 0.452 ' HB2' ' O ' ' X' ' 8' ' ' PRO . 0.3 OUTLIER -91.12 -53.7 4.26 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.894 175.643 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . 0.633 ' HB3' HG23 ' X' ' 40' ' ' ILE . 4.3 m -95.31 -26.19 16.02 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -170.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.409 HD22 ' HA ' ' X' ' 14' ' ' LEU . 2.5 tm? -94.86 -41.94 8.95 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.602 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 23.2 t -67.2 -25.72 66.27 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.984 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . 0.404 ' OE1' HD11 ' X' ' 44' ' ' LEU . 4.2 tm0? -63.66 -54.88 28.84 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 121.174 0.511 . . . . 0.0 110.308 176.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.722 ' SD ' HD11 ' X' ' 29' ' ' LEU . 14.2 ptp -71.69 -33.62 68.96 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.459 -177.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 28.1 tp -67.61 -36.46 80.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.881 0.372 . . . . 0.0 110.81 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 20.7 t -79.75 -38.24 33.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.243 -178.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 42.2 tpp -75.75 -31.52 59.59 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.617 0.228 . . . . 0.0 111.617 -175.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.88 47.27 0.62 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.145 -1.026 . . . . 0.0 112.754 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.653 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 50.4 m-85 -119.41 169.15 10.27 Favored 'General case' 0 CA--C 1.509 -0.603 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 175.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 42.0 m -151.31 -148.71 0.27 Allowed 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.113 -0.635 . . . . 0.0 110.369 -179.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.447 ' HA ' ' HB2' ' X' ' 29' ' ' LEU . 2.3 m-20 -92.46 115.81 28.43 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 174.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . 0.629 ' HG3' ' HA ' ' X' ' 47' ' ' ILE . 48.0 mm-40 -82.9 43.26 0.84 Allowed 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.715 177.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 143.05 -14.33 2.36 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.581 -178.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.58 7.38 36.92 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.834 -0.698 . . . . 0.0 111.902 -178.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.639 ' HH2' HG23 ' X' ' 47' ' ' ILE . 55.9 p-90 -86.51 -13.85 44.78 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 119.046 -0.502 . . . . 0.0 111.3 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.722 HD11 ' SD ' ' X' ' 17' ' ' MET . 36.9 tp -48.21 -51.0 27.21 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -167.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 25.5 p -65.43 -47.83 74.86 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.739 0.304 . . . . 0.0 111.019 177.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . 0.505 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 10.0 mtm180 -54.97 -52.48 62.92 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.903 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . 0.466 ' HB2' ' HE3' ' X' ' 28' ' ' TRP . 2.6 tm? -55.94 -55.25 34.9 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 123.034 0.533 . . . . 0.0 110.808 178.129 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 84.2 mt -56.91 -65.17 0.66 Allowed 'General case' 0 C--O 1.225 -0.214 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.195 -176.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -54.76 -38.7 67.54 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -172.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 42.8 p -71.88 -13.24 61.61 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -177.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -120.15 38.91 3.83 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.7 -0.227 . . . . 0.0 110.537 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 43.54 46.83 6.07 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.916 0.887 . . . . 0.0 112.029 -175.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 63.18 76.62 0.36 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.247 178.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -111.88 123.63 50.66 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.299 -174.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.723 ' HB ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.87 -8.76 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.454 174.2 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.46 -44.04 95.81 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.53 -0.843 . . . . 0.0 112.338 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -93.47 -18.91 21.77 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.698 0.285 . . . . 0.0 110.865 178.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.603 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -71.05 -51.05 27.51 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.487 177.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.76 ' HA ' ' CG1' ' X' ' 47' ' ' ILE . 10.3 mp -62.45 -28.9 70.13 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.509 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . 0.521 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 17.0 t70 -51.59 -44.77 62.93 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.474 0.484 . . . . 0.0 111.691 178.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 2.0 p -96.48 -23.68 16.45 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -177.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.76 ' CG1' ' HA ' ' X' ' 44' ' ' LEU . 25.3 pt -81.94 45.44 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 N-CA-C 112.935 0.716 . . . . 0.0 112.935 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . 0.454 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 3.0 mt-30 88.33 15.63 0.07 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.05 0.94 . . . . 0.0 113.342 173.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . 0.521 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 32.9 m-85 . . . . . 0 C--N 1.328 -0.365 0 O-C-N 121.985 -0.447 . . . . 0.0 110.219 171.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.439 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . 0.777 ' OD2' ' HD3' ' X' ' 9' ' ' ARG . 29.5 t70 -81.7 145.82 55.2 Favored Pre-proline 0 C--N 1.321 -0.672 0 CA-C-N 114.138 -1.392 . . . . 0.0 108.18 178.502 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . 0.579 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 92.9 Cg_exo -42.64 -26.0 0.57 Allowed 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 123.004 2.469 . . . . 0.0 113.879 -177.355 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . 0.777 ' HD3' ' OD2' ' X' ' 7' ' ' ASP . 3.6 mpp_? -92.89 -38.61 11.63 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . 0.499 HD22 ' HB2' ' X' ' 14' ' ' LEU . 87.9 mt -97.03 -15.57 20.98 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 -172.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.472 ' O ' ' HB3' ' X' ' 15' ' ' SER . 15.2 tt -72.48 -19.59 19.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 172.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -94.44 -51.03 4.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.317 174.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . 0.43 ' O ' ' HG2' ' X' ' 17' ' ' MET . 34.5 m -94.73 -29.63 14.69 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -169.005 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.499 ' HB2' HD22 ' X' ' 10' ' ' LEU . 10.0 tt -94.24 -40.62 9.9 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.472 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 5.6 t -67.53 -26.1 66.16 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.708 -179.03 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . 0.415 ' HA ' ' OG ' ' X' ' 19' ' ' SER . 1.1 pp0? -73.64 -28.48 61.8 Favored 'General case' 0 C--O 1.224 -0.263 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 175.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.43 ' HG2' ' O ' ' X' ' 13' ' ' SER . 91.0 mmm -65.46 -42.29 92.48 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 174.232 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.38 -34.64 77.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.067 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . 0.415 ' OG ' ' HA ' ' X' ' 16' ' ' GLN . 5.1 p -84.83 -34.79 22.62 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -175.595 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . 0.447 ' HA ' ' CE ' ' X' ' 20' ' ' MET . 21.2 mmt -78.44 -15.2 58.9 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 121.141 -0.224 . . . . 0.0 111.486 -178.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 98.68 44.57 2.45 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.499 178.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -125.6 -177.78 4.02 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 176.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . 0.41 ' O ' HG21 ' X' ' 47' ' ' ILE . 42.5 m -156.96 -134.86 0.04 OUTLIER 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 175.524 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.586 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 2.8 p30 -122.15 131.43 53.95 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 169.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -97.61 55.11 1.21 Allowed 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.099 -0.64 . . . . 0.0 109.868 178.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 144.31 -0.22 1.08 Allowed Glycine 0 CA--C 1.518 0.227 0 C-N-CA 120.279 -0.963 . . . . 0.0 113.632 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.0 11.22 63.58 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.004 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.798 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 42.0 p-90 -87.21 -5.62 58.89 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -176.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.586 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 53.7 tp -59.83 -26.59 65.92 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 122.075 -0.39 . . . . 0.0 111.35 -175.083 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 80.5 p -93.73 -11.47 31.37 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.816 0.341 . . . . 0.0 111.082 175.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . 0.498 ' CG ' ' HA ' ' X' ' 28' ' ' TRP . 13.3 mmm180 -94.99 -61.98 1.39 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.25 0.548 . . . . 0.0 110.746 -178.458 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -47.16 -72.37 0.05 Allowed 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 114.345 -1.298 . . . . 0.0 111.408 -177.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.583 ' H ' HD12 ' X' ' 33' ' ' LEU . 6.3 mp -53.79 -50.0 67.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.579 -175.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . 0.401 HE22 HD21 ' X' ' 10' ' ' LEU . 0.0 OUTLIER -49.22 -34.06 14.01 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -176.154 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 2.7 m -99.05 -2.86 36.11 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 111.732 0.271 . . . . 0.0 111.732 -174.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -123.86 37.75 4.34 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -177.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 47.8 t30 69.48 26.33 5.18 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.38 0.61 . . . . 0.0 110.73 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.524 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 29.4 m-85 54.54 64.9 1.66 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.268 178.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . 0.426 ' O ' ' HG ' ' X' ' 33' ' ' LEU . 33.7 p-10 -103.79 133.8 48.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.013 -0.994 . . . . 0.0 112.551 -173.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.645 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -91.45 -3.92 10.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.95 170.285 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.96 -36.32 81.18 Favored Glycine 0 N--CA 1.444 -0.807 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.736 177.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -96.88 -17.66 20.02 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.304 -0.448 . . . . 0.0 110.783 176.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.645 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -68.44 -45.99 71.05 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.217 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.618 ' HA ' HD11 ' X' ' 47' ' ' ILE . 10.2 mp -63.41 -34.01 76.8 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.788 0.328 . . . . 0.0 110.754 178.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -58.85 -38.31 78.44 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.743 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 9.6 p -96.48 -5.93 38.38 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -172.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.798 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 1.4 pp -98.81 -27.07 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 CA-C-N 119.565 1.075 . . . . 0.0 112.502 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . 0.494 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.6 mp0 -159.8 -35.92 0.06 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.784 0.326 . . . . 0.0 110.949 -179.11 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.426 -177.011 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.48 0 CA-C-O 121.881 0.848 . . . . 0.0 109.837 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -89.68 150.08 43.44 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 172.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -46.36 -25.27 3.12 Favored 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 122.339 2.026 . . . . 0.0 113.05 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 66.0 mtt85 -87.59 -38.59 15.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.661 178.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 98.0 mt -81.95 -26.61 33.85 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.498 -176.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.512 ' O ' ' HB3' ' X' ' 15' ' ' SER . 0.3 OUTLIER -69.48 -20.18 23.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 174.188 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -88.34 -63.99 1.21 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.186 -0.915 . . . . 0.0 111.668 173.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 11.5 m -89.67 -26.7 20.57 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -167.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.57 ' HG ' HD11 ' X' ' 29' ' ' LEU . 7.8 tt -93.4 -42.74 9.12 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.512 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 15.3 t -67.12 -31.13 71.39 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.789 -175.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -65.91 -33.35 75.63 Favored 'General case' 0 C--O 1.227 -0.103 0 C-N-CA 120.501 -0.48 . . . . 0.0 111.022 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.812 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 14.7 ptm -89.03 -30.31 18.81 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.046 177.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 53.3 tp -59.71 -41.5 90.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.935 0.398 . . . . 0.0 110.665 177.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 14.6 m -87.69 -40.1 14.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.228 -175.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 86.3 mmm -72.28 -27.18 62.31 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -175.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.25 46.87 0.62 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 119.901 -1.142 . . . . 0.0 113.172 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.812 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 39.7 m-85 -122.69 160.24 26.27 Favored 'General case' 0 CA--C 1.511 -0.552 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 171.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 5.0 m -147.87 178.11 8.77 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.095 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.592 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.3 p30 -85.07 130.03 34.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.201 0.524 . . . . 0.0 110.082 173.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . 0.729 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 51.7 tp10 -69.67 -25.08 63.72 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.212 -176.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -145.66 15.25 1.8 Allowed Glycine 0 C--O 1.228 -0.238 0 C-N-CA 120.336 -0.935 . . . . 0.0 113.597 -178.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . 0.423 ' O ' ' HD3' ' X' ' 31' ' ' ARG . . . 90.91 22.89 31.72 Favored Glycine 0 CA--C 1.509 -0.337 0 C-N-CA 120.468 -0.872 . . . . 0.0 111.92 179.616 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.729 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 38.8 p-90 -96.12 -5.0 41.75 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -176.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.592 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 3.2 tp -51.37 -38.73 54.81 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -170.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . 0.768 ' O ' ' HG3' ' X' ' 34' ' ' GLN . 70.5 p -79.72 -46.2 17.5 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 119.928 -0.709 . . . . 0.0 110.195 173.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . 0.677 ' HD2' ' H ' ' X' ' 31' ' ' ARG . 1.4 mpt_? -53.34 -66.19 0.43 Allowed 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.422 0.689 . . . . 0.0 112.398 -179.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . 0.491 HD22 ' HE2' ' X' ' 36' ' ' LYS . 3.5 tm? -50.91 -60.5 3.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.437 -177.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.535 HD13 ' O ' ' X' ' 29' ' ' LEU . 11.0 mp -52.51 -47.8 66.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.405 -175.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . 0.768 ' HG3' ' O ' ' X' ' 30' ' ' THR . 33.2 mt-30 -64.88 -26.07 68.16 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -173.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 70.4 p -74.02 -16.68 61.05 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.315 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . 0.491 ' HE2' HD22 ' X' ' 32' ' ' LEU . 2.8 mptp? -121.33 37.08 4.43 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 121.266 -0.173 . . . . 0.0 111.462 177.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 37.9 t30 66.25 52.72 1.1 Allowed 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.161 0.505 . . . . 0.0 111.357 177.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.419 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 1.2 m-85 44.71 58.61 3.82 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.131 177.164 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . 0.489 ' O ' ' HG ' ' X' ' 33' ' ' LEU . 24.9 p-10 -111.15 151.49 28.1 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 119.167 -1.013 . . . . 0.0 113.523 -172.141 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.627 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -90.66 -2.88 10.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 114.11 -1.405 . . . . 0.0 110.119 172.245 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.31 -37.06 85.89 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.851 -0.69 . . . . 0.0 111.797 -178.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.21 -21.0 17.54 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.251 -0.474 . . . . 0.0 110.532 175.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.627 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -63.62 -47.26 82.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.303 178.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.413 ' HA ' HD11 ' X' ' 47' ' ' ILE . 1.1 tp -62.68 -26.35 68.61 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.355 -179.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -67.28 -45.64 76.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.057 -179.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 27.5 p -97.31 -20.7 17.68 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -170.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.703 HG23 ' HH2' ' X' ' 28' ' ' TRP . 4.6 pt -64.58 -30.37 50.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 118.959 0.799 . . . . 0.0 112.586 -171.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -166.42 -41.56 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.201 0.524 . . . . 0.0 109.923 177.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 . . . . . 0 C--N 1.326 -0.416 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.007 -175.227 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.415 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.01 154.22 41.76 Favored Pre-proline 0 C--O 1.218 -0.59 0 CA-C-N 114.785 -1.098 . . . . 0.0 108.322 174.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_exo -45.7 -22.46 1.19 Allowed 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 123.305 2.67 . . . . 0.0 114.55 -174.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -83.99 -42.17 16.5 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 122.055 -0.403 . . . . 0.0 112.045 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 67.9 mt -99.25 -19.45 17.09 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -175.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.598 ' O ' ' HB3' ' X' ' 15' ' ' SER . 0.1 OUTLIER -69.4 -22.73 25.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 175.653 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -93.78 -37.58 11.71 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.765 176.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . 0.405 ' HA ' HG23 ' X' ' 40' ' ' ILE . 7.4 m -95.83 -40.72 9.19 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -171.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.422 HD23 HD11 ' X' ' 29' ' ' LEU . 3.3 tm? -94.58 -48.41 6.11 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -178.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.598 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 22.9 t -64.49 -27.11 68.75 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.053 -176.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . 0.486 HE21 ' HB3' ' X' ' 16' ' ' GLN . 0.0 OUTLIER -62.56 -46.65 87.38 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.206 0.527 . . . . 0.0 109.812 174.801 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . . . . . . . . . 77.2 mtp -71.36 -43.62 66.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.723 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 29.1 tp -62.58 -32.48 73.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.953 -176.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 8.0 t -96.33 -11.04 26.41 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.749 0.278 . . . . 0.0 111.749 -175.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 14.0 tpt -102.0 -31.71 10.53 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.777 -0.369 . . . . 0.0 111.372 -178.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.28 44.91 0.7 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.547 -0.835 . . . . 0.0 111.607 -177.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -128.99 146.58 50.94 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 177.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 14.9 m -146.22 -164.03 1.88 Allowed 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.915 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 9.1 p-10 -76.33 116.68 17.25 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 172.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 58.9 tt0 -100.96 65.17 1.09 Allowed 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 177.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 140.64 -6.07 2.64 Favored Glycine 0 N--CA 1.449 -0.478 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.268 -174.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.79 16.75 55.96 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 121.089 -0.577 . . . . 0.0 112.124 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.683 ' HH2' HG23 ' X' ' 47' ' ' ILE . 58.6 p-90 -93.32 -13.33 28.28 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -174.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.915 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 3.7 tp -57.01 -33.62 67.35 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.648 -0.658 . . . . 0.0 112.135 -170.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . 0.5 ' O ' ' HG2' ' X' ' 34' ' ' GLN . 10.4 p -87.89 -10.41 50.77 Favored 'General case' 0 C--O 1.218 -0.599 0 C-N-CA 120.185 -0.606 . . . . 0.0 111.034 175.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . 0.53 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 20.0 mtp180 -95.6 -56.4 2.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.337 0.589 . . . . 0.0 110.868 -178.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -50.46 -53.31 30.69 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.948 -177.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.715 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 9.6 mp -68.31 -47.08 68.53 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -170.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . 0.5 ' HG2' ' O ' ' X' ' 30' ' ' THR . 3.5 mm100 -37.98 -71.27 0.08 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 -172.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 33.3 p -60.81 -29.91 69.75 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.802 0.334 . . . . 0.0 111.84 -173.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . 0.403 ' HB3' ' HB2' ' X' ' 39' ' ' ASP . 49.8 mttp -88.01 37.07 0.79 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.409 177.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 15.2 p30 46.37 34.32 2.23 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.352 1.061 . . . . 0.0 112.56 179.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.715 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 31.9 m-85 68.57 73.9 0.27 Allowed 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.869 -176.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . 0.403 ' HB2' ' HB3' ' X' ' 36' ' ' LYS . 35.2 t0 -100.47 125.5 46.78 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.975 -175.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.647 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.95 -13.79 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.625 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.662 169.856 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.63 -37.93 95.58 Favored Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.564 -0.827 . . . . 0.0 112.352 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.08 -18.75 19.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.436 -0.382 . . . . 0.0 111.065 176.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.646 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -70.47 -36.36 73.84 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.498 178.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.768 HD12 HD11 ' X' ' 47' ' ' ILE . 7.1 mp -60.7 -36.88 79.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.188 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . 0.543 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.1 t70 -51.93 -41.72 62.25 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 123.48 0.487 . . . . 0.0 111.354 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 5.1 p -96.23 -5.81 39.53 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -177.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.768 HD11 HD12 ' X' ' 44' ' ' LEU . 14.1 pt -101.95 44.33 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 CA-C-N 118.164 0.438 . . . . 0.0 111.63 174.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 79.04 27.1 0.43 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.94 0.896 . . . . 0.0 112.367 174.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . 0.543 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 62.3 m-85 . . . . . 0 C--N 1.326 -0.431 0 CA-C-O 120.882 0.372 . . . . 0.0 110.173 173.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . 0.427 ' HA ' HG23 ' X' ' 11' ' ' ILE . . . . . . . . 0 CA--C 1.515 -0.372 0 CA-C-O 121.554 0.692 . . . . 0.0 109.935 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . 0.49 ' O ' HG12 ' X' ' 11' ' ' ILE . 7.6 t70 -93.94 147.96 34.41 Favored Pre-proline 0 C--N 1.314 -0.974 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 175.133 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . 0.455 ' HA ' HD11 ' X' ' 11' ' ' ILE . 85.0 Cg_exo -44.18 -30.32 3.41 Favored 'Trans proline' 0 CA--C 1.532 0.421 0 C-N-CA 122.903 2.402 . . . . 0.0 112.709 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . 0.478 ' HB3' ' HD2' ' X' ' 38' ' ' TYR . 80.3 mtm-85 -84.15 -29.49 26.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.514 178.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . 0.412 HD22 ' HB2' ' X' ' 14' ' ' LEU . 88.1 mt -97.88 -20.71 17.32 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -174.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.49 HG12 ' O ' ' X' ' 7' ' ' ASP . 10.7 pt -73.64 -13.41 16.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 168.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -95.21 -53.13 3.9 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.629 174.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 23.7 t -93.29 -32.22 14.4 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -169.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.412 ' HB2' HD22 ' X' ' 10' ' ' LEU . 8.3 tt -93.28 -40.33 10.48 Favored 'General case' 0 CA--C 1.51 -0.592 0 O-C-N 121.395 -0.816 . . . . 0.0 109.002 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.471 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 10.5 t -70.03 -23.1 63.06 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.494 -176.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' X' ' 20' ' ' MET . 4.4 pp0? -65.3 -26.78 68.21 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.249 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.709 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 15.9 ptm -99.14 -24.74 14.77 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 121.033 -0.267 . . . . 0.0 110.504 175.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 35.7 tp -62.22 -40.73 97.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.752 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 40.3 p -91.4 -25.81 19.18 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.487 -178.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . 0.401 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 44.5 ttm -73.89 -31.26 63.04 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.499 -0.318 . . . . 0.0 111.148 -176.068 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 104.54 47.12 1.23 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.081 -1.057 . . . . 0.0 112.685 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.709 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 13.9 m-30 -114.27 175.92 5.27 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 175.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . 0.607 ' O ' HG22 ' X' ' 47' ' ' ILE . 12.3 m -145.9 158.64 43.85 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 119.812 -0.755 . . . . 0.0 111.407 -178.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -68.68 133.74 48.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.464 173.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . 0.814 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 2.3 tm-20 -91.28 -16.95 26.74 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -175.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -170.25 21.1 0.08 OUTLIER Glycine 0 CA--C 1.519 0.32 0 C-N-CA 119.221 -1.466 . . . . 0.0 114.49 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 87.19 24.0 38.77 Favored Glycine 0 C--N 1.32 -0.311 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.402 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.814 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 59.1 p-90 -96.86 -14.65 21.69 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 119.157 -0.449 . . . . 0.0 112.179 -178.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.421 ' HA ' ' CE3' ' X' ' 28' ' ' TRP . 26.0 tp -52.33 -24.31 7.34 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -169.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 21.8 p -88.65 -61.59 1.68 Allowed 'General case' 0 C--N 1.32 -0.683 0 O-C-N 121.826 -0.546 . . . . 0.0 110.469 169.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . 0.73 ' HG2' ' HA ' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -49.37 -56.74 8.56 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -177.482 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . 0.603 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 2.5 tm? -54.12 -46.46 72.19 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 122.642 0.377 . . . . 0.0 110.842 -178.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.595 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 11.2 mp -70.04 -51.38 32.55 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.454 -178.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -44.37 -56.22 4.38 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -176.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 61.9 p -75.92 -2.7 31.55 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -175.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' X' ' 39' ' ' ASP . 53.7 mttp -120.59 28.27 8.07 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 40.7 t30 64.02 30.86 13.92 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.737 0.779 . . . . 0.0 110.262 178.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.595 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 8.6 m-30 59.43 63.55 1.53 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.874 -174.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' X' ' 36' ' ' LYS . 32.2 t70 -95.86 124.83 40.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.871 -173.153 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.817 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -90.44 -6.25 10.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.396 171.769 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.29 -40.81 99.5 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.442 -0.885 . . . . 0.0 111.982 177.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.5 -20.98 16.14 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.173 -0.514 . . . . 0.0 110.906 176.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.817 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -66.88 -39.15 87.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.646 178.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.854 HD12 HD11 ' X' ' 47' ' ' ILE . 5.7 mp -57.85 -37.02 73.13 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.149 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -49.78 -46.34 50.68 Favored 'General case' 0 CA--C 1.532 0.269 0 O-C-N 123.696 0.623 . . . . 0.0 111.499 178.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -88.21 -21.69 24.41 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -177.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.854 HD11 HD12 ' X' ' 44' ' ' LEU . 8.1 pt -88.05 43.3 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 O-C-N 121.757 -0.589 . . . . 0.0 111.639 174.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . 0.444 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 1.5 mp0 85.88 38.13 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.526 1.13 . . . . 0.0 112.982 174.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . 0.561 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 26.6 m-85 . . . . . 0 C--N 1.328 -0.335 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 170.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.3 0 CA-C-O 121.084 0.469 . . . . 0.0 110.252 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . 0.406 ' O ' HG22 ' X' ' 11' ' ' ILE . 8.3 m-20 -77.75 154.78 80.93 Favored Pre-proline 0 C--O 1.216 -0.669 0 CA-C-N 115.448 -0.797 . . . . 0.0 109.298 176.158 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -46.04 -26.2 3.39 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 122.911 2.407 . . . . 0.0 112.675 177.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 56.0 mtm-85 -92.02 -33.96 14.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.188 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 93.7 mt -98.4 -19.52 17.68 Favored 'General case' 0 C--O 1.219 -0.519 0 O-C-N 122.223 -0.298 . . . . 0.0 111.578 -173.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.573 ' O ' ' HB3' ' X' ' 15' ' ' SER . 10.6 tt -74.08 -15.36 16.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 169.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . 0.516 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 4.7 tm-20 -94.77 -60.74 1.63 Allowed 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 114.754 -1.112 . . . . 0.0 110.277 175.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 36.7 m -89.77 -26.43 20.6 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -170.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . . . . . . . . . 7.5 tt -92.88 -40.41 10.63 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.573 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 28.1 t -70.18 -17.09 63.15 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.908 178.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . 0.516 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 0.0 OUTLIER -55.24 -50.73 68.71 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.509 178.383 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 1.014 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 0.5 OUTLIER -91.18 -23.66 20.17 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.012 179.405 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . 0.543 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 24.2 tp -63.49 -40.95 98.43 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.798 0.332 . . . . 0.0 110.805 -178.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 12.2 t -99.55 9.38 43.3 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.211 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . 0.474 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 55.1 tpp -104.5 -31.2 9.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.836 0.351 . . . . 0.0 110.874 -179.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 108.9 45.75 1.01 Allowed Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.313 -0.946 . . . . 0.0 111.831 -177.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 1.014 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 46.0 m-85 -125.79 178.78 5.51 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 175.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 44.8 m -161.39 160.23 29.22 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 176.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.669 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 50.2 p-10 -78.39 160.52 27.73 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.374 -0.53 . . . . 0.0 109.89 172.157 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . 0.749 ' HG2' ' CD1' ' X' ' 28' ' ' TRP . 18.1 pt-20 -64.05 -20.39 65.9 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.407 178.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 144.24 42.56 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.217 -0.992 . . . . 0.0 114.324 174.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 154.95 -16.85 0.54 Allowed Glycine 0 C--N 1.333 0.403 0 C-N-CA 118.39 -1.862 . . . . 0.0 115.389 171.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.936 ' HH2' HG23 ' X' ' 47' ' ' ILE . 43.2 p-90 -87.03 -20.03 27.78 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 118.459 1.13 . . . . 0.0 113.033 -173.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.669 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 42.3 tp -55.79 -21.32 18.7 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.15 0.886 . . . . 0.0 111.401 -176.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.88 -31.67 17.22 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 175.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . 0.675 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -95.15 -52.05 4.37 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 -178.678 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . 0.561 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 3.2 tm? -49.83 -51.56 39.05 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.49 0.716 . . . . 0.0 111.535 -177.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.698 ' O ' ' HA ' ' X' ' 38' ' ' TYR . 8.0 mp -71.99 -9.03 57.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.751 -177.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.7 -38.5 10.78 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.714 0.293 . . . . 0.0 110.775 -179.134 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 9.3 p -75.21 -39.49 60.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.44 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . 0.407 ' HG2' ' CB ' ' X' ' 42' ' ' ALA . 5.0 mptp? -78.3 37.92 0.28 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.956 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 41.9 45.92 3.34 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.851 0.86 . . . . 0.0 112.151 -177.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.698 ' HA ' ' O ' ' X' ' 33' ' ' LEU . 67.7 m-85 59.78 77.86 0.3 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.312 177.227 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -134.84 138.69 44.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.931 -175.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.65 HD13 ' H ' ' X' ' 40' ' ' ILE . 0.1 OUTLIER -90.14 -9.72 10.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.919 169.294 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.57 -34.41 89.44 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.203 178.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . 0.407 ' CB ' ' HG2' ' X' ' 36' ' ' LYS . . . -99.01 -15.29 19.12 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.334 -0.433 . . . . 0.0 110.612 176.295 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.648 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -76.56 -35.84 57.97 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.163 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.507 HD13 ' O ' ' X' ' 40' ' ' ILE . 9.5 mp -69.7 -32.65 71.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.275 177.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -60.92 -31.85 71.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.157 177.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 21.8 p -98.01 -33.91 11.0 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -174.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.936 HG23 ' HH2' ' X' ' 28' ' ' TRP . 1.8 pt -65.71 -35.04 74.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 C-N-CA 119.337 -0.945 . . . . 0.0 112.837 -169.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . 0.431 ' OE1' ' HD1' ' X' ' 22' ' ' PHE . 1.0 OUTLIER -166.89 -34.95 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 120.735 0.302 . . . . 0.0 110.382 179.075 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . 0.504 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 52.7 m-85 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.978 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.324 0 CA-C-O 121.722 0.772 . . . . 0.0 109.149 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . 0.43 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 32.3 t70 -93.85 144.53 28.28 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 114.86 -1.064 . . . . 0.0 108.34 178.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . 0.43 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 93.0 Cg_exo -42.36 -23.66 0.3 Allowed 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.362 2.708 . . . . 0.0 114.054 -178.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . 0.469 ' HD3' ' CE2' ' X' ' 38' ' ' TYR . 60.1 mtt85 -87.73 -46.07 9.8 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . 0.719 HD22 ' HB2' ' X' ' 14' ' ' LEU . 74.3 mt -99.41 -11.89 20.73 Favored 'General case' 0 C--O 1.219 -0.504 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -175.463 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.659 ' O ' ' HB3' ' X' ' 15' ' ' SER . 11.2 tt -69.25 -25.65 29.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 121.552 0.691 . . . . 0.0 109.202 176.087 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -96.61 -38.11 10.09 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.661 176.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 32.5 m -96.01 -33.0 12.3 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -172.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.719 ' HB2' HD22 ' X' ' 10' ' ' LEU . 10.1 tt -95.33 -49.0 5.65 Favored 'General case' 0 CA--C 1.508 -0.657 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.659 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 37.2 t -61.42 -31.4 71.33 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 114.426 -1.261 . . . . 0.0 111.403 -177.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -53.47 -55.0 29.04 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.871 0.367 . . . . 0.0 110.22 176.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.744 ' HB3' ' HB2' ' X' ' 22' ' ' PHE . 68.8 mtm -69.23 -39.91 78.24 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.493 -178.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.91 -32.5 74.23 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -177.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 20.7 p -86.13 -37.35 18.87 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.852 0.315 . . . . 0.0 111.852 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 13.4 tpt -69.99 -24.95 63.39 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.362 -176.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.9 34.54 1.5 Allowed Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.434 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.744 ' HB2' ' HB3' ' X' ' 17' ' ' MET . 5.6 m-85 -110.58 -176.13 2.9 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 173.056 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . 0.6 ' O ' HG21 ' X' ' 47' ' ' ILE . 15.3 m -152.47 -149.28 0.29 Allowed 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.392 178.082 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.444 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 12.2 p-10 -122.88 131.78 53.89 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 170.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -115.69 68.05 0.71 Allowed 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.097 -0.641 . . . . 0.0 111.012 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 136.9 5.51 1.89 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.378 -0.915 . . . . 0.0 113.136 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 79.38 7.63 88.34 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.173 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.834 ' HZ2' HG23 ' X' ' 47' ' ' ILE . 46.0 p-90 -79.65 -10.1 59.74 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 111.556 0.206 . . . . 0.0 111.556 -178.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.675 HD11 ' HG ' ' X' ' 14' ' ' LEU . 14.5 tp -55.97 -24.65 39.76 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 122.015 -0.428 . . . . 0.0 111.283 -174.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . 0.636 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 20.5 p -94.41 -47.47 6.57 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 122.072 -0.393 . . . . 0.0 110.706 169.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . 0.448 ' H ' ' HG2' ' X' ' 31' ' ' ARG . 15.6 mmm180 -55.65 -59.78 4.37 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.303 0.641 . . . . 0.0 112.012 -178.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . 0.535 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 2.8 tm? -55.97 -60.53 3.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.934 -1.03 . . . . 0.0 111.128 -176.118 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.454 HD13 ' O ' ' X' ' 29' ' ' LEU . 9.8 mp -57.32 -45.61 84.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.387 -176.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . 0.636 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.3 OUTLIER -49.82 -48.43 50.86 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 123.217 0.323 . . . . 0.0 111.436 179.685 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 14.1 m -67.15 -46.21 74.74 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.171 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -81.74 37.14 0.46 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.682 -179.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 5.5 p-10 40.33 49.92 2.6 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.806 0.842 . . . . 0.0 112.387 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.469 ' CE2' ' HD3' ' X' ' 9' ' ' ARG . 79.2 m-85 61.72 67.93 0.73 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.143 177.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -120.6 137.94 54.15 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.82 -177.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.71 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -90.9 -9.8 10.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.432 171.826 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -60.78 -38.43 95.23 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.587 -178.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.51 -15.4 18.68 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.486 -0.357 . . . . 0.0 110.594 175.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.71 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -68.41 -51.33 45.12 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.357 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.464 HD13 ' HB ' ' X' ' 40' ' ' ILE . 11.1 mp -59.52 -28.69 67.29 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.886 0.374 . . . . 0.0 110.913 178.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . 0.451 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 37.1 t70 -65.36 -33.09 75.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.797 -179.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 5.0 p -95.87 -5.81 40.77 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 -172.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.834 HG23 ' HZ2' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -105.03 -27.39 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-N 119.005 0.821 . . . . 0.0 112.522 -179.047 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . 0.629 ' NE2' ' HB ' ' X' ' 47' ' ' ILE . 3.0 mp0 -157.49 -48.84 0.07 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.282 0.563 . . . . 0.0 110.279 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . 0.451 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 48.1 m-85 . . . . . 0 C--N 1.323 -0.55 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.781 -173.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.515 -0.385 0 CA-C-O 121.707 0.765 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . 0.588 ' CG ' ' HD2' ' X' ' 8' ' ' PRO . 21.5 t70 -75.75 154.32 85.24 Favored Pre-proline 0 C--N 1.318 -0.764 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 176.544 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . 0.588 ' HD2' ' CG ' ' X' ' 7' ' ' ASP . 71.1 Cg_exo -39.07 -25.41 0.1 Allowed 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 123.233 2.622 . . . . 0.0 113.627 -178.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . 0.529 ' HD3' ' OD2' ' X' ' 7' ' ' ASP . 5.6 mtp180 -77.11 -48.11 18.64 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 176.054 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 79.6 mt -92.05 -26.4 18.34 Favored 'General case' 0 C--O 1.217 -0.608 0 O-C-N 122.254 -0.279 . . . . 0.0 111.672 -175.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.525 ' O ' ' HB3' ' X' ' 15' ' ' SER . 12.7 tt -69.69 -15.32 19.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 173.065 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -91.8 -58.4 2.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.001 174.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 50.2 m -90.86 -29.96 17.22 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -169.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.407 ' O ' ' HG3' ' X' ' 17' ' ' MET . 5.2 tt -94.52 -45.05 7.58 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 -179.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.525 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 19.3 t -64.77 -25.73 68.05 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.8 -175.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . 0.669 ' O ' ' HB2' ' X' ' 20' ' ' MET . 5.2 pp0? -65.96 -24.31 66.78 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 120.952 -0.299 . . . . 0.0 111.562 -179.549 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.528 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 4.6 ppp? -101.52 -27.38 13.14 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.775 0.322 . . . . 0.0 110.564 176.19 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 24.7 tp -65.93 -43.29 88.52 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.983 -179.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 29.6 t -96.84 8.82 43.5 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.09 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . 0.669 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 10.3 tpt -100.36 -31.42 11.34 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.972 0.415 . . . . 0.0 110.561 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.11 42.1 2.88 Favored Glycine 0 N--CA 1.447 -0.611 0 N-CA-C 111.058 -0.817 . . . . 0.0 111.058 -174.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.528 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 11.4 m-30 -115.76 171.23 7.88 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . 0.477 ' O ' HG22 ' X' ' 47' ' ' ILE . 32.4 m -153.35 161.95 41.79 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.605 177.059 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.505 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 15.6 p30 -68.54 136.95 53.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.124 0.487 . . . . 0.0 110.389 174.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . 0.684 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 38.5 tt0 -61.54 -19.45 62.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.366 -0.833 . . . . 0.0 111.22 -176.166 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -149.69 -64.68 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.677 176.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . 0.484 ' HA2' ' OD2' ' X' ' 24' ' ' ASP . . . 179.52 32.9 0.06 OUTLIER Glycine 0 CA--C 1.506 -0.531 0 N-CA-C 110.755 -0.938 . . . . 0.0 110.755 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.754 ' HH2' HG23 ' X' ' 47' ' ' ILE . 40.5 p-90 -96.83 -4.02 41.09 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -172.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.505 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 20.9 tp -59.11 -24.08 62.67 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.746 -0.596 . . . . 0.0 112.058 -170.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . 0.407 ' HA ' ' OE1' ' X' ' 34' ' ' GLN . 6.7 m -95.05 -11.88 27.57 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 121.368 0.604 . . . . 0.0 111.074 174.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -95.66 -54.84 3.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.727 -177.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -61.37 -61.04 2.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.105 -177.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.631 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 7.8 mp -60.37 -60.75 3.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.254 -172.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . 0.407 ' OE1' ' HA ' ' X' ' 30' ' ' THR . 12.2 mp0 -46.45 -43.01 16.21 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -173.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 40.2 p -76.9 -12.17 59.92 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 -176.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -118.69 32.97 5.85 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.624 0.231 . . . . 0.0 111.624 -177.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 45.9 t30 60.37 40.71 17.14 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.43 0.634 . . . . 0.0 110.513 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.631 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 18.1 m-85 55.86 61.03 2.96 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.649 -179.293 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -86.06 118.19 25.37 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.471 -173.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.689 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.3 OUTLIER -90.53 -4.34 10.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.37 173.72 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.92 -39.96 93.43 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 120.589 -0.815 . . . . 0.0 111.73 176.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.16 -25.86 14.39 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.07 -0.565 . . . . 0.0 111.11 178.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.689 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -65.01 -41.81 95.02 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.899 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.746 HD12 HD11 ' X' ' 47' ' ' ILE . 7.1 mp -65.34 -33.73 76.67 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.381 -178.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . 0.636 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.4 t70 -58.43 -39.34 79.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.018 0.437 . . . . 0.0 110.554 178.053 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 8.8 p -94.83 -6.38 42.96 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -177.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.754 HG23 ' HH2' ' X' ' 28' ' ' TRP . 13.0 pt -100.72 42.93 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 O-C-N 121.703 -0.623 . . . . 0.0 111.382 174.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 2.1 mt-30 89.49 -6.93 0.41 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.798 1.239 . . . . 0.0 113.318 173.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . 0.636 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 6.9 m-85 . . . . . 0 C--N 1.325 -0.475 0 O-C-N 121.944 -0.472 . . . . 0.0 111.59 178.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.512 -0.512 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . 0.486 ' O ' HG12 ' X' ' 11' ' ' ILE . 9.0 t70 -108.34 150.22 40.29 Favored Pre-proline 0 C--N 1.316 -0.871 0 CA-C-N 114.15 -1.387 . . . . 0.0 107.416 -177.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . 0.452 ' HD2' ' CG ' ' X' ' 7' ' ' ASP . 94.8 Cg_exo -42.76 -31.99 2.32 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.906 2.404 . . . . 0.0 113.25 -177.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . 0.508 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 69.1 mtp180 -78.08 -26.56 48.21 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 178.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . 0.717 HD22 ' HB2' ' X' ' 14' ' ' LEU . 56.5 mt -97.67 -22.3 16.54 Favored 'General case' 0 C--O 1.221 -0.421 0 C-N-CA 122.283 0.233 . . . . 0.0 110.788 177.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.554 ' O ' ' HB3' ' X' ' 15' ' ' SER . 43.5 mm -66.86 -13.86 17.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 108.617 -0.882 . . . . 0.0 108.617 171.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -93.73 -64.19 1.11 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.66 -1.155 . . . . 0.0 111.1 171.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . 0.527 ' O ' ' HE2' ' X' ' 17' ' ' MET . 15.9 m -86.92 -25.65 24.29 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -168.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.717 ' HB2' HD22 ' X' ' 10' ' ' LEU . 60.5 tp -93.37 -43.96 8.52 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.554 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 46.3 t -63.23 -26.75 68.93 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.173 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . 0.442 HE22 HD11 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -57.05 -47.92 79.78 Favored 'General case' 0 N--CA 1.461 0.089 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 174.399 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.618 ' HB3' ' O ' ' X' ' 22' ' ' PHE . 59.1 mtm -75.79 -43.99 43.59 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.204 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 28.9 tp -57.72 -32.86 67.83 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 123.4 0.437 . . . . 0.0 111.578 -177.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 46.8 t -88.07 -30.93 19.53 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.576 -178.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . 0.451 ' HB3' ' CE1' ' X' ' 22' ' ' PHE . 15.0 tpt -80.6 -31.51 36.69 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -176.319 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.43 24.57 4.37 Favored Glycine 0 CA--C 1.52 0.371 0 C-N-CA 119.976 -1.107 . . . . 0.0 113.939 176.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.618 ' O ' ' HB3' ' X' ' 17' ' ' MET . 0.0 OUTLIER -138.61 167.09 22.7 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 171.136 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 36.6 m -158.59 -91.57 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 119.971 -0.692 . . . . 0.0 111.926 -175.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.442 ' CG ' ' H ' ' X' ' 27' ' ' GLY . 56.2 t0 -119.17 122.92 43.11 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.297 -176.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . 0.799 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 54.8 tt0 -61.44 -29.45 69.95 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.249 176.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 155.84 40.33 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 119.567 -1.301 . . . . 0.0 115.294 173.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . 0.442 ' H ' ' CG ' ' X' ' 24' ' ' ASP . . . 146.09 -14.81 1.7 Allowed Glycine 0 C--N 1.332 0.342 0 C-N-CA 119.178 -1.487 . . . . 0.0 114.724 171.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.871 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 56.8 p-90 -96.2 -14.73 22.51 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 117.81 0.805 . . . . 0.0 113.041 -173.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.44 ' HA ' ' CE3' ' X' ' 28' ' ' TRP . 38.8 tp -54.76 -34.72 62.94 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.864 -0.523 . . . . 0.0 112.392 -170.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . 0.547 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 80.3 p -85.5 -16.45 39.52 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 122.167 -0.333 . . . . 0.0 111.273 177.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 13.7 mtm105 -95.37 -52.6 4.09 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.971 0.415 . . . . 0.0 111.216 -176.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -52.07 -70.34 0.09 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.241 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.584 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 7.0 mp -58.43 -45.51 88.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.992 -175.425 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . 0.547 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.0 OUTLIER -53.23 -38.99 63.44 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -174.231 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 40.5 p -94.37 -2.34 52.23 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.837 0.351 . . . . 0.0 111.938 -177.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -118.29 38.05 3.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.9 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 41.64 45.12 2.86 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.744 0.817 . . . . 0.0 111.928 -176.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.584 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 53.1 m-85 60.05 78.01 0.29 Allowed 'General case' 0 C--O 1.233 0.209 0 CA-C-N 114.873 -1.058 . . . . 0.0 111.382 178.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -97.86 120.96 39.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.704 -177.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.529 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.12 -19.96 7.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 172.029 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.18 -46.37 91.15 Favored Glycine 0 N--CA 1.441 -0.973 0 C-N-CA 120.493 -0.86 . . . . 0.0 112.277 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -83.81 -22.05 31.91 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.475 -0.362 . . . . 0.0 111.002 178.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.711 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -68.91 -47.4 65.9 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.944 178.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.529 HD13 ' O ' ' X' ' 40' ' ' ILE . 10.8 mp -67.36 -29.12 68.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.03 -179.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -65.13 -28.45 69.43 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 121.284 0.564 . . . . 0.0 110.897 178.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 7.6 p -96.08 -32.69 12.41 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -175.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.871 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 0.9 OUTLIER -83.36 -29.43 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -173.137 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . 0.565 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.3 mt-30 -164.04 -35.9 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 -177.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . 0.513 ' CE2' ' HE2' ' X' ' 22' ' ' PHE . 37.4 m-85 . . . . . 0 C--N 1.323 -0.551 0 CA-C-O 120.809 0.338 . . . . 0.0 110.707 -177.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.51 -0.577 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -106.94 142.19 24.47 Favored Pre-proline 0 C--N 1.314 -0.955 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 -179.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -44.96 -20.88 0.43 Allowed 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.152 2.568 . . . . 0.0 113.325 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 87.8 mtm-85 -92.56 -37.73 12.31 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 122.901 0.48 . . . . 0.0 112.11 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . 0.738 HD23 ' HB2' ' X' ' 13' ' ' SER . 36.7 mt -98.84 -10.66 22.63 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -175.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.698 ' O ' ' HB2' ' X' ' 15' ' ' SER . 12.6 tt -68.1 -21.91 27.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 175.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -95.62 -26.22 15.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.847 170.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . 0.738 ' HB2' HD23 ' X' ' 10' ' ' LEU . 20.3 m -96.65 -48.51 5.48 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -171.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.538 ' HB2' HD22 ' X' ' 10' ' ' LEU . 2.4 tm? -93.11 -44.13 8.52 Favored 'General case' 0 CA--C 1.507 -0.709 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 -179.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.698 ' HB2' ' O ' ' X' ' 11' ' ' ILE . 18.9 m -64.67 -17.83 64.42 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.277 -176.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . 0.527 ' NE2' ' HB3' ' X' ' 17' ' ' MET . 4.7 pp0? -78.28 -28.44 47.6 Favored 'General case' 0 N--CA 1.461 0.117 0 C-N-CA 120.557 -0.457 . . . . 0.0 111.091 177.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 1.046 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 23.0 ptp -94.16 -26.53 16.65 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.588 178.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 36.8 tp -57.46 -40.18 77.94 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.459 -179.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 25.6 m -70.8 -37.76 73.28 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -177.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -84.66 -26.24 27.93 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 111.895 0.331 . . . . 0.0 111.895 -174.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.69 46.15 0.86 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.318 -0.944 . . . . 0.0 112.277 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 1.046 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 6.5 m-85 -127.36 146.46 50.45 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 175.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 58.6 m -151.51 -116.89 0.04 OUTLIER 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.784 -175.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.681 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.4 p30 -122.47 142.89 50.09 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.182 172.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . 0.762 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 29.5 tt0 -67.58 -50.61 57.53 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.582 0.706 . . . . 0.0 110.054 177.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -133.77 -3.61 3.25 Favored Glycine 0 C--N 1.319 -0.372 0 CA-C-N 114.978 -1.01 . . . . 0.0 112.855 -178.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.05 12.16 3.66 Favored Glycine 0 C--N 1.33 0.205 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.739 178.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.774 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 28.2 p-90 -80.35 -6.96 58.82 Favored 'General case' 0 C--O 1.22 -0.453 0 N-CA-C 111.998 0.369 . . . . 0.0 111.998 -178.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.681 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 15.0 tp -56.6 -32.37 65.19 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.934 0.397 . . . . 0.0 111.627 -173.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . 0.497 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 35.1 p -82.3 -19.97 38.38 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.341 176.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . 0.602 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 8.8 mtm180 -95.24 -57.03 2.53 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.694 -175.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -51.35 -62.35 1.67 Allowed 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.608 0.763 . . . . 0.0 111.157 -177.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.841 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 7.3 mp -60.62 -45.48 93.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.243 -176.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . 0.497 ' HB2' ' O ' ' X' ' 30' ' ' THR . 3.7 tp-100 -39.15 -61.21 0.79 Allowed 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -175.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 26.7 p -85.3 -2.82 58.49 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -174.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -108.3 28.73 8.03 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 122.202 -0.311 . . . . 0.0 111.274 177.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 48.0 t30 60.31 42.7 14.57 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.09 0.471 . . . . 0.0 110.866 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.841 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 89.4 m-85 53.55 58.61 5.01 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.562 0.696 . . . . 0.0 110.177 -178.067 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -77.01 117.1 18.26 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.448 -1.251 . . . . 0.0 111.428 -172.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.634 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.78 -5.11 10.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.109 0.481 . . . . 0.0 110.291 170.958 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -80.28 -36.48 23.91 Favored Glycine 0 N--CA 1.439 -1.117 0 C-N-CA 120.476 -0.869 . . . . 0.0 111.52 178.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.56 -20.49 18.96 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.182 -0.509 . . . . 0.0 111.273 178.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.659 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -65.27 -45.01 86.19 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.019 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.634 HD13 ' O ' ' X' ' 40' ' ' ILE . 11.0 mp -66.26 -29.34 69.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.644 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -63.66 -29.5 70.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.281 176.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 3.6 p -98.04 -16.16 19.73 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -175.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.774 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 0.4 OUTLIER -94.06 -30.61 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 119.431 -0.908 . . . . 0.0 113.17 -176.292 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . 0.463 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.7 mp0 -161.22 -42.58 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.968 0.413 . . . . 0.0 110.966 -178.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . 0.432 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 60.0 m-85 . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.639 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.322 0 CA-C-O 121.434 0.635 . . . . 0.0 109.457 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . 0.534 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 28.9 t70 -81.7 147.22 58.42 Favored Pre-proline 0 C--N 1.318 -0.771 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 176.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . 0.534 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 83.9 Cg_exo -47.06 -24.92 3.68 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.07 1.847 . . . . 0.0 112.849 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 77.8 mtm-85 -94.17 -28.46 15.64 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . 0.501 HD22 ' HB2' ' X' ' 14' ' ' LEU . 50.2 mt -97.95 -16.97 19.48 Favored 'General case' 0 CA--C 1.514 -0.42 0 O-C-N 122.14 -0.35 . . . . 0.0 111.284 -177.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.536 ' HA ' ' HB2' ' X' ' 15' ' ' SER . 14.2 tt -73.02 -8.77 12.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 172.492 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . 0.546 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 45.8 mt-10 -93.65 -62.61 1.33 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.637 -1.165 . . . . 0.0 110.754 173.318 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 11.0 m -90.05 -27.93 19.38 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -168.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.501 ' HB2' HD22 ' X' ' 10' ' ' LEU . 9.5 tt -94.28 -44.39 7.97 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.536 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 12.9 t -66.71 -18.95 65.64 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.125 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . 0.546 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 0.0 OUTLIER -64.03 -44.27 93.03 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 175.239 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.614 ' SD ' HD13 ' X' ' 29' ' ' LEU . 62.1 mtt -69.86 -38.35 76.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.606 178.139 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . 0.437 ' HB2' ' HA ' ' X' ' 15' ' ' SER . 7.9 mp -62.12 -32.5 73.08 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.499 178.233 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 37.2 t -80.6 -44.35 19.08 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.331 -178.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 26.2 mmt -78.66 -32.21 47.07 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -175.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.6 46.86 0.82 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.363 -0.922 . . . . 0.0 112.124 -178.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -128.52 162.97 25.98 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 177.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 44.8 m -139.78 -143.25 0.16 Allowed 'General case' 0 C--N 1.315 -0.91 0 C-N-CA 120.576 -0.45 . . . . 0.0 109.789 178.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.715 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 21.8 p-10 -99.72 128.23 45.82 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.94 0.4 . . . . 0.0 110.272 173.395 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . 0.816 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 42.9 tp10 -83.71 56.99 3.86 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.751 0.786 . . . . 0.0 109.223 176.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 133.31 -87.33 0.27 Allowed Glycine 0 N--CA 1.446 -0.686 0 CA-C-N 114.827 -1.079 . . . . 0.0 111.476 -174.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -172.27 29.28 0.11 Allowed Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 121.041 -0.599 . . . . 0.0 111.741 177.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.824 ' HH2' HG23 ' X' ' 47' ' ' ILE . 53.3 p-90 -95.92 -9.66 30.74 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 -176.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.715 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 10.6 tp -59.69 -19.96 53.15 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 121.826 -0.546 . . . . 0.0 110.761 -175.663 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . 0.649 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 38.7 p -93.83 -48.03 6.48 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 121.993 -0.442 . . . . 0.0 110.624 169.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 42.7 mmm-85 -63.71 -61.22 2.45 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.287 -176.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . 0.645 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 2.0 tm? -50.33 -52.38 37.31 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.84 -178.276 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.424 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 62.3 mt -61.06 -62.01 2.16 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.305 -179.514 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . 0.649 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.0 OUTLIER -42.8 -54.69 4.0 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -175.966 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 29.6 p -68.39 -24.74 64.81 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -175.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 61.0 mttm -105.19 37.4 2.2 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.978 178.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 42.05 41.86 2.16 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.715 0.806 . . . . 0.0 112.841 -178.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.424 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 74.3 m-85 65.96 66.22 0.5 Allowed 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.033 177.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -104.25 120.18 40.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.257 -179.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.765 ' HB ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.26 -3.6 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.155 173.719 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.8 -41.01 97.76 Favored Glycine 0 N--CA 1.443 -0.878 0 C-N-CA 120.402 -0.904 . . . . 0.0 111.961 177.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.99 -20.27 16.84 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.156 -0.522 . . . . 0.0 111.18 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.698 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -74.33 -31.71 62.54 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.011 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.765 HD13 ' HB ' ' X' ' 40' ' ' ILE . 6.5 mp -75.43 -19.15 59.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.199 179.428 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . 0.544 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.5 t70 -70.33 -27.14 64.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.87 0.367 . . . . 0.0 110.502 177.287 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 17.9 p -95.83 -23.44 16.92 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.824 HG23 ' HH2' ' X' ' 28' ' ' TRP . 2.4 pp -84.09 42.55 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 178.336 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 84.67 7.55 0.5 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.164 0.985 . . . . 0.0 112.801 172.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . 0.544 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 15.9 m-85 . . . . . 0 C--N 1.325 -0.473 0 CA-C-O 121.082 0.468 . . . . 0.0 110.944 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.293 0 CA-C-O 121.821 0.82 . . . . 0.0 108.868 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -78.36 147.3 72.05 Favored Pre-proline 0 C--O 1.216 -0.678 0 CA-C-N 114.462 -1.245 . . . . 0.0 108.17 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -44.99 -23.14 0.85 Allowed 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 122.728 2.285 . . . . 0.0 113.272 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . 0.646 ' HD2' ' CE2' ' X' ' 38' ' ' TYR . 78.3 mtm180 -93.2 -33.93 13.8 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.996 -0.547 . . . . 0.0 112.315 -179.583 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . 0.493 HD22 ' HB2' ' X' ' 14' ' ' LEU . 83.8 mt -97.82 -19.02 18.41 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 122.212 -0.305 . . . . 0.0 111.019 -176.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.421 ' O ' HD13 ' X' ' 11' ' ' ILE . 0.3 OUTLIER -75.54 -9.9 13.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 170.826 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -96.44 -58.28 2.1 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.549 171.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . 0.426 ' HA ' HG23 ' X' ' 40' ' ' ILE . 45.9 t -96.35 -24.9 15.95 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 -167.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.493 ' HB2' HD22 ' X' ' 10' ' ' LEU . 9.8 tt -95.77 -43.87 7.68 Favored 'General case' 0 CA--C 1.508 -0.659 0 CA-C-N 118.997 0.817 . . . . 0.0 109.823 -176.566 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.601 ' HA ' ' HB3' ' X' ' 18' ' ' LEU . 61.4 p -74.91 -9.78 58.87 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.968 -178.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 5.1 tm0? -57.45 -60.54 3.5 Favored 'General case' 0 C--N 1.339 0.111 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 174.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.843 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 0.6 OUTLIER -73.77 -29.08 61.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.654 178.614 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . 0.601 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 26.4 tp -61.77 -30.97 71.15 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.504 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 23.1 t -97.42 -34.18 11.13 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 120.586 0.231 . . . . 0.0 111.254 -177.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 81.1 mtp -79.61 -12.88 59.82 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -176.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.68 42.1 3.21 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.272 -0.966 . . . . 0.0 113.264 176.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.843 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 46.0 m-85 -129.16 161.13 30.81 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 174.448 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 55.0 m -139.77 -177.83 5.14 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.707 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.568 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 6.2 p-10 -77.12 115.85 17.26 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.293 0.568 . . . . 0.0 109.983 175.347 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -86.11 59.68 5.78 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.117 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.73 -4.68 2.21 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.27 -0.967 . . . . 0.0 113.189 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . 0.404 ' HA2' ' OD2' ' X' ' 24' ' ' ASP . . . 86.09 21.04 53.95 Favored Glycine 0 N--CA 1.445 -0.744 0 C-N-CA 120.44 -0.886 . . . . 0.0 111.546 -177.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.615 ' HH2' HG23 ' X' ' 47' ' ' ILE . 46.2 p-90 -84.85 -10.74 56.84 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-O 119.625 -0.226 . . . . 0.0 111.432 -179.309 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.568 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 48.5 tp -59.01 -28.27 66.24 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.896 -0.503 . . . . 0.0 111.785 -170.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 28.9 m -94.37 -11.08 30.66 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 120.948 0.404 . . . . 0.0 111.118 174.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . 0.553 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 5.0 mtp-105 -96.04 -53.12 3.77 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.148 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 8.8 tp -64.85 -77.54 0.06 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.867 0.692 . . . . 0.0 112.867 -172.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.754 ' HA ' ' HB2' ' X' ' 36' ' ' LYS . 1.6 pp -69.4 -16.93 63.61 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -171.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . 0.456 ' N ' HD12 ' X' ' 33' ' ' LEU . 1.8 tp-100 -64.33 -33.75 76.57 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.5 0.191 . . . . 0.0 110.98 178.156 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 78.1 p -95.69 -16.88 21.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.972 0.415 . . . . 0.0 110.383 175.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . 0.754 ' HB2' ' HA ' ' X' ' 33' ' ' LEU . 43.9 mttp -87.81 38.71 0.85 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.603 177.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 43.73 40.08 2.85 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.842 0.857 . . . . 0.0 112.953 -178.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.646 ' CE2' ' HD2' ' X' ' 9' ' ' ARG . 72.8 m-85 58.74 71.35 0.59 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.713 173.368 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -125.59 142.43 51.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.736 0.779 . . . . 0.0 112.705 -179.168 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.806 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.1 OUTLIER -91.39 -3.98 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.27 173.594 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.12 -42.96 97.85 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.967 -178.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -94.17 -23.73 17.8 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.272 -0.464 . . . . 0.0 110.549 175.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.806 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -66.53 -32.57 74.0 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.093 178.355 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.608 HD12 HD11 ' X' ' 47' ' ' ILE . 3.3 tp -66.24 -35.87 81.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.236 0.541 . . . . 0.0 110.616 -179.513 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . 0.546 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 18.9 t70 -69.1 -34.27 74.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.019 178.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 44.9 p -91.63 -24.31 19.58 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -174.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.615 HG23 ' HH2' ' X' ' 28' ' ' TRP . 5.7 pt -72.19 -26.14 24.49 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 119.886 -0.726 . . . . 0.0 111.504 -176.444 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . 0.416 HE21 ' HB2' ' X' ' 48' ' ' GLN . 0.0 OUTLIER -173.94 -45.37 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 O-C-N 123.12 0.262 . . . . 0.0 111.081 178.679 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . 0.546 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 51.9 m-85 . . . . . 0 C--N 1.327 -0.377 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -173.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.397 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . 0.552 ' HB2' ' H ' ' X' ' 10' ' ' LEU . 2.9 m-20 -71.26 156.05 92.23 Favored Pre-proline 0 CA--C 1.505 -0.77 0 CA-C-N 114.895 -1.048 . . . . 0.0 108.622 178.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -58.44 -12.26 13.27 Favored 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 121.084 1.189 . . . . 0.0 110.489 169.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 37.3 mtp85 -93.34 -43.04 8.98 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 114.784 -1.098 . . . . 0.0 111.551 174.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . 0.625 HD22 ' HB2' ' X' ' 14' ' ' LEU . 32.0 mt -88.13 -21.94 24.37 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -173.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.492 ' O ' ' HB3' ' X' ' 15' ' ' SER . 15.1 tt -69.52 -17.12 21.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 172.528 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 50.9 mm-40 -95.05 -64.95 1.01 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.684 173.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 13.2 m -81.6 -26.55 34.8 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -169.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.625 ' HB2' HD22 ' X' ' 10' ' ' LEU . 0.2 OUTLIER -94.98 -49.32 5.6 Favored 'General case' 0 CA--C 1.506 -0.741 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 -179.823 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.492 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 21.9 t -62.59 -27.03 68.91 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.521 -176.639 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . 0.408 ' O ' ' HB2' ' X' ' 20' ' ' MET . 4.7 tm0? -51.14 -49.24 61.23 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 120.938 0.399 . . . . 0.0 110.662 176.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.798 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 10.5 ptm -97.96 -31.45 12.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.828 -176.186 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 29.2 tp -64.35 -31.94 73.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.822 0.344 . . . . 0.0 111.071 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 15.8 m -98.73 -7.52 27.56 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.443 -178.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . 0.432 ' HA ' ' CE ' ' X' ' 20' ' ' MET . 0.1 OUTLIER -92.63 -31.66 15.06 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.841 0.353 . . . . 0.0 110.808 -179.122 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.58 31.49 2.14 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.671 -0.776 . . . . 0.0 111.826 -176.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.798 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 20.4 m-30 -116.46 155.97 27.66 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 175.362 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -140.04 -159.43 0.96 Allowed 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 120.101 -0.639 . . . . 0.0 110.261 -179.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.997 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 18.8 p-10 -85.93 114.73 23.07 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.396 0.617 . . . . 0.0 109.542 172.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . 0.516 ' HB2' ' HE1' ' X' ' 28' ' ' TRP . 5.7 mm-40 -84.01 54.42 2.92 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.571 -178.344 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 139.77 -17.23 3.03 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.405 -177.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 111.65 7.69 23.65 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.173 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.761 ' HH2' HG23 ' X' ' 47' ' ' ILE . 51.7 p-90 -83.55 -22.26 32.45 Favored 'General case' 0 C--O 1.208 -1.112 0 CA-C-O 119.087 -0.483 . . . . 0.0 111.992 -178.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.997 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 11.6 tp -50.13 -34.67 22.97 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 118.898 0.772 . . . . 0.0 111.577 -174.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.53 -30.24 52.71 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 175.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 16.4 mtp180 -92.36 -55.52 3.38 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -175.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . 0.453 ' HB3' HD12 ' X' ' 33' ' ' LEU . 2.8 tm? -43.15 -59.89 1.88 Allowed 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.29 1.036 . . . . 0.0 111.996 -178.267 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.782 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.8 mp -70.58 -36.67 73.72 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.569 -174.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -52.63 -46.74 67.22 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -173.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 22.5 p -77.76 -12.09 59.94 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.801 0.334 . . . . 0.0 111.694 -178.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 50.1 mttp -112.51 37.66 2.99 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.114 -178.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 41.62 39.77 1.22 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.628 0.771 . . . . 0.0 112.172 -177.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.782 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 31.2 m-85 66.94 77.76 0.27 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.907 -179.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -106.19 126.7 52.54 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.675 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.585 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -90.22 -12.97 9.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 120.932 0.396 . . . . 0.0 110.201 172.208 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -60.22 -41.13 98.13 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.631 179.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.87 -17.43 21.11 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.751 0.31 . . . . 0.0 111.085 177.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.585 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -69.97 -42.97 72.43 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.658 177.207 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.739 HD12 HD11 ' X' ' 47' ' ' ILE . 8.9 mp -62.47 -27.34 69.06 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.085 -178.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . 0.481 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 33.5 t70 -55.13 -39.6 69.61 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.814 0.34 . . . . 0.0 111.709 179.026 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 1.1 p -95.99 -24.48 16.35 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 -177.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.761 HG23 ' HH2' ' X' ' 28' ' ' TRP . 8.3 pt -82.78 44.66 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 178.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 82.68 25.5 0.15 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.135 0.974 . . . . 0.0 113.14 171.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . 0.481 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 66.2 m-85 . . . . . 0 N--CA 1.468 0.455 0 N-CA-C 110.34 -0.244 . . . . 0.0 110.34 174.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.516 -0.344 0 CA-C-O 121.11 0.481 . . . . 0.0 109.706 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . 0.502 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 0.3 OUTLIER -67.35 152.86 95.75 Favored Pre-proline 0 CA--C 1.512 -0.505 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.026 177.248 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . 0.502 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 23.6 Cg_endo -59.45 -13.17 19.6 Favored 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 121.452 1.435 . . . . 0.0 110.574 171.486 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . 0.419 ' H ' ' HB3' ' X' ' 7' ' ' ASP . 36.5 mmt180 -93.78 -50.0 5.57 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.424 -1.262 . . . . 0.0 111.823 175.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . 0.791 HD22 ' HB2' ' X' ' 14' ' ' LEU . 89.5 mt -94.68 -17.02 22.62 Favored 'General case' 0 C--O 1.217 -0.608 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -169.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.521 ' O ' ' HB2' ' X' ' 15' ' ' SER . 0.2 OUTLIER -65.91 -25.23 35.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 175.471 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -94.87 -42.58 8.62 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.508 174.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . 0.478 ' HA ' HG23 ' X' ' 40' ' ' ILE . 4.0 t -94.97 -36.98 11.36 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 -166.807 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.791 ' HB2' HD22 ' X' ' 10' ' ' LEU . 8.4 tt -94.63 -42.82 8.59 Favored 'General case' 0 CA--C 1.51 -0.558 0 CA-C-O 121.51 0.671 . . . . 0.0 109.209 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.549 ' HA ' ' HB3' ' X' ' 18' ' ' LEU . 46.3 m -64.8 -17.27 64.07 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.123 -179.299 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -58.46 -63.04 1.42 Allowed 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.116 175.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.861 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 0.9 OUTLIER -76.13 -25.24 55.15 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.799 -0.361 . . . . 0.0 111.172 179.884 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . 0.549 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 37.2 tp -61.54 -34.8 76.18 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.817 0.342 . . . . 0.0 110.865 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 29.9 p -89.07 -42.21 11.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.574 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 91.4 mmm -66.53 -32.81 74.4 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -176.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 109.83 46.37 0.9 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.218 -0.991 . . . . 0.0 111.931 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.861 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 95.4 m-85 -130.63 172.21 12.2 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 175.679 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . 0.419 ' O ' HG22 ' X' ' 47' ' ' ILE . 50.2 m -155.27 -173.86 4.73 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.571 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 30.7 p30 -83.39 154.11 24.19 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.939 0.4 . . . . 0.0 110.125 172.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . 0.505 ' HG2' ' CD1' ' X' ' 28' ' ' TRP . 7.5 pt-20 -82.59 -7.41 59.65 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.197 -174.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -170.66 -28.91 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.713 -178.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . 0.455 ' HA2' ' OD2' ' X' ' 24' ' ' ASP . . . 148.39 31.09 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 119.983 -1.103 . . . . 0.0 112.937 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.848 ' HH2' HG23 ' X' ' 47' ' ' ILE . 40.4 p-90 -96.17 -13.89 23.19 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 178.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.576 HD21 ' HG ' ' X' ' 14' ' ' LEU . 30.4 tp -58.11 -15.2 8.65 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 122.019 -0.426 . . . . 0.0 111.584 -174.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 82.7 p -94.46 -56.35 2.84 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 121.823 -0.548 . . . . 0.0 110.614 169.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . 0.689 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -69.72 -51.4 34.65 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -174.761 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . 0.845 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 3.4 tm? -51.05 -54.79 21.61 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.757 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 10.8 mp -54.95 -60.12 3.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.825 177.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -40.0 -48.98 2.49 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.868 0.73 . . . . 0.0 112.556 -179.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 7.6 m -59.57 -51.28 70.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.022 -0.536 . . . . 0.0 112.017 -174.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.57 37.4 1.2 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 40.2 t30 61.98 61.01 1.43 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.4 176.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.757 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 81.0 m-85 43.9 52.86 6.5 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.351 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -82.37 130.74 35.17 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.46 -173.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.579 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.69 -12.2 9.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.058 169.688 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.51 -41.73 83.62 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.457 -0.877 . . . . 0.0 112.135 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -91.31 -19.57 22.82 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.339 -0.431 . . . . 0.0 110.943 177.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.531 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -71.58 -39.69 70.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.789 178.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.727 ' HA ' HG12 ' X' ' 47' ' ' ILE . 7.0 mp -65.55 -37.09 85.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.886 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -54.14 -35.92 62.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.233 176.189 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 7.4 p -96.25 -22.12 17.44 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -177.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.848 HG23 ' HH2' ' X' ' 28' ' ' TRP . 28.0 pt -83.97 42.78 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.8 -0.562 . . . . 0.0 111.715 176.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 72.85 20.46 3.59 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.405 0.682 . . . . 0.0 112.094 174.377 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . 0.497 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 9.7 m-30 . . . . . 0 C--N 1.328 -0.369 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 173.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.442 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . 0.545 ' O ' HG12 ' X' ' 11' ' ' ILE . 23.6 t70 -80.27 154.54 74.55 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 113.35 -1.75 . . . . 0.0 107.901 178.359 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . 0.457 ' HD2' ' CG ' ' X' ' 7' ' ' ASP . 68.8 Cg_exo -49.31 -21.66 4.9 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 121.98 1.787 . . . . 0.0 112.461 177.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . 0.44 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 34.6 mmt180 -87.27 -26.62 23.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.35 177.31 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . 0.464 HD12 ' HB2' ' X' ' 14' ' ' LEU . 4.4 mm? -98.01 -33.39 11.21 Favored 'General case' 0 C--O 1.222 -0.38 0 O-C-N 122.292 -0.255 . . . . 0.0 110.75 -175.653 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.545 HG12 ' O ' ' X' ' 7' ' ' ASP . 18.1 pt -68.97 -12.53 16.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 170.287 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -96.56 -66.49 0.9 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.148 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . 0.472 ' OG ' HG23 ' X' ' 40' ' ' ILE . 34.6 t -83.77 -23.23 31.62 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -170.163 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.464 ' HB2' HD12 ' X' ' 10' ' ' LEU . 2.6 tm? -92.51 -42.53 9.66 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 177.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.527 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 43.9 t -62.75 -24.93 67.95 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.209 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . 0.458 ' HB3' HE21 ' X' ' 16' ' ' GLN . 0.0 OUTLIER -55.17 -43.57 74.41 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.908 0.385 . . . . 0.0 110.551 176.99 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.651 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 9.5 ptm -96.66 -27.78 14.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.545 -178.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . 0.479 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 35.6 tp -64.22 -40.5 96.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.942 0.401 . . . . 0.0 110.815 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 19.0 m -91.72 -4.51 54.99 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.71 -176.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 16.7 tpt -102.78 -33.24 9.45 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.379 -179.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.65 46.52 0.67 Allowed Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.211 -0.995 . . . . 0.0 112.266 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.651 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 47.5 m-85 -125.63 163.62 22.38 Favored 'General case' 0 CA--C 1.507 -0.695 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 175.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . 0.478 ' O ' HG22 ' X' ' 47' ' ' ILE . 41.4 m -145.82 171.09 15.3 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 120.426 -0.51 . . . . 0.0 109.95 -179.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.472 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.6 p30 -69.51 134.0 48.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.2 0.524 . . . . 0.0 110.628 177.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . 0.591 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 33.3 tt0 -87.18 55.54 3.6 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.546 0.688 . . . . 0.0 109.379 177.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 136.01 -95.05 0.24 Allowed Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.371 -0.832 . . . . 0.0 111.918 -176.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -166.73 29.78 0.19 Allowed Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.991 -0.623 . . . . 0.0 111.673 178.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.629 ' HH2' HG23 ' X' ' 47' ' ' ILE . 53.6 p-90 -92.96 -14.08 27.96 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -176.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.472 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 13.8 tp -57.1 -24.52 54.67 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -168.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 77.1 p -82.71 -48.56 10.73 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.298 170.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 31.8 mtt-85 -60.07 -57.97 10.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.977 -177.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -50.28 -51.12 47.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.064 -176.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.46 HD13 ' O ' ' X' ' 29' ' ' LEU . 11.0 mp -62.64 -64.31 0.96 Allowed 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.27 179.554 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -43.42 -43.11 5.06 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -178.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 28.0 m -64.65 -52.24 58.4 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -176.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . 0.631 ' HB2' ' HB2' ' X' ' 39' ' ' ASP . 0.0 OUTLIER -93.38 40.28 1.06 Allowed 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -176.638 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 5.7 p-10 44.29 51.11 7.65 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.324 0.649 . . . . 0.0 111.84 -176.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.44 ' CD2' ' HB3' ' X' ' 9' ' ' ARG . 57.8 m-85 64.37 73.39 0.43 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 114.467 -1.242 . . . . 0.0 111.003 178.147 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . 0.631 ' HB2' ' HB2' ' X' ' 36' ' ' LYS . 2.5 t0 -97.35 117.72 32.23 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.045 -0.979 . . . . 0.0 111.127 -176.379 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.586 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.1 -18.38 7.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 121.102 0.477 . . . . 0.0 109.791 171.367 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.18 -34.12 89.08 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.543 179.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -100.01 -20.61 15.99 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.729 0.3 . . . . 0.0 111.282 177.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.471 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -72.47 -36.22 68.41 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.45 179.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.72 ' HA ' HG12 ' X' ' 47' ' ' ILE . 7.0 mp -63.68 -31.64 72.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.098 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . 0.54 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.9 t70 -55.18 -48.71 73.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.949 177.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 3.3 p -85.98 -5.61 59.19 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 -177.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.72 HG12 ' HA ' ' X' ' 44' ' ' LEU . 30.1 pt -106.24 43.3 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 O-C-N 121.902 -0.499 . . . . 0.0 111.272 175.151 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . 0.415 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 1.1 mp0 85.05 22.86 0.09 Allowed 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.657 1.183 . . . . 0.0 113.308 173.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . 0.645 ' HE1' ' CZ ' ' X' ' 22' ' ' PHE . 32.2 m-85 . . . . . 0 C--N 1.327 -0.407 0 N-CA-C 110.224 -0.288 . . . . 0.0 110.224 172.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 -0.191 0 CA-C-O 121.196 0.522 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -73.14 156.8 89.15 Favored Pre-proline 0 CA--C 1.509 -0.601 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.966 177.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -55.07 -12.76 5.5 Favored 'Trans proline' 0 CA--C 1.536 0.576 0 C-N-CA 121.307 1.338 . . . . 0.0 110.987 169.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -90.99 -49.13 6.59 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.01 177.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . 0.517 HD22 ' HB2' ' X' ' 14' ' ' LEU . 53.9 mt -97.85 -17.55 19.24 Favored 'General case' 0 C--O 1.22 -0.491 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -173.168 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.608 ' O ' ' HB3' ' X' ' 15' ' ' SER . 0.5 OUTLIER -66.75 -21.33 28.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.876 0.846 . . . . 0.0 108.932 174.083 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -95.15 -45.83 7.04 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.584 175.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 8.1 t -94.05 -36.3 12.18 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -169.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.566 HD13 HD21 ' X' ' 29' ' ' LEU . 42.1 tp -92.71 -43.44 9.06 Favored 'General case' 0 CA--C 1.51 -0.582 0 O-C-N 121.682 -0.636 . . . . 0.0 109.791 179.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.608 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 33.4 t -61.43 -25.64 67.34 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.818 -175.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . 0.485 ' NE2' ' HB3' ' X' ' 17' ' ' MET . 4.2 pp0? -73.01 -30.58 63.87 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 120.584 -0.446 . . . . 0.0 111.21 179.22 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.781 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 23.7 ptp -90.14 -27.86 19.33 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.28 177.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 27.7 tp -63.93 -28.59 69.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.795 178.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 8.9 p -93.69 -44.21 8.28 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.901 -179.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 25.0 mmt -69.99 -24.09 63.26 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -175.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.82 47.39 1.27 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.087 -1.054 . . . . 0.0 112.555 -179.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.781 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 47.5 m-85 -127.06 144.5 51.01 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 176.274 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 14.3 m -144.39 169.95 16.95 Favored 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 119.855 -0.738 . . . . 0.0 111.233 -173.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.578 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 8.4 p-10 -71.73 131.19 42.76 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.798 173.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . 0.569 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 16.0 tp10 -69.21 -69.18 0.35 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.718 -177.475 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -97.47 -20.29 22.88 Favored Glycine 0 C--N 1.316 -0.539 0 C-N-CA 120.951 -0.643 . . . . 0.0 113.169 -179.236 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.52 32.67 0.81 Allowed Glycine 0 CA--C 1.507 -0.407 0 C-N-CA 120.537 -0.839 . . . . 0.0 111.211 -176.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.637 ' HH2' HG23 ' X' ' 47' ' ' ILE . 23.9 p-90 -96.15 -3.79 43.86 Favored 'General case' 0 C--O 1.217 -0.647 0 CA-C-N 115.173 -0.513 . . . . 0.0 111.452 -176.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.777 HD12 HD13 ' X' ' 33' ' ' LEU . 11.0 tp -60.19 -32.26 70.92 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 122.176 -0.328 . . . . 0.0 111.348 -172.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . 0.401 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 4.6 m -79.89 -15.39 57.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.965 0.412 . . . . 0.0 110.821 175.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . 0.547 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 11.3 mtm180 -96.33 -60.24 1.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.033 0.444 . . . . 0.0 111.168 -178.122 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -49.31 -72.63 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.773 -178.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.777 HD13 HD12 ' X' ' 29' ' ' LEU . 6.9 mp -56.75 -45.77 81.82 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.787 -174.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . 0.401 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.0 OUTLIER -49.59 -51.76 34.98 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -176.972 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 2.2 m -77.64 -7.44 56.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.073 0.463 . . . . 0.0 111.107 -177.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -115.06 37.83 3.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.362 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 11.7 p30 49.74 33.04 5.73 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.02 0.928 . . . . 0.0 112.777 179.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.505 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 67.8 m-85 63.83 70.15 0.52 Allowed 'General case' 0 C--O 1.234 0.267 0 C-N-CA 122.955 0.502 . . . . 0.0 110.818 178.196 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 44.7 p-10 -111.42 141.04 45.49 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.683 0.754 . . . . 0.0 112.72 -178.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.577 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -92.6 -6.17 10.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.385 170.244 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.21 -44.19 76.83 Favored Glycine 0 CA--C 1.505 -0.565 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.435 -177.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.84 -18.49 20.33 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 120.827 0.346 . . . . 0.0 110.831 177.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.577 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -71.63 -31.92 67.4 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.778 177.797 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.806 HD12 HD11 ' X' ' 47' ' ' ILE . 6.1 tp -65.14 -31.54 72.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.111 0.481 . . . . 0.0 110.443 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -73.94 -27.55 61.07 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.847 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 22.9 p -97.15 -31.12 12.63 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 -175.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.806 HD11 HD12 ' X' ' 44' ' ' LEU . 2.1 pt -64.63 -26.93 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -171.368 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -167.74 -39.09 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 120.77 0.319 . . . . 0.0 111.077 177.024 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 60.2 m-85 . . . . . 0 C--N 1.327 -0.407 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.94 -177.578 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.512 -0.482 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -102.02 150.03 37.08 Favored Pre-proline 0 C--N 1.317 -0.822 0 CA-C-N 114.191 -1.368 . . . . 0.0 108.127 -176.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -45.24 -25.87 2.15 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.33 2.02 . . . . 0.0 113.11 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 50.5 mtp85 -92.95 -35.0 13.54 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 178.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 97.1 mt -88.28 -18.03 29.43 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 116.8 -0.182 . . . . 0.0 110.81 -177.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.481 ' HA ' ' HB2' ' X' ' 15' ' ' SER . 0.4 OUTLIER -63.83 -26.04 39.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.639 0.733 . . . . 0.0 109.272 171.318 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . 0.555 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 5.3 mm-40 -85.81 -45.24 11.77 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.368 176.596 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . 0.579 ' HB2' HD23 ' X' ' 33' ' ' LEU . 11.2 p -96.09 -43.14 7.9 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 113.858 1.058 . . . . 0.0 113.858 -169.44 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.592 ' HG ' HD11 ' X' ' 29' ' ' LEU . 2.9 tt -93.09 -45.44 7.9 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -176.224 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.481 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 33.1 m -68.5 -14.56 63.09 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.414 179.532 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . 0.555 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 0.7 OUTLIER -62.3 -65.95 0.61 Allowed 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 171.106 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.488 ' CB ' ' HB2' ' X' ' 22' ' ' PHE . 70.5 mtm -62.71 -39.46 94.08 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.874 -179.051 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 30.0 tp -61.09 -34.4 74.87 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -177.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 27.8 t -94.99 -8.44 36.9 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.602 0.239 . . . . 0.0 111.563 -177.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 50.5 tpp -101.74 -31.81 10.6 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.495 -178.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.26 34.31 1.64 Allowed Glycine 0 CA--C 1.511 -0.214 0 C-N-CA 120.581 -0.818 . . . . 0.0 111.501 -177.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.508 ' HB3' HD12 ' X' ' 47' ' ' ILE . 4.5 m-85 -121.76 138.77 54.23 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 176.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 68.8 m -134.83 -128.15 0.16 Allowed 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.687 -176.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.589 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.6 p30 -120.98 136.96 54.86 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.751 173.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . 0.413 ' HB2' ' HE1' ' X' ' 28' ' ' TRP . 23.2 tt0 -68.46 -38.49 81.13 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.002 0.429 . . . . 0.0 110.385 -177.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -144.15 -0.14 1.07 Allowed Glycine 0 CA--C 1.519 0.33 0 C-N-CA 120.739 -0.743 . . . . 0.0 113.57 -178.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 123.09 28.67 1.33 Allowed Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.253 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.812 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 32.9 p-90 -96.53 -8.76 31.16 Favored 'General case' 0 C--O 1.218 -0.597 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -178.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.592 HD11 ' HG ' ' X' ' 14' ' ' LEU . 20.3 tp -65.48 -17.39 64.52 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.069 0.461 . . . . 0.0 110.342 -176.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -93.8 -16.34 24.23 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.799 172.052 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . 0.428 ' HD3' ' HA ' ' X' ' 28' ' ' TRP . 19.8 mtp85 -97.33 -66.07 0.92 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.213 0.53 . . . . 0.0 112.106 -177.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -46.92 -73.47 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 114.093 -1.412 . . . . 0.0 112.682 -172.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.678 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.8 mp -50.49 -51.94 42.74 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-O 121.027 0.441 . . . . 0.0 111.346 -174.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 15.0 mp0 -50.67 -38.55 47.19 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.69 -178.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 5.3 m -86.46 -6.77 58.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.986 0.422 . . . . 0.0 110.993 -177.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -125.41 38.83 4.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.891 -177.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 10.1 p30 56.91 22.45 7.15 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.247 1.019 . . . . 0.0 113.061 178.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.678 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 15.1 m-85 72.34 73.25 0.15 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.608 0.763 . . . . 0.0 110.11 177.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 45.4 p-10 -115.11 142.92 45.99 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.558 0.694 . . . . 0.0 112.581 -177.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.612 HD13 ' H ' ' X' ' 40' ' ' ILE . 0.1 OUTLIER -91.54 -19.5 7.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.082 173.09 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.12 -39.42 97.61 Favored Glycine 0 CA--C 1.506 -0.526 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.598 -177.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . 0.446 ' O ' ' HB3' ' X' ' 45' ' ' ASP . . . -96.39 -10.36 27.8 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.47 -0.365 . . . . 0.0 110.642 176.627 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.527 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -73.69 -47.4 39.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.039 178.11 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . . . . . . . . . 10.7 mp -58.81 -33.55 70.5 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.72 0.295 . . . . 0.0 110.616 177.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . 0.446 ' HB3' ' O ' ' X' ' 42' ' ' ALA . 15.4 t0 -55.19 -45.78 75.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.197 175.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 1.2 p -86.13 -6.04 59.09 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 114.187 1.18 . . . . 0.0 114.187 -171.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.812 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 0.1 OUTLIER -109.58 -26.78 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-N 119.371 0.987 . . . . 0.0 112.893 178.685 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . 0.635 ' NE2' ' HB ' ' X' ' 47' ' ' ILE . 1.5 mp0 -155.59 -44.75 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.83 0.347 . . . . 0.0 111.54 -176.747 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 . . . . . 0 C--N 1.326 -0.413 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.29 -174.664 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.426 0 CA-C-O 121.498 0.666 . . . . 0.0 109.227 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . 0.516 ' H ' ' HB2' ' X' ' 10' ' ' LEU . 0.3 OUTLIER -85.83 155.48 58.6 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-N 114.823 -1.081 . . . . 0.0 109.24 -178.924 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.65 -14.31 30.63 Favored 'Trans proline' 0 CA--C 1.533 0.434 0 C-N-CA 121.144 1.229 . . . . 0.0 110.293 170.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 80.2 mtm180 -93.73 -30.67 14.76 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.245 175.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . 0.516 ' HB2' ' H ' ' X' ' 7' ' ' ASP . 96.5 mt -98.44 -18.43 18.25 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -174.597 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.485 ' O ' ' HB3' ' X' ' 15' ' ' SER . 44.8 mm -68.35 -16.24 20.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 170.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . 0.569 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 38.2 tt0 -93.4 -54.79 3.54 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.253 174.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . 0.418 ' HA ' HG23 ' X' ' 40' ' ' ILE . 22.8 t -94.49 -27.94 15.72 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -169.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . . . . . . . . . 9.3 tt -94.5 -47.6 6.48 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 -179.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.485 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 35.1 t -62.87 -28.82 70.3 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.094 -179.397 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . 0.569 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 0.0 OUTLIER -50.11 -43.08 51.51 Favored 'General case' 0 N--CA 1.463 0.186 0 O-C-N 123.507 0.505 . . . . 0.0 110.993 178.326 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.806 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 18.9 ptp -99.26 -30.46 12.23 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.736 -176.05 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -65.44 -33.91 77.06 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -176.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 57.6 p -98.78 -12.16 21.16 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -178.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 12.3 tpt -88.04 -23.84 23.64 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.046 -178.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.93 44.93 0.72 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.621 179.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.806 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 4.0 m-85 -116.77 -174.26 2.54 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 176.36 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . 0.557 ' O ' HG21 ' X' ' 47' ' ' ILE . 50.6 m -150.47 -161.03 1.25 Allowed 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.126 -0.63 . . . . 0.0 111.143 178.143 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.479 ' HA ' ' HE1' ' X' ' 28' ' ' TRP . 7.6 t70 -116.63 123.99 48.68 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 177.056 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -119.24 78.98 1.35 Allowed 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 120.829 0.347 . . . . 0.0 110.493 -177.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 124.74 -6.79 8.38 Favored Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.524 -0.846 . . . . 0.0 113.831 176.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.37 12.16 63.43 Favored Glycine 0 C--O 1.23 -0.13 0 C-N-CA 120.61 -0.805 . . . . 0.0 111.663 -177.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.712 ' HE3' ' HB3' ' X' ' 32' ' ' LEU . 31.2 p-90 -65.1 -34.52 78.6 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-N 115.127 -0.537 . . . . 0.0 111.572 -179.116 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . . . . . . . . . 51.8 tp -55.11 -22.5 16.78 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -165.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 51.2 p -94.66 -32.52 13.35 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.697 -0.627 . . . . 0.0 111.774 175.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . 0.44 ' CG ' ' HA ' ' X' ' 28' ' ' TRP . 31.8 ptt180 -94.22 -40.1 10.18 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -173.286 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . 0.712 ' HB3' ' HE3' ' X' ' 28' ' ' TRP . 2.9 tm? -61.91 -56.27 21.04 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 123.401 0.68 . . . . 0.0 110.24 -178.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 10.5 mp -55.06 -50.4 69.21 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.504 177.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -47.35 -53.24 14.26 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.421 -177.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 19.7 m -73.62 -23.98 59.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.918 0.39 . . . . 0.0 110.966 -178.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . 0.53 ' HB3' ' HB3' ' X' ' 39' ' ' ASP . 14.7 mptt -95.33 33.67 1.54 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.515 178.27 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 15.0 p30 46.73 35.5 3.15 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.519 0.728 . . . . 0.0 112.446 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 66.94 69.9 0.39 Allowed 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.364 0.666 . . . . 0.0 110.038 -178.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . 0.53 ' HB3' ' HB3' ' X' ' 36' ' ' LYS . 30.2 t70 -121.9 137.6 54.72 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.449 -173.272 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.756 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -90.43 -8.5 10.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.735 173.096 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . 0.419 ' H ' ' CG ' ' X' ' 39' ' ' ASP . . . -62.85 -48.35 81.61 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.124 -177.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -93.48 -10.56 34.56 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.898 -0.651 . . . . 0.0 110.818 175.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.756 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -68.29 -47.55 67.32 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.674 -179.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.414 HD13 ' O ' ' X' ' 40' ' ' ILE . 10.3 mp -71.57 -20.2 62.04 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.119 -178.408 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -70.45 -23.05 62.64 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.431 -178.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 33.0 p -95.3 -23.55 17.16 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -174.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.62 ' O ' ' HG3' ' X' ' 48' ' ' GLN . 1.7 pt -102.8 -26.75 3.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -172.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . 0.62 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.7 mt-30 -157.31 -53.36 0.07 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 118.351 0.523 . . . . 0.0 111.412 -176.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 . . . . . 0 C--N 1.322 -0.588 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 176.573 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.516 -0.362 0 CA-C-O 121.807 0.813 . . . . 0.0 109.987 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . 0.455 ' O ' HG22 ' X' ' 11' ' ' ILE . 13.3 t70 -94.28 149.47 36.78 Favored Pre-proline 0 C--N 1.315 -0.904 0 CA-C-N 114.606 -1.179 . . . . 0.0 108.237 -178.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . 0.749 ' O ' ' HB2' ' X' ' 12' ' ' GLU . 63.2 Cg_exo -48.28 -13.37 0.23 Allowed 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.022 2.482 . . . . 0.0 113.033 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . 0.449 ' HB3' ' CD1' ' X' ' 38' ' ' TYR . 10.4 mmt-85 -71.5 -48.81 46.61 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.394 173.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . 0.548 HD22 ' HB2' ' X' ' 14' ' ' LEU . 24.3 mt -100.08 -41.16 7.26 Favored 'General case' 0 C--O 1.222 -0.366 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -178.2 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.621 ' O ' ' HB3' ' X' ' 15' ' ' SER . 11.2 tt -63.01 -22.3 30.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.1 0.476 . . . . 0.0 110.112 -179.057 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . 0.749 ' HB2' ' O ' ' X' ' 8' ' ' PRO . 0.4 OUTLIER -94.26 -59.58 1.92 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.809 172.378 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . 0.434 ' HB2' ' O ' ' X' ' 9' ' ' ARG . 49.4 m -85.62 -25.72 26.48 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -169.24 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.548 ' HB2' HD22 ' X' ' 10' ' ' LEU . 10.4 tt -93.0 -40.7 10.4 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 178.637 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.621 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 32.1 t -68.08 -16.65 64.11 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.867 177.211 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . 0.539 ' O ' ' HB2' ' X' ' 20' ' ' MET . 0.0 OUTLIER -55.24 -45.4 76.04 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.067 0.461 . . . . 0.0 110.316 174.464 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.668 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 15.0 ptm -99.9 -20.29 16.21 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.668 -176.305 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . 0.451 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 46.0 tp -60.12 -49.34 78.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.772 0.32 . . . . 0.0 111.005 -179.459 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 16.0 p -98.86 9.26 43.83 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -178.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . 0.539 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 27.4 ttt -91.43 -28.33 17.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.035 0.445 . . . . 0.0 111.022 -178.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.35 34.55 1.59 Allowed Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.572 -0.823 . . . . 0.0 111.179 -174.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.668 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 14.9 m-30 -117.83 -174.72 2.69 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 175.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 71.7 p -161.38 -163.35 0.99 Allowed 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 119.621 -0.832 . . . . 0.0 111.043 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.634 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 0.7 OUTLIER -112.64 115.18 28.17 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 166.882 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . 0.563 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 62.9 tt0 -51.65 -34.88 39.88 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.007 -175.607 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -124.16 -68.65 0.21 Allowed Glycine 0 C--N 1.318 -0.465 0 N-CA-C 111.24 -0.744 . . . . 0.0 111.24 173.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -176.31 29.97 0.08 OUTLIER Glycine 0 CA--C 1.508 -0.379 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 177.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.759 ' HH2' HG23 ' X' ' 47' ' ' ILE . 45.7 p-90 -97.33 -9.73 26.95 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -172.281 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.634 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 12.5 tp -52.52 -25.71 11.07 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -169.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . 0.456 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 32.1 p -84.44 -55.9 3.91 Favored 'General case' 0 C--N 1.322 -0.604 0 O-C-N 121.876 -0.515 . . . . 0.0 110.421 170.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.4 -51.9 50.63 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.785 -177.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -51.26 -60.36 3.21 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 123.266 0.626 . . . . 0.0 111.114 -177.319 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.462 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 8.8 mp -62.86 -44.83 95.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.134 -179.114 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.8 OUTLIER -49.47 -47.06 48.68 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -178.45 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 4.7 m -80.8 -23.92 38.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.957 0.408 . . . . 0.0 111.25 -176.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -102.5 39.72 1.47 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -175.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 12.2 p30 50.4 29.32 3.81 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.728 0.811 . . . . 0.0 112.512 179.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.462 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 92.6 m-85 71.27 71.46 0.18 Allowed 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.825 177.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -114.52 130.16 56.72 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.891 -174.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.565 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -90.92 -17.9 7.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.077 169.87 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.26 -34.78 90.28 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.219 179.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.82 -15.68 19.16 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.38 -0.41 . . . . 0.0 111.002 176.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.565 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -72.48 -38.94 68.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.939 0.4 . . . . 0.0 110.777 178.623 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.545 ' HG ' HD11 ' X' ' 47' ' ' ILE . 9.0 mp -76.75 -18.3 58.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.486 178.2 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -69.29 -34.73 75.16 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.547 175.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 7.1 p -95.75 -6.04 40.65 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -174.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.759 HG23 ' HH2' ' X' ' 28' ' ' TRP . 6.6 pt -100.2 -30.22 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 119.613 -0.835 . . . . 0.0 113.205 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . 0.543 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.9 mp0 -165.79 -48.01 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.256 0.55 . . . . 0.0 110.595 -177.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 . . . . . 0 C--N 1.325 -0.495 0 CA-C-N 114.977 -1.01 . . . . 0.0 110.53 -172.894 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.228 0 CA-C-O 121.973 0.892 . . . . 0.0 108.841 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -84.4 144.97 44.23 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 114.31 -1.313 . . . . 0.0 107.893 177.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -41.6 -26.77 0.42 Allowed 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 123.253 2.635 . . . . 0.0 113.764 -178.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . 0.524 ' HD2' ' CE2' ' X' ' 38' ' ' TYR . 83.9 mtm180 -83.45 -42.58 16.77 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 178.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 3.9 mp -97.28 -17.08 20.02 Favored 'General case' 0 C--O 1.216 -0.659 0 O-C-N 122.277 -0.264 . . . . 0.0 111.55 -174.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.562 ' O ' ' HB3' ' X' ' 15' ' ' SER . 10.5 tt -73.93 -12.95 15.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 170.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -93.81 -50.23 5.45 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 114.396 -1.275 . . . . 0.0 110.761 174.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . 0.582 ' HA ' HG23 ' X' ' 40' ' ' ILE . 44.1 p -95.01 -34.09 12.47 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -171.236 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.522 ' HG ' HD11 ' X' ' 29' ' ' LEU . 6.4 tt -93.36 -44.54 8.23 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 -178.284 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.562 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 16.1 t -66.72 -21.72 66.07 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.924 -178.392 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 7.0 tm0? -56.54 -55.39 34.44 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.341 174.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.786 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 23.6 ptp -80.37 -26.91 38.36 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.926 -178.268 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . 0.436 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 33.5 tp -64.83 -29.38 70.34 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.03 0.443 . . . . 0.0 110.613 178.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 14.1 t -94.64 -14.23 25.1 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.892 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 35.9 tpp -96.05 -32.22 12.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.154 -176.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.27 38.0 1.16 Allowed Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.706 -0.759 . . . . 0.0 111.876 -179.163 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.786 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 51.8 m-85 -136.05 160.88 37.29 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 50.7 m -151.6 -161.95 1.43 Allowed 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.148 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.965 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 11.3 p-10 -69.17 120.63 15.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.926 0.394 . . . . 0.0 109.997 173.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -102.64 58.25 0.79 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.447 0.641 . . . . 0.0 109.305 179.193 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 145.29 -8.1 1.63 Allowed Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.404 -176.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 96.82 15.48 39.5 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 121.193 -0.527 . . . . 0.0 111.847 -178.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.874 ' HH2' HG23 ' X' ' 47' ' ' ILE . 46.9 p-90 -95.7 -7.05 38.45 Favored 'General case' 0 C--O 1.221 -0.437 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -174.871 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.965 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 6.1 tp -59.06 -24.92 63.3 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.686 0.675 . . . . 0.0 111.11 -175.011 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 38.5 p -93.59 -40.2 10.41 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 121.853 -0.529 . . . . 0.0 110.855 170.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 15.8 mmm180 -60.61 -64.41 0.96 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.076 0.465 . . . . 0.0 111.339 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -53.22 -60.46 3.26 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.903 -178.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 10.9 mp -54.08 -68.01 0.22 Allowed 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.352 -174.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -47.71 -46.46 29.67 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -176.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 23.4 m -66.89 -33.02 74.69 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.7 0.286 . . . . 0.0 111.616 -178.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . 0.534 ' O ' ' HB2' ' X' ' 39' ' ' ASP . 5.6 mptp? -95.43 26.44 3.86 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 178.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 39.0 t30 62.82 50.1 3.43 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 121.238 0.542 . . . . 0.0 110.832 179.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.524 ' CE2' ' HD2' ' X' ' 9' ' ' ARG . 92.0 m-85 48.23 53.91 11.09 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.862 -179.623 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . 0.534 ' HB2' ' O ' ' X' ' 36' ' ' LYS . 1.8 t0 -93.27 128.78 39.4 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.394 -173.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.582 HG23 ' HA ' ' X' ' 13' ' ' SER . 0.0 OUTLIER -89.61 -12.01 9.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.413 171.829 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.97 -36.51 93.16 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.603 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.02 -24.7 14.82 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.875 0.369 . . . . 0.0 110.988 177.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.577 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -64.84 -37.99 89.47 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.154 178.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.704 ' HA ' ' CG1' ' X' ' 47' ' ' ILE . 7.2 mp -68.28 -37.35 80.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.292 -178.319 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . 0.602 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.0 t70 -55.18 -37.32 66.91 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.832 0.349 . . . . 0.0 110.828 179.274 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 14.3 p -88.73 -29.05 20.11 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.874 HG23 ' HH2' ' X' ' 28' ' ' TRP . 24.6 pt -79.93 43.91 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 O-C-N 121.644 -0.66 . . . . 0.0 112.084 175.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 78.79 8.7 1.99 Allowed 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 172.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . 0.602 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 14.0 m-85 . . . . . 0 C--N 1.328 -0.362 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 170.97 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 -0.277 0 CA-C-O 121.179 0.514 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -86.0 145.91 41.94 Favored Pre-proline 0 C--N 1.32 -0.675 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 173.74 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -43.08 -26.79 0.83 Allowed 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.189 2.593 . . . . 0.0 113.191 -179.119 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . 0.506 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 69.1 mtt85 -80.03 -44.22 20.52 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.927 177.992 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . 0.671 HD22 ' HB2' ' X' ' 14' ' ' LEU . 86.1 mt -98.07 -15.43 20.01 Favored 'General case' 0 C--O 1.217 -0.652 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -172.367 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.515 ' O ' ' HB2' ' X' ' 15' ' ' SER . 11.7 tt -71.8 -17.09 19.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 169.348 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 46.5 tp10 -94.46 -58.63 2.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.4 -1.273 . . . . 0.0 111.191 175.412 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 14.1 m -91.89 -22.66 19.95 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -170.251 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.671 ' HB2' HD22 ' X' ' 10' ' ' LEU . 53.4 tp -94.3 -48.03 6.35 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 177.679 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.515 ' HB2' ' O ' ' X' ' 11' ' ' ILE . 45.0 m -66.89 -18.87 65.59 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.689 -176.345 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 5.0 tm0? -60.39 -49.19 78.55 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.161 0.505 . . . . 0.0 110.333 173.944 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.648 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 4.5 ppp? -91.31 -21.07 21.23 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.325 -177.04 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . 0.412 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 28.6 tp -69.62 -39.56 77.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.835 -179.985 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 21.0 p -72.7 -41.95 64.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.637 -179.571 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 15.5 tpt -71.61 -29.53 64.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.475 -176.198 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.48 47.23 1.7 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.041 -1.076 . . . . 0.0 112.066 -178.947 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.648 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 31.5 m-85 -106.96 172.2 6.95 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 174.345 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . 0.435 ' O ' HG22 ' X' ' 47' ' ' ILE . 10.7 m -148.24 169.95 18.96 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 119.976 -0.69 . . . . 0.0 110.254 179.187 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.637 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 8.2 p-10 -71.24 140.92 50.58 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 170.98 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -116.35 65.85 0.71 Allowed 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.87 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 139.1 -3.56 2.78 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.662 -175.942 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 83.13 26.23 45.25 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.978 -179.575 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.775 ' HH2' HG23 ' X' ' 47' ' ' ILE . 55.0 p-90 -96.94 -17.93 19.79 Favored 'General case' 0 C--O 1.216 -0.683 0 CA-C-O 119.081 -0.485 . . . . 0.0 112.152 -176.353 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.637 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 35.3 tp -47.46 -45.55 26.01 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -168.303 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 30.2 p -69.05 -49.16 59.97 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.746 0.307 . . . . 0.0 110.878 176.017 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . 0.567 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 4.2 mtm180 -57.47 -60.59 3.42 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.617 -178.647 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . 0.479 ' O ' ' HB2' ' X' ' 36' ' ' LYS . 2.1 tm? -48.67 -55.03 12.46 Favored 'General case' 0 C--O 1.23 0.079 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.25 -178.543 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 92.6 mt -59.88 -67.7 0.36 Allowed 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.751 -178.373 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -43.19 -56.15 3.58 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -175.166 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 32.3 p -67.12 -27.54 67.41 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -175.917 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . 0.479 ' HB2' ' O ' ' X' ' 32' ' ' LEU . 1.9 tttm -97.45 37.55 1.35 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.171 179.951 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 43.1 45.83 4.75 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.483 0.713 . . . . 0.0 112.119 -176.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.506 ' CD2' ' HB3' ' X' ' 9' ' ' ARG . 24.4 m-85 56.84 68.28 0.88 Allowed 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.987 178.924 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -106.92 122.53 46.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.1 -178.651 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.656 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -89.85 -8.14 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.95 173.614 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.38 -43.0 97.73 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.214 177.666 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -94.45 -22.28 18.38 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.473 -0.364 . . . . 0.0 111.212 177.776 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.656 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -68.0 -38.83 83.1 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.792 178.741 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.779 HD12 HD11 ' X' ' 47' ' ' ILE . 6.9 mp -62.83 -33.26 74.86 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.654 -179.076 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . 0.474 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 18.9 t70 -53.15 -45.44 68.43 Favored 'General case' 0 C--N 1.33 -0.245 0 O-C-N 123.333 0.396 . . . . 0.0 111.468 178.272 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 3.2 p -96.45 -5.23 40.11 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 -176.124 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.779 HD11 HD12 ' X' ' 44' ' ' LEU . 23.6 pt -96.75 42.28 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 O-C-N 121.572 -0.705 . . . . 0.0 111.322 173.547 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 80.94 30.82 0.16 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.034 0.933 . . . . 0.0 112.634 174.453 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . 0.527 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 33.3 m-85 . . . . . 0 C--N 1.327 -0.402 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 170.49 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.452 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . 0.654 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 54.5 t0 -80.19 133.44 57.31 Favored Pre-proline 0 CA--C 1.506 -0.732 0 CA-C-N 113.693 -1.594 . . . . 0.0 107.521 177.916 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . 0.654 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 80.6 Cg_exo -40.56 -26.14 0.21 Allowed 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.908 2.405 . . . . 0.0 112.818 179.814 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 77.9 mtm180 -72.48 -53.03 13.26 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.41 175.263 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . 0.498 ' HA ' ' HB3' ' X' ' 13' ' ' SER . 4.5 mp -95.72 -23.77 16.83 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -174.318 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.573 ' HA ' ' HB2' ' X' ' 15' ' ' SER . 0.0 OUTLIER -62.73 -28.01 44.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.76 0.79 . . . . 0.0 109.016 177.086 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' X' ' 16' ' ' GLN . 81.9 mt-10 -93.9 -22.09 18.83 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.576 174.937 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . 0.498 ' HB3' ' HA ' ' X' ' 10' ' ' LEU . 29.7 t -98.56 -61.03 1.43 Allowed 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -175.824 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.506 ' HG ' HD11 ' X' ' 29' ' ' LEU . 8.3 tt -92.58 -40.26 10.88 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-O 121.074 0.464 . . . . 0.0 109.749 -174.09 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.573 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 23.2 m -66.5 -26.91 67.39 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.009 -176.031 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' X' ' 12' ' ' GLU . 5.3 pp0? -69.3 -30.22 68.25 Favored 'General case' 0 C--O 1.228 -0.067 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.046 -179.425 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.948 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 18.9 ptm -96.39 -32.95 12.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.25 -179.517 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 61.1 tp -55.13 -43.65 74.33 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 123.427 0.454 . . . . 0.0 111.592 -178.215 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 16.3 p -98.93 9.74 42.86 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -177.157 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 35.0 ttp -111.22 -12.85 14.07 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.63 -176.413 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 115.19 19.82 5.77 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.336 -0.935 . . . . 0.0 112.398 179.604 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.948 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 28.0 m-85 -116.63 163.11 16.6 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 107.734 -1.209 . . . . 0.0 107.734 170.892 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 47.5 m -154.65 -138.01 0.07 Allowed 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 120.201 -0.599 . . . . 0.0 109.919 179.96 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.773 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 25.0 p-10 -110.75 116.29 31.03 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.238 0.542 . . . . 0.0 110.907 176.298 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . 0.738 ' HG3' ' HA ' ' X' ' 47' ' ' ILE . 1.9 mm-40 -83.76 54.18 2.8 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.218 0.532 . . . . 0.0 110.9 177.631 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 136.08 2.65 2.67 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.561 -179.188 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . 0.459 ' HA2' ' OD2' ' X' ' 24' ' ' ASP . . . 87.86 13.6 64.35 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.645 179.39 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.77 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 42.4 p-90 -85.49 -13.24 49.72 Favored 'General case' 0 C--O 1.217 -0.657 0 O-C-N 122.629 -0.336 . . . . 0.0 111.046 179.64 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.773 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 54.5 tp -56.06 -24.26 38.63 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.366 -175.723 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 53.2 p -93.86 -21.81 19.02 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.793 -0.185 . . . . 0.0 111.43 176.339 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . 0.618 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 0.2 OUTLIER -95.02 -56.36 2.77 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 120.568 0.223 . . . . 0.0 111.528 -177.339 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -44.97 -68.85 0.16 Allowed 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 124.046 0.938 . . . . 0.0 112.063 -174.507 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.795 ' HB2' ' HA ' ' X' ' 38' ' ' TYR . 0.9 OUTLIER -67.59 -25.61 65.85 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.873 -0.331 . . . . 0.0 111.785 -176.153 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . 0.459 ' N ' HD12 ' X' ' 33' ' ' LEU . 0.8 OUTLIER -63.7 -31.43 72.6 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 122.21 -0.307 . . . . 0.0 111.685 179.481 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . 0.43 HG22 ' O ' ' X' ' 31' ' ' ARG . 4.9 t -99.26 -10.77 21.97 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 122.229 -0.294 . . . . 0.0 111.701 -179.214 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -114.39 39.92 2.66 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -174.868 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 16.3 p30 50.29 34.84 9.45 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.666 0.786 . . . . 0.0 112.025 -178.129 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.795 ' HA ' ' HB2' ' X' ' 33' ' ' LEU . 68.8 m-85 64.69 69.39 0.5 Allowed 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.786 178.512 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -93.26 107.21 19.07 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 113.972 -1.467 . . . . 0.0 111.176 -172.698 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.635 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.5 OUTLIER -92.24 -4.07 10.75 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.432 172.671 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -74.64 -34.23 54.15 Favored Glycine 0 N--CA 1.441 -1.014 0 C-N-CA 120.003 -1.094 . . . . 0.0 111.027 175.391 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.73 -25.0 15.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.778 -0.711 . . . . 0.0 110.979 177.327 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.689 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -64.52 -42.72 95.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.234 179.859 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.631 HD13 ' O ' ' X' ' 40' ' ' ILE . 10.9 mp -67.03 -27.68 67.6 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.909 179.614 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -66.82 -58.01 5.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.193 174.798 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 21.2 p -61.9 -20.15 63.45 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 -174.064 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.77 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 1.8 pt -89.62 -30.05 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 C-N-CA 119.395 -0.922 . . . . 0.0 112.635 179.438 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . 0.631 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.5 mt-30 -163.28 -43.65 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 117.671 0.214 . . . . 0.0 111.542 -177.924 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 . . . . . 0 N--CA 1.464 0.253 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -172.737 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . 0.417 ' HA ' ' HB ' ' X' ' 11' ' ' ILE . . . . . . . . 0 CA--C 1.515 -0.377 0 CA-C-O 121.251 0.548 . . . . 0.0 110.038 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . 0.751 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 37.3 t0 -71.37 136.54 83.96 Favored Pre-proline 0 C--N 1.318 -0.77 0 N-CA-C 106.948 -1.501 . . . . 0.0 106.948 174.88 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . 0.751 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 78.5 Cg_exo -38.78 -28.48 0.14 Allowed 'Trans proline' 0 CA--C 1.534 0.507 0 C-N-CA 123.507 2.805 . . . . 0.0 113.186 -177.81 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 28.9 mmm180 -90.44 -50.55 5.89 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.958 176.15 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . 0.712 HD22 ' HB2' ' X' ' 14' ' ' LEU . 96.0 mt -79.09 -15.22 58.48 Favored 'General case' 0 C--O 1.221 -0.446 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -173.284 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.552 ' O ' ' HB3' ' X' ' 15' ' ' SER . 11.8 tt -69.59 -25.92 29.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 174.033 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . 0.555 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 48.4 mt-10 -95.9 -45.91 6.76 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.531 174.307 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . 0.467 ' HA ' HG23 ' X' ' 40' ' ' ILE . 20.4 m -89.67 -34.14 16.37 Favored 'General case' 0 C--O 1.222 -0.373 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -168.757 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.766 ' HG ' HD11 ' X' ' 29' ' ' LEU . 8.7 tt -95.94 -41.78 8.62 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.745 0.783 . . . . 0.0 109.017 -179.676 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.552 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 9.4 t -71.24 -16.08 62.47 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 114.73 -1.123 . . . . 0.0 111.243 -176.935 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . 0.555 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 3.8 tm0? -57.58 -58.77 6.84 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-O 120.786 0.327 . . . . 0.0 110.224 177.028 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 1.013 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 0.9 OUTLIER -82.91 -22.09 33.99 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.089 -179.298 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . 0.482 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 29.4 tp -66.41 -34.79 78.75 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.773 0.32 . . . . 0.0 110.775 -179.376 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 10.7 m -98.63 -36.16 9.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.546 -176.811 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 26.6 ttt -68.33 -31.81 71.48 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -176.209 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.79 46.58 0.6 Allowed Glycine 0 CA--C 1.508 -0.38 0 C-N-CA 119.938 -1.125 . . . . 0.0 113.196 178.617 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 1.013 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 8.9 m-30 -111.97 -174.48 2.47 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 170.758 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 49.9 m -144.66 -161.28 1.26 Allowed 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 119.7 -0.8 . . . . 0.0 111.401 -179.109 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.561 ' HA ' ' CD1' ' X' ' 28' ' ' TRP . 10.5 t0 -115.28 121.23 42.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.422 -177.946 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . 0.553 ' OE2' ' HB ' ' X' ' 46' ' ' THR . 4.5 pt-20 -61.61 -25.02 67.08 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -178.214 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 148.63 30.91 0.06 OUTLIER Glycine 0 CA--C 1.519 0.311 0 C-N-CA 120.351 -0.928 . . . . 0.0 113.665 178.948 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . 0.564 ' O ' ' HB3' ' X' ' 31' ' ' ARG . . . 126.21 33.91 0.65 Allowed Glycine 0 N--CA 1.446 -0.7 0 C-N-CA 121.026 -0.606 . . . . 0.0 111.674 178.742 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.604 ' HE3' ' HB3' ' X' ' 32' ' ' LEU . 8.5 p-90 -97.67 -39.97 8.82 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-O 120.666 0.269 . . . . 0.0 110.98 -178.263 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.766 HD11 ' HG ' ' X' ' 14' ' ' LEU . 46.1 tp -69.83 -19.15 63.47 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 121.767 -0.583 . . . . 0.0 110.986 -166.45 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 1.7 t -95.0 -31.01 13.82 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.992 170.796 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . 0.564 ' HB3' ' O ' ' X' ' 27' ' ' GLY . 40.8 ttt180 -96.36 -62.26 1.3 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -173.191 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . 0.604 ' HB3' ' HE3' ' X' ' 28' ' ' TRP . 2.8 tm? -50.62 -63.25 1.18 Allowed 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.441 0.696 . . . . 0.0 111.563 -176.472 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 31.4 mt -45.77 -58.86 3.15 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.574 0.546 . . . . 0.0 111.739 -177.439 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -46.71 -58.78 3.53 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 123.83 0.707 . . . . 0.0 112.542 -178.947 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 60.9 p -62.5 -28.57 69.93 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.547 -176.889 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . 0.514 ' HB3' ' HB2' ' X' ' 39' ' ' ASP . 5.4 mptp? -94.63 39.3 1.1 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.548 176.606 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 31.82 53.12 0.24 Allowed 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.862 1.265 . . . . 0.0 113.744 -174.358 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 60.0 56.11 3.53 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.276 178.142 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . 0.514 ' HB2' ' HB3' ' X' ' 36' ' ' LYS . 24.5 m-20 -107.14 128.01 54.02 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.277 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.634 HD13 ' H ' ' X' ' 40' ' ' ILE . 0.1 OUTLIER -84.36 -3.13 7.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.732 169.239 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -69.67 -36.44 75.62 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.289 179.248 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.11 -12.49 20.45 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.951 0.405 . . . . 0.0 110.214 175.088 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.605 ' CB ' ' HA ' ' X' ' 40' ' ' ILE . . . -57.2 -53.22 60.52 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.821 -179.666 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.505 ' HG ' ' HE2' ' X' ' 22' ' ' PHE . 10.2 mp -61.35 -38.77 88.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.619 -179.258 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -52.16 -46.05 65.3 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.252 -179.654 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . 0.553 ' HB ' ' OE2' ' X' ' 25' ' ' GLU . 36.7 p -78.12 -35.11 49.53 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -171.44 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.544 HG12 ' O ' ' X' ' 43' ' ' ALA . 6.7 pt -96.25 -25.19 4.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 -168.999 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . 0.421 HE21 ' HB2' ' X' ' 48' ' ' GLN . 0.0 OUTLIER -153.64 -26.68 0.14 Allowed 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -178.207 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 . . . . . 0 C--N 1.324 -0.523 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -178.284 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.468 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . 0.454 ' O ' HG22 ' X' ' 11' ' ' ILE . 80.9 m-20 -70.38 155.49 93.35 Favored Pre-proline 0 CA--C 1.507 -0.703 0 CA-C-N 114.605 -1.18 . . . . 0.0 109.179 179.564 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -53.0 -18.37 9.45 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 122.134 1.889 . . . . 0.0 111.438 172.086 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 15.1 mmm180 -93.71 -35.82 12.61 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.353 179.744 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . 0.684 HD22 ' HG ' ' X' ' 14' ' ' LEU . 63.9 mt -98.26 -25.33 14.9 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.792 -171.671 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.529 ' HA ' ' HB2' ' X' ' 15' ' ' SER . 10.6 tt -70.48 -14.53 18.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 171.032 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -96.58 -52.29 4.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.673 -1.148 . . . . 0.0 111.2 175.341 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 7.7 t -94.46 -32.71 13.4 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -168.963 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.684 ' HG ' HD22 ' X' ' 10' ' ' LEU . 32.3 mt -92.51 -39.16 11.54 Favored 'General case' 0 CA--C 1.506 -0.721 0 O-C-N 121.556 -0.715 . . . . 0.0 109.63 178.481 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.529 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 8.2 t -63.3 -22.31 66.8 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.519 -175.905 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . 0.482 HE21 ' HG3' ' X' ' 17' ' ' MET . 3.7 pp0? -72.73 -29.17 63.13 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 120.411 -0.516 . . . . 0.0 109.997 176.919 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.482 ' HG3' HE21 ' X' ' 16' ' ' GLN . 26.2 mtt -72.21 -40.13 68.06 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.325 171.886 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 11.1 mp -68.43 -14.13 62.79 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.453 178.911 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 2.8 t -98.92 -40.98 7.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.934 -178.389 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 83.8 mtp -83.92 -32.4 25.13 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -176.986 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.32 46.91 0.67 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.384 -0.912 . . . . 0.0 112.396 -179.548 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -117.14 160.94 20.23 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 174.134 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 13.8 m -140.9 -136.71 0.11 Allowed 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 120.196 -0.602 . . . . 0.0 110.145 -179.659 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.551 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 7.9 p-10 -121.77 122.3 39.2 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.164 173.001 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . 0.784 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 40.1 tt0 -67.68 -48.02 67.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.36 0.6 . . . . 0.0 110.377 -179.325 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -129.02 19.88 5.43 Favored Glycine 0 C--N 1.32 -0.326 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.992 -178.838 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 87.93 4.87 78.16 Favored Glycine 0 C--O 1.228 -0.256 0 C-N-CA 120.539 -0.839 . . . . 0.0 112.688 178.462 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.786 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 36.3 p-90 -75.04 -9.16 58.28 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -178.985 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.551 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 59.0 tp -53.85 -23.56 12.85 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 -171.316 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . 0.638 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 43.9 p -84.59 -63.82 1.27 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.646 170.79 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . 0.568 ' CG ' ' HA ' ' X' ' 28' ' ' TRP . 12.1 ptm180 -57.07 -45.72 83.05 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -175.434 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -53.23 -64.4 0.83 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.782 0.325 . . . . 0.0 110.653 -178.347 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.545 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.7 mp -65.76 -43.69 88.11 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.891 -175.671 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . 0.638 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.0 OUTLIER -54.81 -38.92 67.94 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -178.293 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 19.3 m -85.05 -12.31 53.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.304 0.574 . . . . 0.0 110.892 -178.681 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -112.37 37.9 2.89 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.354 179.768 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 43.37 40.62 2.72 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.648 0.779 . . . . 0.0 112.733 -178.345 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.545 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 64.4 m-85 64.04 67.89 0.59 Allowed 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.688 177.771 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -105.67 120.1 40.81 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.13 -176.443 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.708 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -91.26 -9.54 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 CA-C-O 121.033 0.444 . . . . 0.0 110.198 170.771 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.23 -34.65 81.14 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.394 -0.907 . . . . 0.0 111.517 176.978 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.27 -14.86 19.07 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.947 -0.626 . . . . 0.0 110.987 176.062 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.708 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -75.84 -33.57 60.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.242 -179.16 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.631 ' HA ' HD11 ' X' ' 47' ' ' ILE . 10.9 mp -72.89 -23.56 60.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.946 0.403 . . . . 0.0 110.053 177.359 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -68.62 -29.07 67.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.009 174.981 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 13.3 p -96.84 -14.96 21.51 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 -172.669 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.786 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 1.2 pp -97.84 -28.77 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 119.715 1.143 . . . . 0.0 113.104 -179.41 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . 0.489 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 2.0 mp0 -161.19 -59.35 0.05 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.014 0.435 . . . . 0.0 110.573 179.853 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.919 -175.668 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.215 0 CA-C-O 121.63 0.729 . . . . 0.0 109.929 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -91.44 147.29 35.05 Favored Pre-proline 0 C--N 1.317 -0.812 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 179.211 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . 0.621 ' HA ' HG22 ' X' ' 11' ' ' ILE . 79.0 Cg_exo -42.07 -23.77 0.27 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.115 2.543 . . . . 0.0 113.169 179.824 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . 0.436 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 63.5 mtp180 -64.53 -55.59 19.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.946 173.792 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . 0.451 ' HA ' ' OG ' ' X' ' 13' ' ' SER . 5.1 mp -99.41 -26.26 14.19 Favored 'General case' 0 C--O 1.22 -0.465 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -176.739 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.621 HG22 ' HA ' ' X' ' 8' ' ' PRO . 11.6 tt -64.64 -21.23 28.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.337 0.589 . . . . 0.0 109.467 178.751 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -93.63 -33.82 13.54 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.041 175.683 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . 0.636 ' HA ' HG23 ' X' ' 40' ' ' ILE . 56.6 p -96.54 -48.62 5.47 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -173.402 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.442 ' HG ' HD11 ' X' ' 29' ' ' LEU . 8.2 tt -93.49 -42.18 9.38 Favored 'General case' 0 CA--C 1.507 -0.706 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -175.798 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.532 ' CB ' ' HA ' ' X' ' 11' ' ' ILE . 7.3 t -69.78 -22.69 63.32 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.754 -178.497 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 4.5 tm0? -56.33 -59.95 4.22 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.21 0.529 . . . . 0.0 109.993 173.694 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.758 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 11.8 ptm -77.09 -22.52 52.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.457 -176.303 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 20.8 tp -68.4 -39.42 81.68 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.912 0.387 . . . . 0.0 110.382 176.715 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 15.7 t -83.69 -31.35 26.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.186 -179.603 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 37.9 tpp -69.26 -29.23 67.09 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.886 0.374 . . . . 0.0 111.249 -177.259 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.21 38.48 1.23 Allowed Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.339 -0.934 . . . . 0.0 112.15 -178.858 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.758 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 14.2 m-30 -117.4 -173.61 2.45 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 176.595 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 60.2 m -159.28 -135.28 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 176.63 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.611 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.2 p30 -121.67 133.75 54.97 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.854 0.359 . . . . 0.0 110.036 171.804 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . 0.496 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 21.7 tt0 -87.37 48.47 1.65 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.043 0.449 . . . . 0.0 110.038 178.233 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 148.97 -8.21 0.93 Allowed Glycine 0 CA--C 1.518 0.278 0 C-N-CA 120.281 -0.961 . . . . 0.0 113.646 179.849 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 101.05 15.54 28.08 Favored Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.008 -179.126 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.718 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 43.2 p-90 -91.67 -5.11 54.35 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -176.438 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.611 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 28.4 tp -56.83 -34.14 67.46 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.543 -172.293 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 70.5 p -89.32 -10.54 46.38 Favored 'General case' 0 C--N 1.321 -0.637 0 O-C-N 122.164 -0.335 . . . . 0.0 111.293 176.491 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . 0.49 ' HG2' ' HA ' ' X' ' 28' ' ' TRP . 22.6 mmm-85 -94.89 -53.04 3.99 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.021 0.439 . . . . 0.0 111.241 -177.545 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.71 -67.21 0.29 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.656 -177.727 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.557 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.8 mp -54.88 -52.45 62.8 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.531 -177.299 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -41.78 -60.0 1.5 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -177.743 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 2.9 m -66.59 -31.3 71.92 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.242 -176.622 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . 0.595 ' HE3' ' OD2' ' X' ' 39' ' ' ASP . 24.4 mtpp -96.56 39.38 1.16 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.968 -176.433 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 45.96 39.95 6.24 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.209 1.003 . . . . 0.0 113.086 179.859 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.557 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 43.5 m-85 59.89 74.12 0.46 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.599 175.69 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . 0.595 ' OD2' ' HE3' ' X' ' 36' ' ' LYS . 41.4 p-10 -112.45 138.91 48.52 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.756 0.789 . . . . 0.0 112.437 178.763 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.636 HG23 ' HA ' ' X' ' 13' ' ' SER . 0.0 OUTLIER -90.46 -13.42 9.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.084 175.025 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.5 -50.91 61.63 Favored Glycine 0 N--CA 1.444 -0.813 0 CA-C-N 115.517 -0.765 . . . . 0.0 112.511 -176.774 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -88.5 -16.97 31.32 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.216 -0.492 . . . . 0.0 111.137 178.054 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.502 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -67.66 -46.24 72.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.388 -179.781 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.556 HD13 ' OH ' ' X' ' 49' ' ' TYR . 37.5 mt -72.11 -25.54 61.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.985 0.421 . . . . 0.0 110.524 -179.189 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . 0.655 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 9.6 t70 -61.64 -36.86 82.0 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.729 178.507 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 10.7 p -96.03 -3.71 44.38 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 -172.486 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.718 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 1.5 pp -99.78 -27.36 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 C-N-CA 118.379 -1.328 . . . . 0.0 112.614 -177.942 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . 0.446 ' N ' HD12 ' X' ' 47' ' ' ILE . 2.5 mp0 -158.74 -58.32 0.07 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.753 0.311 . . . . 0.0 110.801 178.701 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . 0.655 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 1.3 p90 . . . . . 0 C--N 1.326 -0.453 0 CA-C-O 121.055 0.455 . . . . 0.0 112.226 -175.303 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.516 -0.338 0 N-CA-C 108.671 -0.862 . . . . 0.0 108.671 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . 0.589 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 39.2 t70 -107.22 149.72 39.04 Favored Pre-proline 0 C--N 1.315 -0.906 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 -177.88 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . 0.589 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 72.2 Cg_exo -47.4 -22.24 2.51 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 122.167 1.911 . . . . 0.0 112.5 179.58 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . 0.734 ' HB3' ' HB2' ' X' ' 38' ' ' TYR . 66.1 mtt85 -87.1 -28.82 22.3 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.272 178.185 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . 0.554 HD22 ' HB2' ' X' ' 14' ' ' LEU . 95.7 mt -97.78 -27.58 14.25 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 122.218 -0.301 . . . . 0.0 110.696 -175.569 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.468 ' O ' ' HB3' ' X' ' 15' ' ' SER . 61.1 mt -61.88 -25.37 37.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 174.518 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . 0.467 ' HG2' ' O ' ' X' ' 8' ' ' PRO . 6.3 pt-20 -96.39 -58.75 1.99 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.828 171.494 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . 0.601 ' HB3' HG23 ' X' ' 40' ' ' ILE . 30.8 m -81.18 -26.73 35.78 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -168.275 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.554 ' HB2' HD22 ' X' ' 10' ' ' LEU . 30.6 tp -93.13 -40.29 10.57 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.169 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.468 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 24.4 t -65.16 -26.33 68.12 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.825 -177.762 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 4.6 pp0? -74.35 -26.96 60.45 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.461 -179.211 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.799 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 20.8 ptm -93.73 -28.1 16.13 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.614 177.878 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 4.2 mp -66.89 -35.63 80.45 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.176 179.374 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 22.4 p -87.49 -27.62 22.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.62 -0.263 . . . . 0.0 111.648 -179.263 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 46.9 tpp -80.84 -32.57 35.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.578 -176.163 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 106.35 47.83 1.03 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.047 -1.073 . . . . 0.0 112.178 -179.4 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.799 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 20.3 m-30 -108.92 168.28 9.47 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 108.083 -1.081 . . . . 0.0 108.083 176.454 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . 0.614 ' H ' HE22 ' X' ' 48' ' ' GLN . 20.3 m -146.33 -179.33 6.67 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 119.895 -0.722 . . . . 0.0 110.832 179.45 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -77.95 132.3 37.81 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 172.125 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . 0.92 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 50.2 tt0 -76.76 -16.12 59.57 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.331 -0.548 . . . . 0.0 110.035 179.916 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -159.77 -80.11 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 111.505 -0.638 . . . . 0.0 111.505 176.637 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -162.12 32.63 0.33 Allowed Glycine 0 CA--C 1.508 -0.379 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 175.516 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.92 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 56.9 p-90 -98.37 -16.23 19.39 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -175.325 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.574 ' HA ' ' CE3' ' X' ' 28' ' ' TRP . 60.0 tp -51.16 -48.67 61.83 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -164.762 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . 0.544 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 40.8 p -75.86 -10.85 59.77 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.823 -0.548 . . . . 0.0 111.536 178.421 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 30.9 ttt180 -94.6 -54.87 3.34 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.37 0.268 . . . . 0.0 111.677 -179.688 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -52.47 -49.9 63.76 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.385 0.674 . . . . 0.0 110.4 179.671 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.92 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 73.1 mt -62.59 -53.68 50.99 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.564 179.25 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . 0.544 ' HB2' ' O ' ' X' ' 30' ' ' THR . 2.4 tp-100 -39.29 -56.81 1.47 Allowed 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.99 1.107 . . . . 0.0 113.99 -174.958 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 34.7 p -65.81 -17.12 64.41 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -174.859 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . 0.432 ' O ' ' HB3' ' X' ' 37' ' ' ASN . 50.9 mttm -114.33 30.32 7.38 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -176.568 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . 0.432 ' HB3' ' O ' ' X' ' 36' ' ' LYS . 32.2 t30 65.71 28.12 11.13 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.463 0.649 . . . . 0.0 110.311 179.438 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.92 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 50.1 m-85 60.8 68.25 0.76 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.525 -173.205 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -103.35 133.01 49.13 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.565 -174.362 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.854 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.1 OUTLIER -90.21 -3.99 10.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.136 175.805 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.41 -41.18 99.78 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 120.32 -0.943 . . . . 0.0 111.815 179.201 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -100.47 -14.88 18.09 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.949 -0.626 . . . . 0.0 111.015 175.391 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.854 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -72.26 -41.03 67.21 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.591 178.569 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.892 HD12 HD11 ' X' ' 47' ' ' ILE . 6.4 mp -56.06 -32.11 63.79 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 123.537 0.523 . . . . 0.0 111.202 179.794 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -51.76 -48.35 63.76 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.093 176.206 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 16.9 p -96.08 -20.15 18.88 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -175.453 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.892 HD11 HD12 ' X' ' 44' ' ' LEU . 7.2 pt -83.78 43.67 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 O-C-N 121.607 -0.683 . . . . 0.0 112.025 177.729 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . 0.614 HE22 ' H ' ' X' ' 23' ' ' SER . 2.4 mp0 82.14 34.07 0.08 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.347 1.059 . . . . 0.0 112.874 173.158 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 . . . . . 0 C--N 1.327 -0.373 0 CA-C-O 121.227 0.537 . . . . 0.0 110.768 173.307 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.289 0 CA-C-O 121.418 0.628 . . . . 0.0 109.731 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . 0.532 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 35.8 t70 -77.31 148.11 77.09 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 114.932 -1.031 . . . . 0.0 108.284 177.975 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . 0.532 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 86.4 Cg_exo -41.54 -34.97 2.26 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.645 2.23 . . . . 0.0 112.33 179.312 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 31.1 mmt-85 -77.97 -56.17 4.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.587 174.83 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . 0.484 HD22 ' HB2' ' X' ' 14' ' ' LEU . 77.4 mt -73.0 -29.78 63.28 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-N 115.348 -0.842 . . . . 0.0 112.604 -169.034 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.503 ' O ' ' HB2' ' X' ' 15' ' ' SER . 12.1 tt -64.25 -20.82 27.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.656 0.741 . . . . 0.0 109.613 175.476 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . 0.457 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 40.1 tt0 -96.26 -58.48 2.06 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.388 175.246 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 16.4 t -91.93 -23.19 19.68 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -168.56 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.717 HD11 ' HG ' ' X' ' 29' ' ' LEU . 16.1 tp -92.18 -45.72 8.11 Favored 'General case' 0 CA--C 1.504 -0.802 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 177.145 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.579 ' HA ' ' HB2' ' X' ' 18' ' ' LEU . 48.8 m -64.97 -18.38 65.22 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.158 178.017 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . 0.659 HE21 ' HG2' ' X' ' 17' ' ' MET . 0.0 OUTLIER -57.44 -42.07 81.7 Favored 'General case' 0 CA--C 1.521 -0.151 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 173.276 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.659 ' HG2' HE21 ' X' ' 16' ' ' GLN . 1.9 mtp -86.98 -35.7 18.69 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.722 -176.957 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . 0.579 ' HB2' ' HA ' ' X' ' 15' ' ' SER . 3.8 mm? -62.38 -44.98 95.19 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.667 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 50.6 p -86.92 -24.55 24.78 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 -175.023 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 51.0 ttm -78.77 -32.26 46.47 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.755 0.312 . . . . 0.0 110.88 -177.674 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 112.75 47.45 0.67 Allowed Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.215 -0.993 . . . . 0.0 112.081 -179.506 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.512 ' HB2' ' HB3' ' X' ' 17' ' ' MET . 12.6 m-30 -114.7 163.83 14.9 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 176.341 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . 0.473 ' O ' HG22 ' X' ' 47' ' ' ILE . 72.0 m -150.1 150.46 31.72 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.499 -179.855 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.669 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 0.6 OUTLIER -71.07 129.05 37.97 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.389 0.614 . . . . 0.0 111.688 178.869 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . 0.809 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 30.8 tt0 -56.76 -30.04 63.2 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.71 178.581 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -146.3 -19.22 0.13 Allowed Glycine 0 CA--C 1.521 0.448 0 C-N-CA 120.351 -0.928 . . . . 0.0 114.113 -178.389 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . 0.402 ' H ' ' HB2' ' X' ' 24' ' ' ASP . . . 126.72 27.15 1.07 Allowed Glycine 0 C--O 1.228 -0.234 0 C-N-CA 120.409 -0.901 . . . . 0.0 112.224 -177.781 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.809 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 38.8 p-90 -96.36 -4.62 41.63 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 123.127 0.571 . . . . 0.0 111.57 -178.472 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.717 ' HG ' HD11 ' X' ' 14' ' ' LEU . 63.5 tp -47.87 -32.65 6.47 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -167.885 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 60.8 p -90.36 -40.13 12.28 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 121.917 -0.489 . . . . 0.0 111.432 175.365 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . 0.674 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -72.98 -37.27 67.1 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -173.628 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -61.99 -55.51 28.61 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.132 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.579 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 10.5 mp -56.6 -50.39 72.1 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.643 178.125 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -48.55 -44.43 36.48 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -179.696 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 8.6 m -72.67 -37.44 67.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.921 0.391 . . . . 0.0 110.845 179.707 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . 0.467 ' O ' ' HB2' ' X' ' 39' ' ' ASP . 5.1 mptp? -90.98 37.3 0.92 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.492 179.509 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 41.91 53.88 4.06 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.669 0.788 . . . . 0.0 112.667 -178.187 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.579 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 34.6 m-85 54.72 62.91 2.33 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.374 178.009 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . 0.467 ' HB2' ' O ' ' X' ' 36' ' ' LYS . 32.4 t0 -118.05 134.27 55.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.917 -176.053 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.777 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.1 OUTLIER -89.72 -7.53 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.271 170.601 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.4 -35.02 90.38 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.306 -179.731 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -100.03 -22.16 15.34 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.527 -0.336 . . . . 0.0 110.606 175.285 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.777 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -68.25 -37.66 81.01 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.328 -179.924 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.727 HD13 ' HB ' ' X' ' 40' ' ' ILE . 9.2 mp -68.75 -17.84 64.11 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.735 0.302 . . . . 0.0 111.173 179.162 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -83.92 -29.99 26.69 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.96 0.41 . . . . 0.0 110.463 176.667 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 15.2 p -96.01 -21.69 17.84 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -172.29 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.76 HG23 ' HH2' ' X' ' 28' ' ' TRP . 1.1 pp -67.16 -26.12 35.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 119.525 -0.87 . . . . 0.0 111.476 -173.955 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . 0.616 ' HB3' ' O ' ' X' ' 47' ' ' ILE . 0.1 OUTLIER 153.95 -5.66 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.682 1.193 . . . . 0.0 110.374 169.739 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . 0.54 ' H ' HD12 ' X' ' 47' ' ' ILE . 11.3 m-30 . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.305 174.081 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.444 0 CA-C-O 121.374 0.607 . . . . 0.0 109.568 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . 0.527 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 38.7 t70 -81.36 143.56 52.1 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 179.085 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . 0.527 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 82.9 Cg_exo -42.53 -30.92 1.73 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.662 2.242 . . . . 0.0 112.562 179.295 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . 0.49 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 39.3 mmt180 -87.76 -52.07 5.51 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.021 177.324 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . 0.415 ' HA ' ' HB2' ' X' ' 13' ' ' SER . 91.8 mt -81.54 -14.08 57.31 Favored 'General case' 0 C--O 1.216 -0.697 0 CA-C-N 116.0 -0.546 . . . . 0.0 112.446 -171.404 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.502 ' HA ' ' CB ' ' X' ' 15' ' ' SER . 13.9 tt -66.05 -24.76 34.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.4 0.619 . . . . 0.0 109.604 175.873 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -94.47 -28.86 15.24 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.963 174.528 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . 0.415 ' HB2' ' HA ' ' X' ' 10' ' ' LEU . 16.3 m -96.21 -54.33 3.33 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -171.132 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.421 ' HG ' ' HG ' ' X' ' 29' ' ' LEU . 9.9 tt -94.81 -46.74 6.76 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 -176.429 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.502 ' CB ' ' HA ' ' X' ' 11' ' ' ILE . 14.4 m -63.2 -25.53 68.38 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.178 -177.991 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' X' ' 20' ' ' MET . 2.5 tm0? -61.37 -47.68 84.74 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.029 0.442 . . . . 0.0 109.901 174.703 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.603 ' SD ' HD13 ' X' ' 47' ' ' ILE . 42.1 mtt -77.74 -39.8 43.13 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.046 -177.473 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 35.6 tp -64.47 -37.77 88.69 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.235 -177.723 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 3.7 t -85.7 -22.23 27.93 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.628 0.251 . . . . 0.0 110.932 -178.633 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . 0.401 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 15.4 tpt -78.01 -32.42 51.1 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.925 0.393 . . . . 0.0 110.887 -178.733 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.6 34.53 1.55 Allowed Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.836 -177.89 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.495 ' HB2' ' HB3' ' X' ' 17' ' ' MET . 14.8 m-30 -110.33 -177.31 3.21 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 174.284 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -151.13 -178.33 6.56 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.113 178.54 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -94.35 144.16 25.78 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 173.973 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . 0.507 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 29.4 tt0 -107.5 57.3 0.63 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.151 0.5 . . . . 0.0 110.189 179.65 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.38 -29.31 2.29 Favored Glycine 0 CA--C 1.517 0.191 0 C-N-CA 120.65 -0.786 . . . . 0.0 113.076 179.407 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 120.03 16.16 4.95 Favored Glycine 0 CA--C 1.506 -0.528 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 -177.931 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.906 ' HH2' HG23 ' X' ' 47' ' ' ILE . 60.9 p-90 -84.97 -11.85 54.59 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.132 -0.534 . . . . 0.0 111.347 -177.91 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.421 ' HG ' ' HG ' ' X' ' 14' ' ' LEU . 30.7 tp -66.17 -19.59 65.88 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.393 -0.817 . . . . 0.0 110.018 -176.914 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . 0.46 ' O ' ' HG3' ' X' ' 34' ' ' GLN . 0.1 OUTLIER -95.74 -31.54 13.16 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.921 167.814 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . 0.739 ' HB3' ' HA ' ' X' ' 28' ' ' TRP . 50.0 ttt-85 -87.27 -65.88 0.97 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 -174.256 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . 0.882 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 3.3 tm? -41.67 -59.83 1.53 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.022 0.929 . . . . 0.0 111.39 179.307 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.415 HD12 ' O ' ' X' ' 29' ' ' LEU . 65.9 mt -47.36 -68.88 0.15 Allowed 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.281 -175.754 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . 0.46 ' HG3' ' O ' ' X' ' 30' ' ' THR . 5.3 mt-30 -57.4 -27.37 62.28 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -171.531 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 15.4 m -71.96 -21.74 61.55 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.952 0.406 . . . . 0.0 111.034 179.22 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . 0.443 ' HB2' ' HB2' ' X' ' 39' ' ' ASP . 18.5 mtpp -121.28 37.38 4.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.953 -175.661 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 50.6 t30 63.72 39.03 8.9 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.377 0.608 . . . . 0.0 110.737 178.818 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.49 ' CD2' ' HB3' ' X' ' 9' ' ' ARG . 11.4 m-85 55.57 66.35 1.24 Allowed 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.425 -176.784 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . 0.443 ' HB2' ' HB2' ' X' ' 36' ' ' LYS . 17.8 t70 -88.86 124.59 34.34 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.034 -0.984 . . . . 0.0 112.177 -169.499 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.662 ' O ' HD13 ' X' ' 44' ' ' LEU . 1.5 mm -89.7 -24.32 5.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.131 175.838 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.19 -33.08 84.14 Favored Glycine 0 N--CA 1.441 -1.027 0 CA-C-N 115.264 -0.88 . . . . 0.0 112.762 -177.701 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -100.16 -21.88 15.38 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.873 0.368 . . . . 0.0 111.387 -178.632 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.617 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -70.89 -32.66 69.7 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.655 178.557 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.814 HD12 HD11 ' X' ' 47' ' ' ILE . 6.3 mp -64.65 -35.25 80.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.757 -178.99 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -52.83 -38.92 61.98 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.174 0.296 . . . . 0.0 111.683 179.779 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 2.0 p -96.07 -22.15 17.52 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -176.95 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.906 HG23 ' HH2' ' X' ' 28' ' ' TRP . 16.8 pt -83.34 42.64 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-N 118.478 0.581 . . . . 0.0 112.145 176.915 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 74.74 13.51 3.5 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.359 0.664 . . . . 0.0 112.383 173.912 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 . . . . . 0 N--CA 1.468 0.44 0 CA-C-O 120.655 0.264 . . . . 0.0 110.501 176.161 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.077 0 CA-C-O 121.152 0.501 . . . . 0.0 110.073 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . 0.45 ' O ' HG22 ' X' ' 11' ' ' ILE . 57.6 p30 -83.67 156.18 65.05 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.252 179.465 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -47.19 -14.6 0.19 Allowed 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.07 2.513 . . . . 0.0 114.244 -176.064 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 68.8 mtm180 -94.37 -42.71 8.75 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 111.987 0.365 . . . . 0.0 111.987 179.506 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . 0.409 HD22 ' HB2' ' X' ' 14' ' ' LEU . 53.1 mt -97.64 -26.08 14.89 Favored 'General case' 0 C--O 1.221 -0.446 0 O-C-N 122.213 -0.305 . . . . 0.0 111.458 -177.153 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.642 ' O ' ' HB3' ' X' ' 15' ' ' SER . 7.8 tt -70.68 -15.2 18.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 169.536 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -93.73 -59.06 2.08 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.33 174.267 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 36.7 m -82.91 -33.86 26.76 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.315 0.857 . . . . 0.0 113.315 -172.411 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.445 HD23 HD23 ' X' ' 18' ' ' LEU . 9.4 tt -93.92 -39.25 10.78 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-O 121.393 0.616 . . . . 0.0 109.444 -177.421 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.642 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 6.4 t -73.67 -21.21 60.33 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.374 -176.667 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . 0.622 HE21 ' CG ' ' X' ' 17' ' ' MET . 2.4 pp0? -69.61 -26.16 64.3 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 120.134 -0.627 . . . . 0.0 109.311 173.863 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.622 ' CG ' HE21 ' X' ' 16' ' ' GLN . 77.4 mtp -73.28 -46.35 50.36 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.649 175.642 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . 0.445 HD23 HD23 ' X' ' 14' ' ' LEU . 4.3 mm? -63.32 -41.87 98.94 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.889 179.19 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 16.1 m -70.05 -17.25 63.24 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -178.936 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 30.4 ttm -101.84 -30.23 11.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.864 0.364 . . . . 0.0 111.136 -176.41 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.48 45.74 0.65 Allowed Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.659 -0.782 . . . . 0.0 111.627 -178.785 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.422 ' HB2' ' HB3' ' X' ' 17' ' ' MET . 41.0 m-85 -133.74 166.27 23.02 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 177.771 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 70.2 m -158.72 -123.51 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -178.601 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.644 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.3 p30 -118.78 130.98 56.09 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 169.485 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . 1.089 ' HG3' ' HE1' ' X' ' 28' ' ' TRP . 3.0 pp20? -78.73 1.62 22.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.051 0.453 . . . . 0.0 110.5 -178.534 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -152.02 -73.49 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.98 172.38 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -175.34 28.25 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.479 0 N-CA-C 110.896 -0.882 . . . . 0.0 110.896 175.486 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 1.089 ' HE1' ' HG3' ' X' ' 25' ' ' GLU . 53.3 p-90 -98.31 -19.87 17.53 Favored 'General case' 0 C--O 1.212 -0.898 0 CA-C-O 118.557 -0.735 . . . . 0.0 112.227 -175.035 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.644 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 28.5 tp -40.35 -53.21 2.62 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -168.917 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . 0.425 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 60.2 p -72.78 -17.66 61.56 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -178.773 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -94.59 -48.88 5.9 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.673 -174.944 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . 0.674 ' O ' ' HD3' ' X' ' 36' ' ' LYS . 3.4 tm? -50.12 -71.99 0.06 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 123.72 0.808 . . . . 0.0 111.381 -178.166 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.719 ' HB2' ' HA ' ' X' ' 38' ' ' TYR . 0.5 OUTLIER -62.83 -25.06 68.07 Favored 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -175.292 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . 0.486 ' NE2' ' HE1' ' X' ' 38' ' ' TYR . 5.9 tp-100 -57.65 -36.21 71.56 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 -179.118 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 7.1 m -96.03 -11.48 26.37 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.927 0.394 . . . . 0.0 110.939 -178.789 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . 0.674 ' HD3' ' O ' ' X' ' 32' ' ' LEU . 4.3 mptp? -108.17 36.55 2.75 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -177.505 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 41.6 t30 59.21 37.17 23.93 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.534 0.683 . . . . 0.0 111.084 178.169 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.719 ' HA ' ' HB2' ' X' ' 33' ' ' LEU . 54.8 m-85 54.34 59.12 4.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.256 179.48 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . 0.487 ' HB2' ' O ' ' X' ' 36' ' ' LYS . 2.4 t0 -91.72 128.9 37.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.667 -1.151 . . . . 0.0 111.428 -172.415 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.472 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.12 -7.6 10.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.346 170.416 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -70.76 -42.23 62.03 Favored Glycine 0 N--CA 1.442 -0.964 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.077 -178.977 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -91.26 -22.6 20.5 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.16 -0.52 . . . . 0.0 111.216 178.444 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.491 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -69.04 -41.16 78.04 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.418 -179.387 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.472 HD13 ' O ' ' X' ' 40' ' ' ILE . 10.9 mp -75.14 -33.86 61.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.727 0.299 . . . . 0.0 110.362 178.839 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -57.32 -35.14 69.49 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.291 179.425 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 1.5 p -86.12 -44.03 12.58 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -176.206 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.653 HG23 ' CH2' ' X' ' 28' ' ' TRP . 4.5 pt -67.1 -30.35 49.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 -170.85 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -165.61 -32.07 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 111.606 0.224 . . . . 0.0 111.606 -177.488 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . 0.438 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 13.3 m-85 . . . . . 0 N--CA 1.467 0.403 0 CA-C-O 120.765 0.316 . . . . 0.0 110.834 -179.27 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.515 -0.399 0 CA-C-O 121.608 0.718 . . . . 0.0 109.453 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' X' X ' 7' ' ' ASP . . . . . 0.621 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 25.0 t70 -75.87 146.07 78.84 Favored Pre-proline 0 C--N 1.319 -0.751 0 CA-C-N 114.367 -1.288 . . . . 0.0 108.172 175.965 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' X' X ' 8' ' ' PRO . . . . . 0.621 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 80.2 Cg_exo -42.97 -25.61 0.57 Allowed 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.062 2.508 . . . . 0.0 112.982 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' X' X ' 9' ' ' ARG . . . . . 0.488 ' HB3' ' CG ' ' X' ' 38' ' ' TYR . 64.3 mmt-85 -93.41 -39.1 11.1 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.537 179.844 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' X' X ' 10' ' ' LEU . . . . . 0.571 HD22 ' HB2' ' X' ' 14' ' ' LEU . 79.3 mt -95.66 -19.55 19.63 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 122.137 -0.352 . . . . 0.0 111.631 -170.764 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' X' X ' 11' ' ' ILE . . . . . 0.52 ' O ' ' HB3' ' X' ' 15' ' ' SER . 0.0 OUTLIER -66.39 -24.62 33.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 171.635 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' X' X ' 12' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 41.4 mt-10 -95.91 -62.29 1.31 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.613 173.625 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 35.9 m -81.07 -21.25 40.18 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -169.445 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' X' X ' 14' ' ' LEU . . . . . 0.853 HD12 HD11 ' X' ' 29' ' ' LEU . 8.8 tp -92.97 -45.83 7.76 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.798 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' X' X ' 15' ' ' SER . . . . . 0.52 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 19.3 t -67.6 -26.24 66.16 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 114.004 -1.453 . . . . 0.0 111.528 -178.031 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' X' X ' 16' ' ' GLN . . . . . 0.402 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 3.9 tm0? -52.25 -52.09 54.57 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.058 0.456 . . . . 0.0 110.944 177.485 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' X' X ' 17' ' ' MET . . . . . 0.692 ' SD ' HD13 ' X' ' 29' ' ' LEU . 8.4 ptm -89.06 -26.71 21.26 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.116 -175.619 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 28.8 mt -72.08 -17.69 61.98 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 119.961 -0.696 . . . . 0.0 112.126 -179.474 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 32.4 p -94.52 -21.72 18.69 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 121.059 -0.256 . . . . 0.0 111.383 178.584 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 86.6 mtp -87.08 -31.66 20.35 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.702 0.287 . . . . 0.0 111.321 -179.13 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 108.31 35.56 2.47 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.487 -175.329 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' X' X ' 22' ' ' PHE . . . . . 0.633 ' HD2' HD12 ' X' ' 47' ' ' ILE . 15.0 m-30 -112.82 146.72 38.36 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 175.295 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 62.6 m -136.72 -177.56 4.79 Favored 'General case' 0 C--N 1.308 -1.211 0 C-N-CA 119.903 -0.719 . . . . 0.0 110.779 -174.878 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' X' X ' 24' ' ' ASP . . . . . 0.874 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 1.3 p30 -79.55 123.13 27.3 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.213 0.53 . . . . 0.0 110.117 175.251 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' X' X ' 25' ' ' GLU . . . . . 0.53 ' CB ' ' HE1' ' X' ' 28' ' ' TRP . 18.4 tp10 -68.57 -35.29 77.19 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.264 -177.089 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -139.92 20.28 2.88 Favored Glycine 0 C--N 1.32 -0.334 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.787 178.101 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' X' X ' 27' ' ' GLY . . . . . 0.574 ' O ' ' HG2' ' X' ' 31' ' ' ARG . . . 91.31 23.18 29.93 Favored Glycine 0 C--O 1.225 -0.424 0 C-N-CA 120.509 -0.853 . . . . 0.0 112.309 -179.736 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' X' X ' 28' ' ' TRP . . . . . 0.742 ' CH2' HG23 ' X' ' 47' ' ' ILE . 47.8 p-90 -89.83 -13.7 35.98 Favored 'General case' 0 C--O 1.217 -0.644 0 O-C-N 122.887 -0.184 . . . . 0.0 111.311 -178.385 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' X' X ' 29' ' ' LEU . . . . . 0.874 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 11.4 tp -63.0 -20.96 65.8 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 121.791 -0.568 . . . . 0.0 109.898 -179.259 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.5 -25.7 17.49 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.266 171.224 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' X' X ' 31' ' ' ARG . . . . . 0.574 ' HG2' ' O ' ' X' ' 27' ' ' GLY . 15.7 mmm180 -95.92 -65.47 0.97 Allowed 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -175.433 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' X' X ' 32' ' ' LEU . . . . . 0.715 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 2.8 tm? -39.12 -54.94 1.7 Allowed 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.853 1.261 . . . . 0.0 112.533 -176.197 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' X' X ' 33' ' ' LEU . . . . . 0.735 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 93.4 mt -54.63 -61.85 2.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.497 -176.796 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -38.1 -55.89 1.23 Allowed 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -175.653 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 6.4 p -76.46 -2.44 32.13 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -169.179 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -112.79 -27.31 8.19 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 119.995 -0.682 . . . . 0.0 111.971 -179.009 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 20.7 p30 136.87 15.86 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 125.931 1.693 . . . . 0.0 109.979 178.214 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' X' X ' 38' ' ' TYR . . . . . 0.735 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 26.0 m-85 72.42 56.25 0.15 Allowed 'General case' 0 C--N 1.341 0.217 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 -170.102 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -100.72 125.94 47.22 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.766 -171.265 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' X' X ' 40' ' ' ILE . . . . . 0.818 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.1 OUTLIER -89.58 -8.6 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.123 173.664 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.97 -37.27 92.42 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.355 -0.926 . . . . 0.0 111.915 177.279 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.08 -21.39 16.21 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.506 -0.347 . . . . 0.0 110.74 175.904 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' X' X ' 43' ' ' ALA . . . . . 0.818 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -67.23 -33.78 76.08 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.018 178.049 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' X' X ' 44' ' ' LEU . . . . . 0.84 HD12 HD11 ' X' ' 47' ' ' ILE . 7.1 mp -63.98 -30.42 71.5 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.153 179.429 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' X' X ' 45' ' ' ASP . . . . . 0.572 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 21.1 t70 -57.37 -39.55 76.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.19 0.519 . . . . 0.0 110.812 174.749 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 11.7 p -94.46 -5.53 46.01 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -175.626 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' X' X ' 47' ' ' ILE . . . . . 0.84 HD11 HD12 ' X' ' 44' ' ' LEU . 2.0 pt -102.63 43.91 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 O-C-N 121.999 -0.438 . . . . 0.0 111.666 173.804 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 82.0 33.45 0.09 Allowed 'General case' 0 N--CA 1.474 0.744 0 O-C-N 124.276 0.985 . . . . 0.0 112.549 173.009 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' X' X ' 49' ' ' TYR . . . . . 0.572 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 63.8 m-85 . . . . . 0 C--N 1.33 -0.263 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 173.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.851 0 N-CA-C 112.187 -0.365 . . . . 0.0 112.187 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . 0.473 ' HB2' ' OD2' ' X' ' 7' ' ' ASP . 19.3 m -95.06 158.54 34.72 Favored Pre-proline 0 C--N 1.325 -0.487 0 C-N-CA 122.151 0.18 . . . . 0.0 110.693 -178.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . 0.474 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 56.9 Cg_exo -54.11 127.08 24.25 Favored 'Trans proline' 0 C--N 1.352 0.744 0 C-N-CA 122.856 2.371 . . . . 0.0 112.457 -178.076 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . 0.474 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 7.6 Cg_exo -75.08 41.18 0.72 Allowed 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 123.25 2.633 . . . . 0.0 113.389 -176.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 22.5 pt-20 -158.12 12.59 0.19 Allowed 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 178.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -173.19 26.64 0.01 OUTLIER 'General case' 0 CA--C 1.513 -0.444 0 CA-C-O 121.186 0.517 . . . . 0.0 109.78 -177.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . 0.473 ' OD2' ' HB2' ' X' ' 2' ' ' SER . 7.9 t70 -74.85 148.84 85.19 Favored Pre-proline 0 C--N 1.319 -0.749 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 174.061 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . 0.452 ' O ' ' HB2' ' X' ' 12' ' ' GLU . 86.9 Cg_exo -46.85 -24.18 2.94 Favored 'Trans proline' 0 CA--C 1.535 0.563 0 C-N-CA 122.158 1.905 . . . . 0.0 112.555 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 27.3 mmm180 -93.38 -23.49 18.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.881 -0.6 . . . . 0.0 112.512 179.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 43.5 mt -98.37 -28.3 13.71 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.633 0.254 . . . . 0.0 110.883 -176.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.602 ' O ' ' HB3' ' X' ' 15' ' ' SER . 11.2 tp -75.82 -17.39 15.53 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 171.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . 0.452 ' HB2' ' O ' ' X' ' 8' ' ' PRO . 0.3 OUTLIER -91.12 -53.7 4.26 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.078 -0.965 . . . . 0.0 110.894 175.643 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . 0.633 ' HB3' HG23 ' X' ' 40' ' ' ILE . 4.3 m -95.31 -26.19 16.02 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -170.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.409 HD22 ' HA ' ' X' ' 14' ' ' LEU . 2.5 tm? -94.86 -41.94 8.95 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.602 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 23.2 t -67.2 -25.72 66.27 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.984 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . 0.404 ' OE1' HD11 ' X' ' 44' ' ' LEU . 4.2 tm0? -63.66 -54.88 28.84 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-O 121.174 0.511 . . . . 0.0 110.308 176.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.722 ' SD ' HD11 ' X' ' 29' ' ' LEU . 14.2 ptp -71.69 -33.62 68.96 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.459 -177.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 28.1 tp -67.61 -36.46 80.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.881 0.372 . . . . 0.0 110.81 179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 20.7 t -79.75 -38.24 33.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.243 -178.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 42.2 tpp -75.75 -31.52 59.59 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 111.617 0.228 . . . . 0.0 111.617 -175.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.88 47.27 0.62 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.145 -1.026 . . . . 0.0 112.754 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.653 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 50.4 m-85 -119.41 169.15 10.27 Favored 'General case' 0 CA--C 1.509 -0.603 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 175.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 42.0 m -151.31 -148.71 0.27 Allowed 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.113 -0.635 . . . . 0.0 110.369 -179.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.447 ' HA ' ' HB2' ' X' ' 29' ' ' LEU . 2.3 m-20 -92.46 115.81 28.43 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 174.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . 0.629 ' HG3' ' HA ' ' X' ' 47' ' ' ILE . 48.0 mm-40 -82.9 43.26 0.84 Allowed 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.715 177.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 143.05 -14.33 2.36 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.581 -178.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.58 7.38 36.92 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.834 -0.698 . . . . 0.0 111.902 -178.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.639 ' HH2' HG23 ' X' ' 47' ' ' ILE . 55.9 p-90 -86.51 -13.85 44.78 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 119.046 -0.502 . . . . 0.0 111.3 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.722 HD11 ' SD ' ' X' ' 17' ' ' MET . 36.9 tp -48.21 -51.0 27.21 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -167.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 25.5 p -65.43 -47.83 74.86 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.739 0.304 . . . . 0.0 111.019 177.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . 0.505 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 10.0 mtm180 -54.97 -52.48 62.92 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.903 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . 0.466 ' HB2' ' HE3' ' X' ' 28' ' ' TRP . 2.6 tm? -55.94 -55.25 34.9 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 123.034 0.533 . . . . 0.0 110.808 178.129 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 84.2 mt -56.91 -65.17 0.66 Allowed 'General case' 0 C--O 1.225 -0.214 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.195 -176.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -54.76 -38.7 67.54 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -172.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 42.8 p -71.88 -13.24 61.61 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -177.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -120.15 38.91 3.83 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.7 -0.227 . . . . 0.0 110.537 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 43.54 46.83 6.07 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.916 0.887 . . . . 0.0 112.029 -175.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 63.18 76.62 0.36 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.247 178.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -111.88 123.63 50.66 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.299 -174.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.723 ' HB ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.87 -8.76 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.454 174.2 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.46 -44.04 95.81 Favored Glycine 0 N--CA 1.444 -0.782 0 C-N-CA 120.53 -0.843 . . . . 0.0 112.338 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -93.47 -18.91 21.77 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.698 0.285 . . . . 0.0 110.865 178.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.603 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -71.05 -51.05 27.51 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.487 177.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.76 ' HA ' ' CG1' ' X' ' 47' ' ' ILE . 10.3 mp -62.45 -28.9 70.13 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.509 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . 0.521 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 17.0 t70 -51.59 -44.77 62.93 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.474 0.484 . . . . 0.0 111.691 178.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 2.0 p -96.48 -23.68 16.45 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -177.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.76 ' CG1' ' HA ' ' X' ' 44' ' ' LEU . 25.3 pt -81.94 45.44 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 N-CA-C 112.935 0.716 . . . . 0.0 112.935 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . 0.454 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 3.0 mt-30 88.33 15.63 0.07 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.05 0.94 . . . . 0.0 113.342 173.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . 0.521 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 32.9 m-85 -129.17 77.46 1.79 Allowed 'General case' 0 C--N 1.328 -0.365 0 O-C-N 121.985 -0.447 . . . . 0.0 110.219 171.463 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 8.0 t -76.29 20.96 0.19 Allowed 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.815 0.34 . . . . 0.0 111.632 -177.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 52.4 tttp -167.91 118.54 0.82 Allowed 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 176.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 2.8 m80 . . . . . 0 C--O 1.244 0.796 0 CA-C-O 118.468 -0.777 . . . . 0.0 111.069 -179.89 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.979 0 N-CA-C 111.967 -0.453 . . . . 0.0 111.967 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 22.6 t -81.51 130.28 62.45 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.756 0.278 . . . . 0.0 110.316 179.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -64.49 141.78 75.37 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.639 2.226 . . . . 0.0 112.283 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_exo -72.87 33.87 0.31 Allowed 'Trans proline' 0 CA--C 1.534 0.506 0 C-N-CA 123.069 2.513 . . . . 0.0 113.298 -178.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -139.27 12.19 2.58 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.624 0.726 . . . . 0.0 109.215 177.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -173.58 26.8 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.439 0 CA-C-N 114.779 -1.101 . . . . 0.0 108.757 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . 0.777 ' OD2' ' HD3' ' X' ' 9' ' ' ARG . 29.5 t70 -81.7 145.82 55.2 Favored Pre-proline 0 C--N 1.321 -0.672 0 CA-C-N 114.138 -1.392 . . . . 0.0 108.18 178.502 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . 0.579 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 92.9 Cg_exo -42.64 -26.0 0.57 Allowed 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 123.004 2.469 . . . . 0.0 113.879 -177.355 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . 0.777 ' HD3' ' OD2' ' X' ' 7' ' ' ASP . 3.6 mpp_? -92.89 -38.61 11.63 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.499 HD22 ' HB2' ' X' ' 14' ' ' LEU . 87.9 mt -97.03 -15.57 20.98 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 111.933 0.346 . . . . 0.0 111.933 -172.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.472 ' O ' ' HB3' ' X' ' 15' ' ' SER . 15.2 tt -72.48 -19.59 19.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 172.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -94.44 -51.03 4.95 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.317 174.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . 0.43 ' O ' ' HG2' ' X' ' 17' ' ' MET . 34.5 m -94.73 -29.63 14.69 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -169.005 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.499 ' HB2' HD22 ' X' ' 10' ' ' LEU . 10.0 tt -94.24 -40.62 9.9 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.472 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 5.6 t -67.53 -26.1 66.16 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.708 -179.03 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . 0.415 ' HA ' ' OG ' ' X' ' 19' ' ' SER . 1.1 pp0? -73.64 -28.48 61.8 Favored 'General case' 0 C--O 1.224 -0.263 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 175.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.43 ' HG2' ' O ' ' X' ' 13' ' ' SER . 91.0 mmm -65.46 -42.29 92.48 Favored 'General case' 0 CA--C 1.519 -0.229 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 174.232 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.38 -34.64 77.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.067 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . 0.415 ' OG ' ' HA ' ' X' ' 16' ' ' GLN . 5.1 p -84.83 -34.79 22.62 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -175.595 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . 0.447 ' HA ' ' CE ' ' X' ' 20' ' ' MET . 21.2 mmt -78.44 -15.2 58.9 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 121.141 -0.224 . . . . 0.0 111.486 -178.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 98.68 44.57 2.45 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.499 178.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -125.6 -177.78 4.02 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 176.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . 0.41 ' O ' HG21 ' X' ' 47' ' ' ILE . 42.5 m -156.96 -134.86 0.04 OUTLIER 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 175.524 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.586 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 2.8 p30 -122.15 131.43 53.95 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 169.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -97.61 55.11 1.21 Allowed 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.099 -0.64 . . . . 0.0 109.868 178.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 144.31 -0.22 1.08 Allowed Glycine 0 CA--C 1.518 0.227 0 C-N-CA 120.279 -0.963 . . . . 0.0 113.632 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.0 11.22 63.58 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.004 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.798 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 42.0 p-90 -87.21 -5.62 58.89 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -176.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.586 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 53.7 tp -59.83 -26.59 65.92 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 122.075 -0.39 . . . . 0.0 111.35 -175.083 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 80.5 p -93.73 -11.47 31.37 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.816 0.341 . . . . 0.0 111.082 175.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . 0.498 ' CG ' ' HA ' ' X' ' 28' ' ' TRP . 13.3 mmm180 -94.99 -61.98 1.39 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.25 0.548 . . . . 0.0 110.746 -178.458 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -47.16 -72.37 0.05 Allowed 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 114.345 -1.298 . . . . 0.0 111.408 -177.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.583 ' H ' HD12 ' X' ' 33' ' ' LEU . 6.3 mp -53.79 -50.0 67.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.579 -175.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . 0.401 HE22 HD21 ' X' ' 10' ' ' LEU . 0.0 OUTLIER -49.22 -34.06 14.01 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -176.154 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 2.7 m -99.05 -2.86 36.11 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 111.732 0.271 . . . . 0.0 111.732 -174.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -123.86 37.75 4.34 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -177.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 47.8 t30 69.48 26.33 5.18 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.38 0.61 . . . . 0.0 110.73 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.524 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 29.4 m-85 54.54 64.9 1.66 Allowed 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.268 178.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . 0.426 ' O ' ' HG ' ' X' ' 33' ' ' LEU . 33.7 p-10 -103.79 133.8 48.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.013 -0.994 . . . . 0.0 112.551 -173.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.645 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -91.45 -3.92 10.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 115.104 -0.953 . . . . 0.0 109.95 170.285 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.96 -36.32 81.18 Favored Glycine 0 N--CA 1.444 -0.807 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.736 177.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -96.88 -17.66 20.02 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.304 -0.448 . . . . 0.0 110.783 176.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.645 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -68.44 -45.99 71.05 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.217 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.618 ' HA ' HD11 ' X' ' 47' ' ' ILE . 10.2 mp -63.41 -34.01 76.8 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.788 0.328 . . . . 0.0 110.754 178.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -58.85 -38.31 78.44 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.743 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 9.6 p -96.48 -5.93 38.38 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 -172.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.798 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 1.4 pp -98.81 -27.07 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 CA-C-N 119.565 1.075 . . . . 0.0 112.502 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . 0.494 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.6 mp0 -159.8 -35.92 0.06 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.784 0.326 . . . . 0.0 110.949 -179.11 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -80.9 34.96 0.36 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.426 -177.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 8.4 t -81.54 -2.61 50.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.742 0.782 . . . . 0.0 109.894 178.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -120.11 20.21 12.11 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.602 176.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 79.3 t60 . . . . . 0 C--O 1.246 0.896 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.438 -177.456 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.866 0 N-CA-C 112.165 -0.374 . . . . 0.0 112.165 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 46.1 m -91.01 127.42 51.77 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-O 120.67 0.271 . . . . 0.0 110.506 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . 0.414 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 58.8 Cg_endo -74.98 162.48 37.1 Favored 'Trans proline' 0 CA--C 1.53 0.28 0 C-N-CA 122.516 2.144 . . . . 0.0 112.133 -178.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 4.2 Cg_exo -76.46 14.74 1.13 Allowed 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.859 2.373 . . . . 0.0 112.438 -179.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . 0.437 ' O ' ' HB3' ' X' ' 6' ' ' ALA . 4.1 tm-20 -153.55 112.9 3.79 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 176.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' X' ' 5' ' ' GLU . . . 81.73 48.93 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.48 0 O-C-N 124.115 0.885 . . . . 0.0 109.837 -171.121 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -89.68 150.08 43.44 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 172.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -46.36 -25.27 3.12 Favored 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 122.339 2.026 . . . . 0.0 113.05 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 66.0 mtt85 -87.59 -38.59 15.82 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.661 178.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 98.0 mt -81.95 -26.61 33.85 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.498 -176.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.512 ' O ' ' HB3' ' X' ' 15' ' ' SER . 0.3 OUTLIER -69.48 -20.18 23.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 174.188 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -88.34 -63.99 1.21 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.186 -0.915 . . . . 0.0 111.668 173.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 11.5 m -89.67 -26.7 20.57 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -167.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.57 ' HG ' HD11 ' X' ' 29' ' ' LEU . 7.8 tt -93.4 -42.74 9.12 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.512 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 15.3 t -67.12 -31.13 71.39 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.789 -175.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -65.91 -33.35 75.63 Favored 'General case' 0 C--O 1.227 -0.103 0 C-N-CA 120.501 -0.48 . . . . 0.0 111.022 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.812 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 14.7 ptm -89.03 -30.31 18.81 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.79 -0.364 . . . . 0.0 111.046 177.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 53.3 tp -59.71 -41.5 90.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.935 0.398 . . . . 0.0 110.665 177.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 14.6 m -87.69 -40.1 14.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.228 -175.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 86.3 mmm -72.28 -27.18 62.31 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -175.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.25 46.87 0.62 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 119.901 -1.142 . . . . 0.0 113.172 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.812 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 39.7 m-85 -122.69 160.24 26.27 Favored 'General case' 0 CA--C 1.511 -0.552 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 171.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 5.0 m -147.87 178.11 8.77 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 120.178 -0.609 . . . . 0.0 110.095 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.592 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.3 p30 -85.07 130.03 34.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.201 0.524 . . . . 0.0 110.082 173.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . 0.729 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 51.7 tp10 -69.67 -25.08 63.72 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.212 -176.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -145.66 15.25 1.8 Allowed Glycine 0 C--O 1.228 -0.238 0 C-N-CA 120.336 -0.935 . . . . 0.0 113.597 -178.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . 0.423 ' O ' ' HD3' ' X' ' 31' ' ' ARG . . . 90.91 22.89 31.72 Favored Glycine 0 CA--C 1.509 -0.337 0 C-N-CA 120.468 -0.872 . . . . 0.0 111.92 179.616 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.729 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 38.8 p-90 -96.12 -5.0 41.75 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -176.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.592 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 3.2 tp -51.37 -38.73 54.81 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -170.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . 0.768 ' O ' ' HG3' ' X' ' 34' ' ' GLN . 70.5 p -79.72 -46.2 17.5 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 119.928 -0.709 . . . . 0.0 110.195 173.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . 0.677 ' HD2' ' H ' ' X' ' 31' ' ' ARG . 1.4 mpt_? -53.34 -66.19 0.43 Allowed 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.422 0.689 . . . . 0.0 112.398 -179.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . 0.491 HD22 ' HE2' ' X' ' 36' ' ' LYS . 3.5 tm? -50.91 -60.5 3.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.437 -177.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.535 HD13 ' O ' ' X' ' 29' ' ' LEU . 11.0 mp -52.51 -47.8 66.39 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.405 -175.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . 0.768 ' HG3' ' O ' ' X' ' 30' ' ' THR . 33.2 mt-30 -64.88 -26.07 68.16 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -173.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 70.4 p -74.02 -16.68 61.05 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.29 -0.564 . . . . 0.0 111.315 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . 0.491 ' HE2' HD22 ' X' ' 32' ' ' LEU . 2.8 mptp? -121.33 37.08 4.43 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 121.266 -0.173 . . . . 0.0 111.462 177.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 37.9 t30 66.25 52.72 1.1 Allowed 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.161 0.505 . . . . 0.0 111.357 177.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.419 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 1.2 m-85 44.71 58.61 3.82 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.131 177.164 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . 0.489 ' O ' ' HG ' ' X' ' 33' ' ' LEU . 24.9 p-10 -111.15 151.49 28.1 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 119.167 -1.013 . . . . 0.0 113.523 -172.141 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.627 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -90.66 -2.88 10.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 114.11 -1.405 . . . . 0.0 110.119 172.245 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . 0.424 ' HA2' ' CE1' ' X' ' 52' ' ' HIS . . . -68.31 -37.06 85.89 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.851 -0.69 . . . . 0.0 111.797 -178.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.21 -21.0 17.54 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.251 -0.474 . . . . 0.0 110.532 175.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.627 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -63.62 -47.26 82.12 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.303 178.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.413 ' HA ' HD11 ' X' ' 47' ' ' ILE . 1.1 tp -62.68 -26.35 68.61 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.355 -179.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -67.28 -45.64 76.01 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.057 -179.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 27.5 p -97.31 -20.7 17.68 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -170.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.703 HG23 ' HH2' ' X' ' 28' ' ' TRP . 4.6 pt -64.58 -30.37 50.02 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 118.959 0.799 . . . . 0.0 112.586 -171.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -166.42 -41.56 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.201 0.524 . . . . 0.0 109.923 177.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 -75.7 -158.48 0.09 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.007 -175.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 20.6 t -160.88 21.83 0.13 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.126 178.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -153.73 151.19 29.34 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.555 -179.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . 0.424 ' CE1' ' HA2' ' X' ' 41' ' ' GLY . 67.7 t60 . . . . . 0 C--O 1.245 0.866 0 CA-C-O 118.443 -0.789 . . . . 0.0 109.484 175.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.718 0 N-CA-C 112.035 -0.426 . . . . 0.0 112.035 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 30.5 m -88.09 129.27 50.59 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-O 120.709 0.29 . . . . 0.0 110.876 -178.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -55.34 126.34 22.18 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 123.277 2.651 . . . . 0.0 112.589 -179.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -75.25 25.91 0.38 Allowed 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.794 2.329 . . . . 0.0 113.597 -178.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 72.53 4.06 4.87 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.551 0.741 . . . . 0.0 110.518 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -134.53 22.09 3.66 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.372 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.01 154.22 41.76 Favored Pre-proline 0 C--O 1.218 -0.59 0 CA-C-N 114.785 -1.098 . . . . 0.0 108.322 174.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_exo -45.7 -22.46 1.19 Allowed 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 123.305 2.67 . . . . 0.0 114.55 -174.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 80.3 mtp180 -83.99 -42.17 16.5 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 122.055 -0.403 . . . . 0.0 112.045 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 67.9 mt -99.25 -19.45 17.09 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -175.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.598 ' O ' ' HB3' ' X' ' 15' ' ' SER . 0.1 OUTLIER -69.4 -22.73 25.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 175.653 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -93.78 -37.58 11.71 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.765 176.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . 0.405 ' HA ' HG23 ' X' ' 40' ' ' ILE . 7.4 m -95.83 -40.72 9.19 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -171.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.422 HD23 HD11 ' X' ' 29' ' ' LEU . 3.3 tm? -94.58 -48.41 6.11 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -178.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.598 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 22.9 t -64.49 -27.11 68.75 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.053 -176.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . 0.486 HE21 ' HB3' ' X' ' 16' ' ' GLN . 0.0 OUTLIER -62.56 -46.65 87.38 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 121.206 0.527 . . . . 0.0 109.812 174.801 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . . . . . . . . . 77.2 mtp -71.36 -43.62 66.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.723 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 29.1 tp -62.58 -32.48 73.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.953 -176.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 8.0 t -96.33 -11.04 26.41 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.749 0.278 . . . . 0.0 111.749 -175.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 14.0 tpt -102.0 -31.71 10.53 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.777 -0.369 . . . . 0.0 111.372 -178.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.28 44.91 0.7 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.547 -0.835 . . . . 0.0 111.607 -177.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -128.99 146.58 50.94 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 177.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 14.9 m -146.22 -164.03 1.88 Allowed 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.915 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 9.1 p-10 -76.33 116.68 17.25 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 172.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 58.9 tt0 -100.96 65.17 1.09 Allowed 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 177.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 140.64 -6.07 2.64 Favored Glycine 0 N--CA 1.449 -0.478 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.268 -174.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.79 16.75 55.96 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 121.089 -0.577 . . . . 0.0 112.124 -179.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.683 ' HH2' HG23 ' X' ' 47' ' ' ILE . 58.6 p-90 -93.32 -13.33 28.28 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -174.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.915 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 3.7 tp -57.01 -33.62 67.35 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.648 -0.658 . . . . 0.0 112.135 -170.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . 0.5 ' O ' ' HG2' ' X' ' 34' ' ' GLN . 10.4 p -87.89 -10.41 50.77 Favored 'General case' 0 C--O 1.218 -0.599 0 C-N-CA 120.185 -0.606 . . . . 0.0 111.034 175.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . 0.53 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 20.0 mtp180 -95.6 -56.4 2.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.337 0.589 . . . . 0.0 110.868 -178.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -50.46 -53.31 30.69 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.948 -177.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.715 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 9.6 mp -68.31 -47.08 68.53 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -170.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . 0.5 ' HG2' ' O ' ' X' ' 30' ' ' THR . 3.5 mm100 -37.98 -71.27 0.08 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 -172.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 33.3 p -60.81 -29.91 69.75 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.802 0.334 . . . . 0.0 111.84 -173.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . 0.403 ' HB3' ' HB2' ' X' ' 39' ' ' ASP . 49.8 mttp -88.01 37.07 0.79 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.409 177.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 15.2 p30 46.37 34.32 2.23 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.352 1.061 . . . . 0.0 112.56 179.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.715 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 31.9 m-85 68.57 73.9 0.27 Allowed 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.869 -176.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . 0.403 ' HB2' ' HB3' ' X' ' 36' ' ' LYS . 35.2 t0 -100.47 125.5 46.78 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.975 -175.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.647 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.95 -13.79 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.625 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.662 169.856 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.63 -37.93 95.58 Favored Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.564 -0.827 . . . . 0.0 112.352 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.08 -18.75 19.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.436 -0.382 . . . . 0.0 111.065 176.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.646 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -70.47 -36.36 73.84 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.498 178.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.768 HD12 HD11 ' X' ' 47' ' ' ILE . 7.1 mp -60.7 -36.88 79.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.188 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . 0.543 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.1 t70 -51.93 -41.72 62.25 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 123.48 0.487 . . . . 0.0 111.354 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 5.1 p -96.23 -5.81 39.53 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -177.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.768 HD11 HD12 ' X' ' 44' ' ' LEU . 14.1 pt -101.95 44.33 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 CA-C-N 118.164 0.438 . . . . 0.0 111.63 174.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 79.04 27.1 0.43 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.94 0.896 . . . . 0.0 112.367 174.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . 0.543 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 62.3 m-85 -133.46 62.08 1.66 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.882 0.372 . . . . 0.0 110.173 173.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 22.7 m -82.15 47.65 1.15 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.129 0.49 . . . . 0.0 111.248 -178.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -165.38 78.71 0.3 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.346 177.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . 0.447 ' NE2' ' HB2' ' X' ' 45' ' ' ASP . 21.9 p80 . . . . . 0 C--O 1.245 0.828 0 CA-C-O 118.457 -0.782 . . . . 0.0 110.582 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.881 0 N-CA-C 112.155 -0.378 . . . . 0.0 112.155 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . 0.631 ' HB3' ' HA ' ' X' ' 7' ' ' ASP . 21.3 t -118.42 152.25 50.66 Favored Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 -178.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . 0.422 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 52.4 Cg_exo -52.86 146.02 37.89 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.534 2.156 . . . . 0.0 111.948 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . 0.491 ' HA ' HD12 ' X' ' 10' ' ' LEU . 21.1 Cg_exo -69.88 37.5 0.25 Allowed 'Trans proline' 0 CA--C 1.532 0.402 0 C-N-CA 123.172 2.581 . . . . 0.0 114.063 -175.352 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -146.93 13.11 1.13 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.589 0.233 . . . . 0.0 110.64 176.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . 0.427 ' HA ' HG23 ' X' ' 11' ' ' ILE . . . -179.17 41.62 0.0 OUTLIER 'General case' 0 CA--C 1.515 -0.372 0 CA-C-O 121.554 0.692 . . . . 0.0 109.935 -178.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . 0.631 ' HA ' ' HB3' ' X' ' 2' ' ' SER . 7.6 t70 -93.94 147.96 34.41 Favored Pre-proline 0 C--N 1.314 -0.974 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 175.133 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . 0.455 ' HA ' HD11 ' X' ' 11' ' ' ILE . 85.0 Cg_exo -44.18 -30.32 3.41 Favored 'Trans proline' 0 CA--C 1.532 0.421 0 C-N-CA 122.903 2.402 . . . . 0.0 112.709 -179.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . 0.478 ' HB3' ' HD2' ' X' ' 38' ' ' TYR . 80.3 mtm-85 -84.15 -29.49 26.64 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.838 -0.619 . . . . 0.0 112.514 178.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' X' ' 4' ' ' PRO . 88.1 mt -97.88 -20.71 17.32 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -174.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.49 HG12 ' O ' ' X' ' 7' ' ' ASP . 10.7 pt -73.64 -13.41 16.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 168.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -95.21 -53.13 3.9 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.629 174.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 23.7 t -93.29 -32.22 14.4 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -169.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.412 ' HB2' HD22 ' X' ' 10' ' ' LEU . 8.3 tt -93.28 -40.33 10.48 Favored 'General case' 0 CA--C 1.51 -0.592 0 O-C-N 121.395 -0.816 . . . . 0.0 109.002 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.471 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 10.5 t -70.03 -23.1 63.06 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.494 -176.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' X' ' 20' ' ' MET . 4.4 pp0? -65.3 -26.78 68.21 Favored 'General case' 0 C--O 1.223 -0.302 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.249 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.709 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 15.9 ptm -99.14 -24.74 14.77 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 121.033 -0.267 . . . . 0.0 110.504 175.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 35.7 tp -62.22 -40.73 97.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.752 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 40.3 p -91.4 -25.81 19.18 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.487 -178.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . 0.401 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 44.5 ttm -73.89 -31.26 63.04 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.499 -0.318 . . . . 0.0 111.148 -176.068 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 104.54 47.12 1.23 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.081 -1.057 . . . . 0.0 112.685 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.709 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 13.9 m-30 -114.27 175.92 5.27 Favored 'General case' 0 CA--C 1.511 -0.549 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 175.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . 0.607 ' O ' HG22 ' X' ' 47' ' ' ILE . 12.3 m -145.9 158.64 43.85 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 119.812 -0.755 . . . . 0.0 111.407 -178.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -68.68 133.74 48.86 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.464 173.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . 0.814 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 2.3 tm-20 -91.28 -16.95 26.74 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -175.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -170.25 21.1 0.08 OUTLIER Glycine 0 CA--C 1.519 0.32 0 C-N-CA 119.221 -1.466 . . . . 0.0 114.49 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 87.19 24.0 38.77 Favored Glycine 0 C--N 1.32 -0.311 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.402 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.814 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 59.1 p-90 -96.86 -14.65 21.69 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 119.157 -0.449 . . . . 0.0 112.179 -178.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.421 ' HA ' ' CE3' ' X' ' 28' ' ' TRP . 26.0 tp -52.33 -24.31 7.34 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -169.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 21.8 p -88.65 -61.59 1.68 Allowed 'General case' 0 C--N 1.32 -0.683 0 O-C-N 121.826 -0.546 . . . . 0.0 110.469 169.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . 0.73 ' HG2' ' HA ' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -49.37 -56.74 8.56 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -177.482 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . 0.603 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 2.5 tm? -54.12 -46.46 72.19 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 122.642 0.377 . . . . 0.0 110.842 -178.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.595 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 11.2 mp -70.04 -51.38 32.55 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.454 -178.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -44.37 -56.22 4.38 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -176.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 61.9 p -75.92 -2.7 31.55 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -175.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' X' ' 39' ' ' ASP . 53.7 mttp -120.59 28.27 8.07 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 40.7 t30 64.02 30.86 13.92 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.737 0.779 . . . . 0.0 110.262 178.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.595 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 8.6 m-30 59.43 63.55 1.53 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.393 -0.821 . . . . 0.0 109.874 -174.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' X' ' 36' ' ' LYS . 32.2 t70 -95.86 124.83 40.04 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.871 -173.153 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.817 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -90.44 -6.25 10.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.396 171.769 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.29 -40.81 99.5 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.442 -0.885 . . . . 0.0 111.982 177.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.5 -20.98 16.14 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.173 -0.514 . . . . 0.0 110.906 176.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.817 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -66.88 -39.15 87.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.646 178.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.854 HD12 HD11 ' X' ' 47' ' ' ILE . 5.7 mp -57.85 -37.02 73.13 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.149 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -49.78 -46.34 50.68 Favored 'General case' 0 CA--C 1.532 0.269 0 O-C-N 123.696 0.623 . . . . 0.0 111.499 178.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -88.21 -21.69 24.41 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -177.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.854 HD11 HD12 ' X' ' 44' ' ' LEU . 8.1 pt -88.05 43.3 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 O-C-N 121.757 -0.589 . . . . 0.0 111.639 174.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . 0.444 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 1.5 mp0 85.88 38.13 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.526 1.13 . . . . 0.0 112.982 174.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . 0.561 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 26.6 m-85 -134.61 39.85 3.0 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 170.012 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 6.9 p -80.09 4.47 17.12 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.318 0.58 . . . . 0.0 111.589 -176.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 27.0 mmtp -111.68 14.56 21.2 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.09 178.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 26.4 t-80 . . . . . 0 C--O 1.246 0.868 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.309 -177.062 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.734 0 N-CA-C 112.213 -0.355 . . . . 0.0 112.213 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 62.5 m -116.63 149.32 43.66 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 122.723 -0.281 . . . . 0.0 110.578 179.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . 0.435 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 13.4 Cg_exo -68.68 151.06 74.94 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.611 2.208 . . . . 0.0 111.466 179.053 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 9.3 Cg_exo -72.19 40.77 0.46 Allowed 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 123.207 2.605 . . . . 0.0 112.846 -179.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -151.73 13.06 0.62 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.322 176.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -157.09 21.38 0.31 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.252 -178.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . 0.406 ' O ' HG22 ' X' ' 11' ' ' ILE . 8.3 m-20 -77.75 154.78 80.93 Favored Pre-proline 0 C--O 1.216 -0.669 0 CA-C-N 115.448 -0.797 . . . . 0.0 109.298 176.158 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -46.04 -26.2 3.39 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 122.911 2.407 . . . . 0.0 112.675 177.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 56.0 mtm-85 -92.02 -33.96 14.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.188 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 93.7 mt -98.4 -19.52 17.68 Favored 'General case' 0 C--O 1.219 -0.519 0 O-C-N 122.223 -0.298 . . . . 0.0 111.578 -173.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.573 ' O ' ' HB3' ' X' ' 15' ' ' SER . 10.6 tt -74.08 -15.36 16.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 169.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . 0.516 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 4.7 tm-20 -94.77 -60.74 1.63 Allowed 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 114.754 -1.112 . . . . 0.0 110.277 175.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 36.7 m -89.77 -26.43 20.6 Favored 'General case' 0 C--O 1.224 -0.275 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -170.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . . . . . . . . . 7.5 tt -92.88 -40.41 10.63 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.573 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 28.1 t -70.18 -17.09 63.15 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 115.1 -0.954 . . . . 0.0 110.908 178.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . 0.516 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 0.0 OUTLIER -55.24 -50.73 68.71 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.509 178.383 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 1.014 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 0.5 OUTLIER -91.18 -23.66 20.17 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.012 179.405 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . 0.543 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 24.2 tp -63.49 -40.95 98.43 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-O 120.798 0.332 . . . . 0.0 110.805 -178.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 12.2 t -99.55 9.38 43.3 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.211 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . 0.474 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 55.1 tpp -104.5 -31.2 9.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.836 0.351 . . . . 0.0 110.874 -179.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 108.9 45.75 1.01 Allowed Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.313 -0.946 . . . . 0.0 111.831 -177.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 1.014 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 46.0 m-85 -125.79 178.78 5.51 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 175.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 44.8 m -161.39 160.23 29.22 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 176.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.669 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 50.2 p-10 -78.39 160.52 27.73 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.374 -0.53 . . . . 0.0 109.89 172.157 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . 0.749 ' HG2' ' CD1' ' X' ' 28' ' ' TRP . 18.1 pt-20 -64.05 -20.39 65.9 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.407 178.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 144.24 42.56 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.217 -0.992 . . . . 0.0 114.324 174.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 154.95 -16.85 0.54 Allowed Glycine 0 C--N 1.333 0.403 0 C-N-CA 118.39 -1.862 . . . . 0.0 115.389 171.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.936 ' HH2' HG23 ' X' ' 47' ' ' ILE . 43.2 p-90 -87.03 -20.03 27.78 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 118.459 1.13 . . . . 0.0 113.033 -173.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.669 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 42.3 tp -55.79 -21.32 18.7 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.15 0.886 . . . . 0.0 111.401 -176.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.88 -31.67 17.22 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 175.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . 0.675 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -95.15 -52.05 4.37 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 -178.678 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . 0.561 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 3.2 tm? -49.83 -51.56 39.05 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.49 0.716 . . . . 0.0 111.535 -177.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.698 ' O ' ' HA ' ' X' ' 38' ' ' TYR . 8.0 mp -71.99 -9.03 57.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.751 -177.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.7 -38.5 10.78 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.714 0.293 . . . . 0.0 110.775 -179.134 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 9.3 p -75.21 -39.49 60.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.44 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . 0.407 ' HG2' ' CB ' ' X' ' 42' ' ' ALA . 5.0 mptp? -78.3 37.92 0.28 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.956 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 41.9 45.92 3.34 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.851 0.86 . . . . 0.0 112.151 -177.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.698 ' HA ' ' O ' ' X' ' 33' ' ' LEU . 67.7 m-85 59.78 77.86 0.3 Allowed 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.312 177.227 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 30.0 t0 -134.84 138.69 44.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.931 -175.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.65 HD13 ' H ' ' X' ' 40' ' ' ILE . 0.1 OUTLIER -90.14 -9.72 10.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.919 169.294 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.57 -34.41 89.44 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.826 -0.702 . . . . 0.0 112.203 178.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . 0.407 ' CB ' ' HG2' ' X' ' 36' ' ' LYS . . . -99.01 -15.29 19.12 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.334 -0.433 . . . . 0.0 110.612 176.295 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.648 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -76.56 -35.84 57.97 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.163 -179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.507 HD13 ' O ' ' X' ' 40' ' ' ILE . 9.5 mp -69.7 -32.65 71.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.275 177.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -60.92 -31.85 71.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.157 177.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 21.8 p -98.01 -33.91 11.0 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -174.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.936 HG23 ' HH2' ' X' ' 28' ' ' TRP . 1.8 pt -65.71 -35.04 74.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 C-N-CA 119.337 -0.945 . . . . 0.0 112.837 -169.688 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . 0.431 ' OE1' ' HD1' ' X' ' 22' ' ' PHE . 1.0 OUTLIER -166.89 -34.95 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 120.735 0.302 . . . . 0.0 110.382 179.075 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . 0.504 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 52.7 m-85 -74.69 -173.19 1.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.978 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 20.6 p -153.06 16.77 0.56 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.835 0.35 . . . . 0.0 111.343 178.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -150.44 160.83 43.47 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 178.036 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 74.7 t60 . . . . . 0 C--O 1.244 0.79 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.376 175.744 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.894 0 N-CA-C 112.061 -0.416 . . . . 0.0 112.061 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . 0.451 ' HA ' ' HD3' ' X' ' 3' ' ' PRO . 50.9 m -69.64 128.26 92.17 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 120.868 0.366 . . . . 0.0 110.964 -179.138 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' X' ' 2' ' ' SER . 14.4 Cg_exo -67.42 163.73 33.51 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.751 2.301 . . . . 0.0 111.484 178.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -73.02 37.77 0.39 Allowed 'Trans proline' 0 CA--C 1.533 0.436 0 C-N-CA 122.963 2.442 . . . . 0.0 112.527 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . 0.4 ' H ' ' C ' ' X' ' 3' ' ' PRO . 57.5 mm-40 -124.1 7.59 8.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.784 177.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -177.09 35.85 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.724 -1.125 . . . . 0.0 109.149 -178.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . 0.43 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 32.3 t70 -93.85 144.53 28.28 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 114.86 -1.064 . . . . 0.0 108.34 178.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . 0.43 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 93.0 Cg_exo -42.36 -23.66 0.3 Allowed 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.362 2.708 . . . . 0.0 114.054 -178.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . 0.469 ' HD3' ' CE2' ' X' ' 38' ' ' TYR . 60.1 mtt85 -87.73 -46.07 9.8 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.719 HD22 ' HB2' ' X' ' 14' ' ' LEU . 74.3 mt -99.41 -11.89 20.73 Favored 'General case' 0 C--O 1.219 -0.504 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -175.463 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.659 ' O ' ' HB3' ' X' ' 15' ' ' SER . 11.2 tt -69.25 -25.65 29.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 121.552 0.691 . . . . 0.0 109.202 176.087 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -96.61 -38.11 10.09 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.661 176.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 32.5 m -96.01 -33.0 12.3 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -172.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.719 ' HB2' HD22 ' X' ' 10' ' ' LEU . 10.1 tt -95.33 -49.0 5.65 Favored 'General case' 0 CA--C 1.508 -0.657 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.659 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 37.2 t -61.42 -31.4 71.33 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 114.426 -1.261 . . . . 0.0 111.403 -177.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -53.47 -55.0 29.04 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.871 0.367 . . . . 0.0 110.22 176.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.744 ' HB3' ' HB2' ' X' ' 22' ' ' PHE . 68.8 mtm -69.23 -39.91 78.24 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.493 -178.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.91 -32.5 74.23 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -177.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 20.7 p -86.13 -37.35 18.87 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.852 0.315 . . . . 0.0 111.852 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 13.4 tpt -69.99 -24.95 63.39 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.362 -176.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.9 34.54 1.5 Allowed Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.434 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.744 ' HB2' ' HB3' ' X' ' 17' ' ' MET . 5.6 m-85 -110.58 -176.13 2.9 Favored 'General case' 0 N--CA 1.448 -0.573 0 N-CA-C 107.651 -1.24 . . . . 0.0 107.651 173.056 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . 0.6 ' O ' HG21 ' X' ' 47' ' ' ILE . 15.3 m -152.47 -149.28 0.29 Allowed 'General case' 0 C--N 1.318 -0.794 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.392 178.082 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.444 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 12.2 p-10 -122.88 131.78 53.89 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 170.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -115.69 68.05 0.71 Allowed 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.097 -0.641 . . . . 0.0 111.012 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 136.9 5.51 1.89 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.378 -0.915 . . . . 0.0 113.136 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 79.38 7.63 88.34 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.173 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.834 ' HZ2' HG23 ' X' ' 47' ' ' ILE . 46.0 p-90 -79.65 -10.1 59.74 Favored 'General case' 0 C--O 1.22 -0.486 0 N-CA-C 111.556 0.206 . . . . 0.0 111.556 -178.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.675 HD11 ' HG ' ' X' ' 14' ' ' LEU . 14.5 tp -55.97 -24.65 39.76 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 122.015 -0.428 . . . . 0.0 111.283 -174.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . 0.636 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 20.5 p -94.41 -47.47 6.57 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 122.072 -0.393 . . . . 0.0 110.706 169.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . 0.448 ' H ' ' HG2' ' X' ' 31' ' ' ARG . 15.6 mmm180 -55.65 -59.78 4.37 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.303 0.641 . . . . 0.0 112.012 -178.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . 0.535 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 2.8 tm? -55.97 -60.53 3.34 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.934 -1.03 . . . . 0.0 111.128 -176.118 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.454 HD13 ' O ' ' X' ' 29' ' ' LEU . 9.8 mp -57.32 -45.61 84.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.387 -176.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . 0.636 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.3 OUTLIER -49.82 -48.43 50.86 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 123.217 0.323 . . . . 0.0 111.436 179.685 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 14.1 m -67.15 -46.21 74.74 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.171 -178.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -81.74 37.14 0.46 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.682 -179.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 5.5 p-10 40.33 49.92 2.6 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.806 0.842 . . . . 0.0 112.387 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.469 ' CE2' ' HD3' ' X' ' 9' ' ' ARG . 79.2 m-85 61.72 67.93 0.73 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.143 177.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -120.6 137.94 54.15 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.82 -177.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.71 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -90.9 -9.8 10.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.432 171.826 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -60.78 -38.43 95.23 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.587 -178.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.51 -15.4 18.68 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.486 -0.357 . . . . 0.0 110.594 175.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.71 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -68.41 -51.33 45.12 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.357 179.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.464 HD13 ' HB ' ' X' ' 40' ' ' ILE . 11.1 mp -59.52 -28.69 67.29 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.886 0.374 . . . . 0.0 110.913 178.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . 0.451 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 37.1 t70 -65.36 -33.09 75.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.797 -179.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 5.0 p -95.87 -5.81 40.77 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 114.218 1.192 . . . . 0.0 114.218 -172.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.834 HG23 ' HZ2' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -105.03 -27.39 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 CA-C-N 119.005 0.821 . . . . 0.0 112.522 -179.047 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . 0.629 ' NE2' ' HB ' ' X' ' 47' ' ' ILE . 3.0 mp0 -157.49 -48.84 0.07 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.282 0.563 . . . . 0.0 110.279 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . 0.451 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 48.1 m-85 -82.18 58.47 4.02 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.781 -173.33 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 50.6 m -83.09 -0.64 50.01 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.962 0.887 . . . . 0.0 109.13 171.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . 0.466 ' HD3' ' N ' ' X' ' 51' ' ' LYS . 0.2 OUTLIER -141.84 64.62 1.39 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 113.972 -1.467 . . . . 0.0 108.919 175.687 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 28.0 t-80 . . . . . 0 C--O 1.244 0.814 0 CA-C-O 118.351 -0.833 . . . . 0.0 110.76 -173.984 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.888 0 N-CA-C 112.284 -0.326 . . . . 0.0 112.284 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . 0.514 ' HA ' ' HD3' ' X' ' 3' ' ' PRO . 12.3 m -76.47 120.63 82.5 Favored Pre-proline 0 C--N 1.326 -0.437 0 N-CA-C 110.255 -0.276 . . . . 0.0 110.255 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . 0.609 ' HG2' HD11 ' X' ' 10' ' ' LEU . 1.1 Cg_endo -86.83 166.44 8.62 Favored 'Trans proline' 0 N--CA 1.455 -0.751 0 C-N-CA 122.976 2.451 . . . . 0.0 111.358 -179.222 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . 0.721 ' HB2' ' HB2' ' X' ' 7' ' ' ASP . 44.3 Cg_exo -56.55 155.27 26.75 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.503 2.135 . . . . 0.0 111.947 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -73.91 96.37 2.61 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.015 -173.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . 60.64 59.81 2.09 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.707 0.765 . . . . 0.0 109.376 -175.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . 0.721 ' HB2' ' HB2' ' X' ' 4' ' ' PRO . 21.5 t70 -75.75 154.32 85.24 Favored Pre-proline 0 C--N 1.318 -0.764 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 176.544 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . 0.588 ' HD2' ' CG ' ' X' ' 7' ' ' ASP . 71.1 Cg_exo -39.07 -25.41 0.1 Allowed 'Trans proline' 0 CA--C 1.541 0.829 0 C-N-CA 123.233 2.622 . . . . 0.0 113.627 -178.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . 0.529 ' HD3' ' OD2' ' X' ' 7' ' ' ASP . 5.6 mtp180 -77.11 -48.11 18.64 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 176.054 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.609 HD11 ' HG2' ' X' ' 3' ' ' PRO . 79.6 mt -92.05 -26.4 18.34 Favored 'General case' 0 C--O 1.217 -0.608 0 O-C-N 122.254 -0.279 . . . . 0.0 111.672 -175.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.525 ' O ' ' HB3' ' X' ' 15' ' ' SER . 12.7 tt -69.69 -15.32 19.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 173.065 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -91.8 -58.4 2.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.001 174.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 50.2 m -90.86 -29.96 17.22 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -169.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.407 ' O ' ' HG3' ' X' ' 17' ' ' MET . 5.2 tt -94.52 -45.05 7.58 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 -179.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.525 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 19.3 t -64.77 -25.73 68.05 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.8 -175.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . 0.669 ' O ' ' HB2' ' X' ' 20' ' ' MET . 5.2 pp0? -65.96 -24.31 66.78 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 120.952 -0.299 . . . . 0.0 111.562 -179.549 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.528 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 4.6 ppp? -101.52 -27.38 13.14 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.775 0.322 . . . . 0.0 110.564 176.19 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 24.7 tp -65.93 -43.29 88.52 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.983 -179.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 29.6 t -96.84 8.82 43.5 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.09 -179.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . 0.669 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 10.3 tpt -100.36 -31.42 11.34 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.972 0.415 . . . . 0.0 110.561 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 99.11 42.1 2.88 Favored Glycine 0 N--CA 1.447 -0.611 0 N-CA-C 111.058 -0.817 . . . . 0.0 111.058 -174.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.528 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 11.4 m-30 -115.76 171.23 7.88 Favored 'General case' 0 CA--C 1.506 -0.742 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 177.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . 0.477 ' O ' HG22 ' X' ' 47' ' ' ILE . 32.4 m -153.35 161.95 41.79 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.605 177.059 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.505 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 15.6 p30 -68.54 136.95 53.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.124 0.487 . . . . 0.0 110.389 174.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . 0.684 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 38.5 tt0 -61.54 -19.45 62.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.366 -0.833 . . . . 0.0 111.22 -176.166 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -149.69 -64.68 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.677 176.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . 0.484 ' HA2' ' OD2' ' X' ' 24' ' ' ASP . . . 179.52 32.9 0.06 OUTLIER Glycine 0 CA--C 1.506 -0.531 0 N-CA-C 110.755 -0.938 . . . . 0.0 110.755 179.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.754 ' HH2' HG23 ' X' ' 47' ' ' ILE . 40.5 p-90 -96.83 -4.02 41.09 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -172.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.505 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 20.9 tp -59.11 -24.08 62.67 Favored 'General case' 0 CA--C 1.54 0.588 0 O-C-N 121.746 -0.596 . . . . 0.0 112.058 -170.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . 0.407 ' HA ' ' OE1' ' X' ' 34' ' ' GLN . 6.7 m -95.05 -11.88 27.57 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 121.368 0.604 . . . . 0.0 111.074 174.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -95.66 -54.84 3.22 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.727 -177.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -61.37 -61.04 2.83 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.105 -177.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.631 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 7.8 mp -60.37 -60.75 3.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.254 -172.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . 0.407 ' OE1' ' HA ' ' X' ' 30' ' ' THR . 12.2 mp0 -46.45 -43.01 16.21 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.189 0.811 . . . . 0.0 113.189 -173.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 40.2 p -76.9 -12.17 59.92 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 -176.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -118.69 32.97 5.85 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.624 0.231 . . . . 0.0 111.624 -177.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 45.9 t30 60.37 40.71 17.14 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.43 0.634 . . . . 0.0 110.513 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.631 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 18.1 m-85 55.86 61.03 2.96 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.649 -179.293 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -86.06 118.19 25.37 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.471 -173.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.689 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.3 OUTLIER -90.53 -4.34 10.61 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.37 173.72 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . 0.41 ' HA2' ' CE1' ' X' ' 52' ' ' HIS . . . -66.92 -39.96 93.43 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 120.589 -0.815 . . . . 0.0 111.73 176.394 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.16 -25.86 14.39 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.07 -0.565 . . . . 0.0 111.11 178.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.689 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -65.01 -41.81 95.02 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.899 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.746 HD12 HD11 ' X' ' 47' ' ' ILE . 7.1 mp -65.34 -33.73 76.67 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.381 -178.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . 0.636 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.4 t70 -58.43 -39.34 79.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.018 0.437 . . . . 0.0 110.554 178.053 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 8.8 p -94.83 -6.38 42.96 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -177.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.754 HG23 ' HH2' ' X' ' 28' ' ' TRP . 13.0 pt -100.72 42.93 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 O-C-N 121.703 -0.623 . . . . 0.0 111.382 174.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 2.1 mt-30 89.49 -6.93 0.41 Allowed 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.798 1.239 . . . . 0.0 113.318 173.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . 0.636 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 6.9 m-85 -112.26 73.33 0.81 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.944 -0.472 . . . . 0.0 111.59 178.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 21.3 m -78.72 11.29 2.66 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.072 0.463 . . . . 0.0 111.344 177.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -121.95 79.39 1.57 Allowed 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 172.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . 0.41 ' CE1' ' HA2' ' X' ' 41' ' ' GLY . 13.5 t-160 . . . . . 0 C--O 1.241 0.626 0 CA-C-O 118.498 -0.763 . . . . 0.0 109.773 -176.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.815 0 N-CA-C 112.176 -0.37 . . . . 0.0 112.176 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 66.5 m -86.31 123.02 72.02 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 122.785 -0.244 . . . . 0.0 110.427 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . 0.535 ' HG2' ' HB3' ' X' ' 6' ' ' ALA . 28.1 Cg_endo -63.08 145.39 93.93 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.325 2.016 . . . . 0.0 111.913 179.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.7 34.23 0.38 Allowed 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.812 2.341 . . . . 0.0 112.438 179.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . 0.412 ' H ' ' C ' ' X' ' 3' ' ' PRO . 48.2 mt-10 -146.39 15.2 1.28 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.525 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . 0.535 ' HB3' ' HG2' ' X' ' 3' ' ' PRO . . . -169.55 51.05 0.04 OUTLIER 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 -177.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . 0.486 ' O ' HG12 ' X' ' 11' ' ' ILE . 9.0 t70 -108.34 150.22 40.29 Favored Pre-proline 0 C--N 1.316 -0.871 0 CA-C-N 114.15 -1.387 . . . . 0.0 107.416 -177.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . 0.452 ' HD2' ' CG ' ' X' ' 7' ' ' ASP . 94.8 Cg_exo -42.76 -31.99 2.32 Favored 'Trans proline' 0 CA--C 1.54 0.821 0 C-N-CA 122.906 2.404 . . . . 0.0 113.25 -177.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . 0.508 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 69.1 mtp180 -78.08 -26.56 48.21 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 178.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.717 HD22 ' HB2' ' X' ' 14' ' ' LEU . 56.5 mt -97.67 -22.3 16.54 Favored 'General case' 0 C--O 1.221 -0.421 0 C-N-CA 122.283 0.233 . . . . 0.0 110.788 177.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.554 ' O ' ' HB3' ' X' ' 15' ' ' SER . 43.5 mm -66.86 -13.86 17.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 108.617 -0.882 . . . . 0.0 108.617 171.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -93.73 -64.19 1.11 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 114.66 -1.155 . . . . 0.0 111.1 171.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . 0.527 ' O ' ' HE2' ' X' ' 17' ' ' MET . 15.9 m -86.92 -25.65 24.29 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -168.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.717 ' HB2' HD22 ' X' ' 10' ' ' LEU . 60.5 tp -93.37 -43.96 8.52 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.554 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 46.3 t -63.23 -26.75 68.93 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.173 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . 0.442 HE22 HD11 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -57.05 -47.92 79.78 Favored 'General case' 0 N--CA 1.461 0.089 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 174.399 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.618 ' HB3' ' O ' ' X' ' 22' ' ' PHE . 59.1 mtm -75.79 -43.99 43.59 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.204 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 28.9 tp -57.72 -32.86 67.83 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 123.4 0.437 . . . . 0.0 111.578 -177.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 46.8 t -88.07 -30.93 19.53 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.576 -178.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . 0.451 ' HB3' ' CE1' ' X' ' 22' ' ' PHE . 15.0 tpt -80.6 -31.51 36.69 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -176.319 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.43 24.57 4.37 Favored Glycine 0 CA--C 1.52 0.371 0 C-N-CA 119.976 -1.107 . . . . 0.0 113.939 176.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.618 ' O ' ' HB3' ' X' ' 17' ' ' MET . 0.0 OUTLIER -138.61 167.09 22.7 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 171.136 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 36.6 m -158.59 -91.57 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 119.971 -0.692 . . . . 0.0 111.926 -175.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.442 ' CG ' ' H ' ' X' ' 27' ' ' GLY . 56.2 t0 -119.17 122.92 43.11 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.297 -176.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . 0.799 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 54.8 tt0 -61.44 -29.45 69.95 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.249 176.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 155.84 40.33 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 119.567 -1.301 . . . . 0.0 115.294 173.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . 0.442 ' H ' ' CG ' ' X' ' 24' ' ' ASP . . . 146.09 -14.81 1.7 Allowed Glycine 0 C--N 1.332 0.342 0 C-N-CA 119.178 -1.487 . . . . 0.0 114.724 171.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.871 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 56.8 p-90 -96.2 -14.73 22.51 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 117.81 0.805 . . . . 0.0 113.041 -173.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.44 ' HA ' ' CE3' ' X' ' 28' ' ' TRP . 38.8 tp -54.76 -34.72 62.94 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 121.864 -0.523 . . . . 0.0 112.392 -170.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . 0.547 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 80.3 p -85.5 -16.45 39.52 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 122.167 -0.333 . . . . 0.0 111.273 177.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 13.7 mtm105 -95.37 -52.6 4.09 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.971 0.415 . . . . 0.0 111.216 -176.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -52.07 -70.34 0.09 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.241 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.584 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 7.0 mp -58.43 -45.51 88.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.992 -175.425 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . 0.547 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.0 OUTLIER -53.23 -38.99 63.44 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -174.231 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 40.5 p -94.37 -2.34 52.23 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.837 0.351 . . . . 0.0 111.938 -177.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -118.29 38.05 3.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.9 178.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 41.64 45.12 2.86 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.744 0.817 . . . . 0.0 111.928 -176.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.584 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 53.1 m-85 60.05 78.01 0.29 Allowed 'General case' 0 C--O 1.233 0.209 0 CA-C-N 114.873 -1.058 . . . . 0.0 111.382 178.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -97.86 120.96 39.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.704 -177.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.529 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.12 -19.96 7.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 172.029 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.18 -46.37 91.15 Favored Glycine 0 N--CA 1.441 -0.973 0 C-N-CA 120.493 -0.86 . . . . 0.0 112.277 -179.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -83.81 -22.05 31.91 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.475 -0.362 . . . . 0.0 111.002 178.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.711 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -68.91 -47.4 65.9 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.944 178.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.529 HD13 ' O ' ' X' ' 40' ' ' ILE . 10.8 mp -67.36 -29.12 68.57 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.03 -179.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . 0.748 ' OD1' ' HA ' ' X' ' 50' ' ' SER . 47.7 t0 -65.13 -28.45 69.43 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 121.284 0.564 . . . . 0.0 110.897 178.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 7.6 p -96.08 -32.69 12.41 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -175.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.871 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 0.9 OUTLIER -83.36 -29.43 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -173.137 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . 0.565 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.3 mt-30 -164.04 -35.9 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 -177.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . 0.513 ' CE2' ' HE2' ' X' ' 22' ' ' PHE . 37.4 m-85 -91.73 -167.44 1.78 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.809 0.338 . . . . 0.0 110.707 -177.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . 0.748 ' HA ' ' OD1' ' X' ' 45' ' ' ASP . 68.3 m -155.28 35.54 0.38 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.731 178.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -126.49 89.51 3.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.263 178.475 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.246 0.88 0 CA-C-O 118.57 -0.729 . . . . 0.0 111.004 -179.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.004 0 N-CA-C 112.128 -0.389 . . . . 0.0 112.128 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 18.0 m -80.21 135.39 54.36 Favored Pre-proline 0 C--N 1.326 -0.422 0 N-CA-C 110.448 -0.205 . . . . 0.0 110.448 179.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . 0.502 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 33.8 Cg_exo -60.56 118.38 5.24 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.571 2.181 . . . . 0.0 112.119 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . 0.502 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 3.1 Cg_exo -77.18 42.64 1.16 Allowed 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 123.162 2.574 . . . . 0.0 112.911 -177.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -142.56 10.99 1.87 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.707 0.289 . . . . 0.0 110.949 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -174.29 44.0 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -178.018 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -106.94 142.19 24.47 Favored Pre-proline 0 C--N 1.314 -0.955 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 -179.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -44.96 -20.88 0.43 Allowed 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.152 2.568 . . . . 0.0 113.325 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 87.8 mtm-85 -92.56 -37.73 12.31 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 122.901 0.48 . . . . 0.0 112.11 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.738 HD23 ' HB2' ' X' ' 13' ' ' SER . 36.7 mt -98.84 -10.66 22.63 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -175.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.698 ' O ' ' HB2' ' X' ' 15' ' ' SER . 12.6 tt -68.1 -21.91 27.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 175.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -95.62 -26.22 15.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.847 170.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . 0.738 ' HB2' HD23 ' X' ' 10' ' ' LEU . 20.3 m -96.65 -48.51 5.48 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -171.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.538 ' HB2' HD22 ' X' ' 10' ' ' LEU . 2.4 tm? -93.11 -44.13 8.52 Favored 'General case' 0 CA--C 1.507 -0.709 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 -179.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.698 ' HB2' ' O ' ' X' ' 11' ' ' ILE . 18.9 m -64.67 -17.83 64.42 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.277 -176.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . 0.527 ' NE2' ' HB3' ' X' ' 17' ' ' MET . 4.7 pp0? -78.28 -28.44 47.6 Favored 'General case' 0 N--CA 1.461 0.117 0 C-N-CA 120.557 -0.457 . . . . 0.0 111.091 177.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 1.046 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 23.0 ptp -94.16 -26.53 16.65 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.588 178.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 36.8 tp -57.46 -40.18 77.94 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.459 -179.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 25.6 m -70.8 -37.76 73.28 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -177.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -84.66 -26.24 27.93 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 111.895 0.331 . . . . 0.0 111.895 -174.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.69 46.15 0.86 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.318 -0.944 . . . . 0.0 112.277 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 1.046 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 6.5 m-85 -127.36 146.46 50.45 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 175.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 58.6 m -151.51 -116.89 0.04 OUTLIER 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.784 -175.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.681 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.4 p30 -122.47 142.89 50.09 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.182 172.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . 0.762 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 29.5 tt0 -67.58 -50.61 57.53 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.582 0.706 . . . . 0.0 110.054 177.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -133.77 -3.61 3.25 Favored Glycine 0 C--N 1.319 -0.372 0 CA-C-N 114.978 -1.01 . . . . 0.0 112.855 -178.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 126.05 12.16 3.66 Favored Glycine 0 C--N 1.33 0.205 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.739 178.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.774 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 28.2 p-90 -80.35 -6.96 58.82 Favored 'General case' 0 C--O 1.22 -0.453 0 N-CA-C 111.998 0.369 . . . . 0.0 111.998 -178.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.681 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 15.0 tp -56.6 -32.37 65.19 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.934 0.397 . . . . 0.0 111.627 -173.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . 0.497 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 35.1 p -82.3 -19.97 38.38 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.341 176.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . 0.602 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 8.8 mtm180 -95.24 -57.03 2.53 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.694 -175.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -51.35 -62.35 1.67 Allowed 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.608 0.763 . . . . 0.0 111.157 -177.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.841 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 7.3 mp -60.62 -45.48 93.89 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.243 -176.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . 0.497 ' HB2' ' O ' ' X' ' 30' ' ' THR . 3.7 tp-100 -39.15 -61.21 0.79 Allowed 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -175.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 26.7 p -85.3 -2.82 58.49 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -174.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -108.3 28.73 8.03 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 122.202 -0.311 . . . . 0.0 111.274 177.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 48.0 t30 60.31 42.7 14.57 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-O 121.09 0.471 . . . . 0.0 110.866 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.841 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 89.4 m-85 53.55 58.61 5.01 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.562 0.696 . . . . 0.0 110.177 -178.067 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -77.01 117.1 18.26 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.448 -1.251 . . . . 0.0 111.428 -172.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.634 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.78 -5.11 10.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.109 0.481 . . . . 0.0 110.291 170.958 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -80.28 -36.48 23.91 Favored Glycine 0 N--CA 1.439 -1.117 0 C-N-CA 120.476 -0.869 . . . . 0.0 111.52 178.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.56 -20.49 18.96 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.182 -0.509 . . . . 0.0 111.273 178.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.659 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -65.27 -45.01 86.19 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.019 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.634 HD13 ' O ' ' X' ' 40' ' ' ILE . 11.0 mp -66.26 -29.34 69.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.644 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . 0.557 ' OD1' ' HA ' ' X' ' 50' ' ' SER . 17.6 t70 -63.66 -29.5 70.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.281 176.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 3.6 p -98.04 -16.16 19.73 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -175.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.774 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 0.4 OUTLIER -94.06 -30.61 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 119.431 -0.908 . . . . 0.0 113.17 -176.292 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . 0.463 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.7 mp0 -161.22 -42.58 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 120.968 0.413 . . . . 0.0 110.966 -178.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . 0.432 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 60.0 m-85 -73.16 -175.08 1.73 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.639 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . 0.557 ' HA ' ' OD1' ' X' ' 45' ' ' ASP . 0.4 OUTLIER -169.29 86.43 0.15 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.76 175.384 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . 0.437 ' HB2' ' O ' ' X' ' 50' ' ' SER . 74.4 mmtt 83.82 62.57 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 O-C-N 124.339 1.024 . . . . 0.0 110.338 -177.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 . . . . . 0 C--O 1.245 0.829 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.852 179.721 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . 0.47 ' O ' ' HD3' ' X' ' 3' ' ' PRO . . . . . . . . 0 N--CA 1.484 1.835 0 N-CA-C 112.022 -0.431 . . . . 0.0 112.022 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . 0.46 ' HB3' ' OD1' ' X' ' 7' ' ' ASP . 14.2 m -107.24 98.24 21.9 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-O 120.6 0.238 . . . . 0.0 110.388 178.562 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . 0.47 ' HD3' ' O ' ' X' ' 1' ' ' GLY . 3.9 Cg_exo -77.36 144.95 23.46 Favored 'Trans proline' 0 N--CA 1.461 -0.383 0 C-N-CA 122.664 2.243 . . . . 0.0 111.853 -178.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.42 35.65 0.4 Allowed 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 122.819 2.346 . . . . 0.0 112.793 178.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . 0.402 ' H ' ' C ' ' X' ' 3' ' ' PRO . 21.7 tt0 -162.32 23.45 0.1 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.19 178.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . 179.11 28.63 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.457 -178.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . 0.534 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 28.9 t70 -81.7 147.22 58.42 Favored Pre-proline 0 C--N 1.318 -0.771 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 176.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . 0.534 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 83.9 Cg_exo -47.06 -24.92 3.68 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.07 1.847 . . . . 0.0 112.849 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 77.8 mtm-85 -94.17 -28.46 15.64 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.501 HD22 ' HB2' ' X' ' 14' ' ' LEU . 50.2 mt -97.95 -16.97 19.48 Favored 'General case' 0 CA--C 1.514 -0.42 0 O-C-N 122.14 -0.35 . . . . 0.0 111.284 -177.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.536 ' HA ' ' HB2' ' X' ' 15' ' ' SER . 14.2 tt -73.02 -8.77 12.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 172.492 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . 0.546 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 45.8 mt-10 -93.65 -62.61 1.33 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.637 -1.165 . . . . 0.0 110.754 173.318 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 11.0 m -90.05 -27.93 19.38 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -168.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.501 ' HB2' HD22 ' X' ' 10' ' ' LEU . 9.5 tt -94.28 -44.39 7.97 Favored 'General case' 0 CA--C 1.51 -0.595 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.536 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 12.9 t -66.71 -18.95 65.64 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.444 -0.798 . . . . 0.0 111.125 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . 0.546 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 0.0 OUTLIER -64.03 -44.27 93.03 Favored 'General case' 0 CA--C 1.521 -0.157 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 175.239 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.614 ' SD ' HD13 ' X' ' 29' ' ' LEU . 62.1 mtt -69.86 -38.35 76.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.606 178.139 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . 0.437 ' HB2' ' HA ' ' X' ' 15' ' ' SER . 7.9 mp -62.12 -32.5 73.08 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.499 178.233 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 37.2 t -80.6 -44.35 19.08 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.331 -178.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 26.2 mmt -78.66 -32.21 47.07 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 -175.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 110.6 46.86 0.82 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.363 -0.922 . . . . 0.0 112.124 -178.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -128.52 162.97 25.98 Favored 'General case' 0 CA--C 1.512 -0.504 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 177.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 44.8 m -139.78 -143.25 0.16 Allowed 'General case' 0 C--N 1.315 -0.91 0 C-N-CA 120.576 -0.45 . . . . 0.0 109.789 178.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.715 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 21.8 p-10 -99.72 128.23 45.82 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.94 0.4 . . . . 0.0 110.272 173.395 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . 0.816 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 42.9 tp10 -83.71 56.99 3.86 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.751 0.786 . . . . 0.0 109.223 176.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 133.31 -87.33 0.27 Allowed Glycine 0 N--CA 1.446 -0.686 0 CA-C-N 114.827 -1.079 . . . . 0.0 111.476 -174.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -172.27 29.28 0.11 Allowed Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 121.041 -0.599 . . . . 0.0 111.741 177.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.824 ' HH2' HG23 ' X' ' 47' ' ' ILE . 53.3 p-90 -95.92 -9.66 30.74 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 -176.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.715 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 10.6 tp -59.69 -19.96 53.15 Favored 'General case' 0 N--CA 1.465 0.324 0 O-C-N 121.826 -0.546 . . . . 0.0 110.761 -175.663 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . 0.649 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 38.7 p -93.83 -48.03 6.48 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 121.993 -0.442 . . . . 0.0 110.624 169.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 42.7 mmm-85 -63.71 -61.22 2.45 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.287 -176.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . 0.645 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 2.0 tm? -50.33 -52.38 37.31 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.84 -178.276 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.424 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 62.3 mt -61.06 -62.01 2.16 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.305 -179.514 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . 0.649 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.0 OUTLIER -42.8 -54.69 4.0 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 -175.966 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 29.6 p -68.39 -24.74 64.81 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -175.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 61.0 mttm -105.19 37.4 2.2 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.577 -0.283 . . . . 0.0 110.978 178.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 42.05 41.86 2.16 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.715 0.806 . . . . 0.0 112.841 -178.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.424 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 74.3 m-85 65.96 66.22 0.5 Allowed 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.033 177.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -104.25 120.18 40.6 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.257 -179.238 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.765 ' HB ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.26 -3.6 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.155 173.719 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.8 -41.01 97.76 Favored Glycine 0 N--CA 1.443 -0.878 0 C-N-CA 120.402 -0.904 . . . . 0.0 111.961 177.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.99 -20.27 16.84 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.156 -0.522 . . . . 0.0 111.18 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.698 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -74.33 -31.71 62.54 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.011 179.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.765 HD13 ' HB ' ' X' ' 40' ' ' ILE . 6.5 mp -75.43 -19.15 59.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.199 179.428 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . 0.544 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.5 t70 -70.33 -27.14 64.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.87 0.367 . . . . 0.0 110.502 177.287 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 17.9 p -95.83 -23.44 16.92 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.824 HG23 ' HH2' ' X' ' 28' ' ' TRP . 2.4 pp -84.09 42.55 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 178.336 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 84.67 7.55 0.5 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.164 0.985 . . . . 0.0 112.801 172.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . 0.544 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 15.9 m-85 -122.36 68.57 0.95 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.082 0.468 . . . . 0.0 110.944 176.051 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 14.2 m -81.13 43.63 0.72 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.147 179.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -127.14 92.06 3.45 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 . . . . . 0 C--O 1.244 0.774 0 CA-C-O 118.584 -0.722 . . . . 0.0 109.82 -177.529 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.959 0 N-CA-C 112.013 -0.435 . . . . 0.0 112.013 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . 0.491 ' HA ' ' HD3' ' X' ' 3' ' ' PRO . 27.2 m -81.13 115.58 57.11 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 120.742 0.306 . . . . 0.0 110.974 -178.087 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . 0.491 ' HD3' ' HA ' ' X' ' 2' ' ' SER . 2.9 Cg_exo -78.13 151.97 27.33 Favored 'Trans proline' 0 N--CA 1.463 -0.272 0 C-N-CA 123.106 2.537 . . . . 0.0 112.296 -178.241 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 66.8 Cg_endo -75.63 38.12 0.55 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.825 2.35 . . . . 0.0 112.313 177.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -153.48 15.24 0.51 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.106 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -162.78 24.72 0.1 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.868 -179.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -78.36 147.3 72.05 Favored Pre-proline 0 C--O 1.216 -0.678 0 CA-C-N 114.462 -1.245 . . . . 0.0 108.17 177.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -44.99 -23.14 0.85 Allowed 'Trans proline' 0 CA--C 1.538 0.697 0 C-N-CA 122.728 2.285 . . . . 0.0 113.272 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . 0.646 ' HD2' ' CE2' ' X' ' 38' ' ' TYR . 78.3 mtm180 -93.2 -33.93 13.8 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.996 -0.547 . . . . 0.0 112.315 -179.583 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.493 HD22 ' HB2' ' X' ' 14' ' ' LEU . 83.8 mt -97.82 -19.02 18.41 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 122.212 -0.305 . . . . 0.0 111.019 -176.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.421 ' O ' HD13 ' X' ' 11' ' ' ILE . 0.3 OUTLIER -75.54 -9.9 13.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 107.889 -1.152 . . . . 0.0 107.889 170.826 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -96.44 -58.28 2.1 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.397 -1.274 . . . . 0.0 110.549 171.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . 0.426 ' HA ' HG23 ' X' ' 40' ' ' ILE . 45.9 t -96.35 -24.9 15.95 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 -167.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.493 ' HB2' HD22 ' X' ' 10' ' ' LEU . 9.8 tt -95.77 -43.87 7.68 Favored 'General case' 0 CA--C 1.508 -0.659 0 CA-C-N 118.997 0.817 . . . . 0.0 109.823 -176.566 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.601 ' HA ' ' HB3' ' X' ' 18' ' ' LEU . 61.4 p -74.91 -9.78 58.87 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.968 -178.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 5.1 tm0? -57.45 -60.54 3.5 Favored 'General case' 0 C--N 1.339 0.111 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 174.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.843 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 0.6 OUTLIER -73.77 -29.08 61.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.654 178.614 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . 0.601 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 26.4 tp -61.77 -30.97 71.15 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.504 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 23.1 t -97.42 -34.18 11.13 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 120.586 0.231 . . . . 0.0 111.254 -177.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 81.1 mtp -79.61 -12.88 59.82 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -176.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.68 42.1 3.21 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.272 -0.966 . . . . 0.0 113.264 176.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.843 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 46.0 m-85 -129.16 161.13 30.81 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 174.448 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 55.0 m -139.77 -177.83 5.14 Favored 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.707 -178.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.568 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 6.2 p-10 -77.12 115.85 17.26 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.293 0.568 . . . . 0.0 109.983 175.347 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -86.11 59.68 5.78 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.117 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.73 -4.68 2.21 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.27 -0.967 . . . . 0.0 113.189 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . 0.404 ' HA2' ' OD2' ' X' ' 24' ' ' ASP . . . 86.09 21.04 53.95 Favored Glycine 0 N--CA 1.445 -0.744 0 C-N-CA 120.44 -0.886 . . . . 0.0 111.546 -177.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.615 ' HH2' HG23 ' X' ' 47' ' ' ILE . 46.2 p-90 -84.85 -10.74 56.84 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-O 119.625 -0.226 . . . . 0.0 111.432 -179.309 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.568 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 48.5 tp -59.01 -28.27 66.24 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.896 -0.503 . . . . 0.0 111.785 -170.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 28.9 m -94.37 -11.08 30.66 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-O 120.948 0.404 . . . . 0.0 111.118 174.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . 0.553 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 5.0 mtp-105 -96.04 -53.12 3.77 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.148 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 8.8 tp -64.85 -77.54 0.06 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.867 0.692 . . . . 0.0 112.867 -172.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.754 ' HA ' ' HB2' ' X' ' 36' ' ' LYS . 1.6 pp -69.4 -16.93 63.61 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -171.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . 0.456 ' N ' HD12 ' X' ' 33' ' ' LEU . 1.8 tp-100 -64.33 -33.75 76.57 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.5 0.191 . . . . 0.0 110.98 178.156 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 78.1 p -95.69 -16.88 21.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.972 0.415 . . . . 0.0 110.383 175.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . 0.754 ' HB2' ' HA ' ' X' ' 33' ' ' LEU . 43.9 mttp -87.81 38.71 0.85 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.603 177.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 43.73 40.08 2.85 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.842 0.857 . . . . 0.0 112.953 -178.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.646 ' CE2' ' HD2' ' X' ' 9' ' ' ARG . 72.8 m-85 58.74 71.35 0.59 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.713 173.368 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -125.59 142.43 51.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.736 0.779 . . . . 0.0 112.705 -179.168 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.806 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.1 OUTLIER -91.39 -3.98 10.69 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.27 173.594 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.12 -42.96 97.85 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.967 -178.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -94.17 -23.73 17.8 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.272 -0.464 . . . . 0.0 110.549 175.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.806 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -66.53 -32.57 74.0 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.093 178.355 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.608 HD12 HD11 ' X' ' 47' ' ' ILE . 3.3 tp -66.24 -35.87 81.53 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.236 0.541 . . . . 0.0 110.616 -179.513 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . 0.552 ' OD1' ' HA ' ' X' ' 50' ' ' SER . 18.9 t70 -69.1 -34.27 74.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.019 178.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 44.9 p -91.63 -24.31 19.58 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -174.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.615 HG23 ' HH2' ' X' ' 28' ' ' TRP . 5.7 pt -72.19 -26.14 24.49 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 C-N-CA 119.886 -0.726 . . . . 0.0 111.504 -176.444 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . 0.416 HE21 ' HB2' ' X' ' 48' ' ' GLN . 0.0 OUTLIER -173.94 -45.37 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 O-C-N 123.12 0.262 . . . . 0.0 111.081 178.679 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . 0.546 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 51.9 m-85 -84.47 76.25 10.17 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -173.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . 0.552 ' HA ' ' OD1' ' X' ' 45' ' ' ASP . 26.0 m -87.73 9.6 21.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.33 0.586 . . . . 0.0 110.608 175.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . 0.426 ' O ' ' HD2' ' X' ' 51' ' ' LYS . 0.0 OUTLIER -146.92 122.55 10.48 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.575 175.07 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 80.9 m-70 . . . . . 0 C--O 1.245 0.835 0 CA-C-O 118.302 -0.856 . . . . 0.0 110.469 -175.571 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.889 0 N-CA-C 112.082 -0.407 . . . . 0.0 112.082 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 29.6 m -125.33 110.15 26.46 Favored Pre-proline 0 C--N 1.328 -0.334 0 O-C-N 122.68 -0.306 . . . . 0.0 111.445 -179.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . 0.498 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 7.5 Cg_exo -69.04 137.24 37.06 Favored 'Trans proline' 0 C--N 1.343 0.279 0 C-N-CA 122.695 2.264 . . . . 0.0 110.95 175.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . 0.498 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 16.4 Cg_exo -71.07 17.2 0.27 Allowed 'Trans proline' 0 N--CA 1.475 0.411 0 C-N-CA 122.935 2.423 . . . . 0.0 114.081 -175.017 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -139.31 15.93 2.59 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.476 0.655 . . . . 0.0 109.687 173.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -162.64 46.55 0.15 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.843 -1.071 . . . . 0.0 108.726 178.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . 0.552 ' HB2' ' H ' ' X' ' 10' ' ' LEU . 2.9 m-20 -71.26 156.05 92.23 Favored Pre-proline 0 CA--C 1.505 -0.77 0 CA-C-N 114.895 -1.048 . . . . 0.0 108.622 178.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -58.44 -12.26 13.27 Favored 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 121.084 1.189 . . . . 0.0 110.489 169.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 37.3 mtp85 -93.34 -43.04 8.98 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 114.784 -1.098 . . . . 0.0 111.551 174.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.625 HD22 ' HB2' ' X' ' 14' ' ' LEU . 32.0 mt -88.13 -21.94 24.37 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -173.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.492 ' O ' ' HB3' ' X' ' 15' ' ' SER . 15.1 tt -69.52 -17.12 21.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 172.528 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 50.9 mm-40 -95.05 -64.95 1.01 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.684 173.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 13.2 m -81.6 -26.55 34.8 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -169.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.625 ' HB2' HD22 ' X' ' 10' ' ' LEU . 0.2 OUTLIER -94.98 -49.32 5.6 Favored 'General case' 0 CA--C 1.506 -0.741 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 -179.823 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.492 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 21.9 t -62.59 -27.03 68.91 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.521 -176.639 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . 0.408 ' O ' ' HB2' ' X' ' 20' ' ' MET . 4.7 tm0? -51.14 -49.24 61.23 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 120.938 0.399 . . . . 0.0 110.662 176.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.798 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 10.5 ptm -97.96 -31.45 12.16 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.828 -176.186 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 29.2 tp -64.35 -31.94 73.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.822 0.344 . . . . 0.0 111.071 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 15.8 m -98.73 -7.52 27.56 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.443 -178.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . 0.432 ' HA ' ' CE ' ' X' ' 20' ' ' MET . 0.1 OUTLIER -92.63 -31.66 15.06 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.841 0.353 . . . . 0.0 110.808 -179.122 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.58 31.49 2.14 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.671 -0.776 . . . . 0.0 111.826 -176.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.798 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 20.4 m-30 -116.46 155.97 27.66 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 175.362 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -140.04 -159.43 0.96 Allowed 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 120.101 -0.639 . . . . 0.0 110.261 -179.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.997 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 18.8 p-10 -85.93 114.73 23.07 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 121.396 0.617 . . . . 0.0 109.542 172.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . 0.516 ' HB2' ' HE1' ' X' ' 28' ' ' TRP . 5.7 mm-40 -84.01 54.42 2.92 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.571 -178.344 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 139.77 -17.23 3.03 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.405 -177.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 111.65 7.69 23.65 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.173 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.761 ' HH2' HG23 ' X' ' 47' ' ' ILE . 51.7 p-90 -83.55 -22.26 32.45 Favored 'General case' 0 C--O 1.208 -1.112 0 CA-C-O 119.087 -0.483 . . . . 0.0 111.992 -178.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.997 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 11.6 tp -50.13 -34.67 22.97 Favored 'General case' 0 N--CA 1.476 0.872 0 CA-C-N 118.898 0.772 . . . . 0.0 111.577 -174.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.53 -30.24 52.71 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 175.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 16.4 mtp180 -92.36 -55.52 3.38 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -175.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . 0.453 ' HB3' HD12 ' X' ' 33' ' ' LEU . 2.8 tm? -43.15 -59.89 1.88 Allowed 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.29 1.036 . . . . 0.0 111.996 -178.267 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.782 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.8 mp -70.58 -36.67 73.72 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.569 -174.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -52.63 -46.74 67.22 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -173.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 22.5 p -77.76 -12.09 59.94 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.801 0.334 . . . . 0.0 111.694 -178.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 50.1 mttp -112.51 37.66 2.99 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.114 -178.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 41.62 39.77 1.22 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.628 0.771 . . . . 0.0 112.172 -177.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.782 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 31.2 m-85 66.94 77.76 0.27 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.907 -179.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -106.19 126.7 52.54 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.675 179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.585 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -90.22 -12.97 9.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 120.932 0.396 . . . . 0.0 110.201 172.208 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -60.22 -41.13 98.13 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.631 179.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.87 -17.43 21.11 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.751 0.31 . . . . 0.0 111.085 177.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.585 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -69.97 -42.97 72.43 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.658 177.207 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.739 HD12 HD11 ' X' ' 47' ' ' ILE . 8.9 mp -62.47 -27.34 69.06 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.085 -178.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . 0.481 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 33.5 t70 -55.13 -39.6 69.61 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.814 0.34 . . . . 0.0 111.709 179.026 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 1.1 p -95.99 -24.48 16.35 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 -177.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.761 HG23 ' HH2' ' X' ' 28' ' ' TRP . 8.3 pt -82.78 44.66 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 178.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 82.68 25.5 0.15 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.135 0.974 . . . . 0.0 113.14 171.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . 0.481 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 66.2 m-85 -141.6 63.99 1.41 Allowed 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 110.34 -0.244 . . . . 0.0 110.34 174.098 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 2.6 t -81.79 8.95 8.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.953 0.406 . . . . 0.0 112.053 -174.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -134.34 25.77 3.81 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.63 173.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 12.8 p80 . . . . . 0 C--O 1.247 0.924 0 O-C-N 124.593 1.183 . . . . 0.0 112.816 -178.406 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.735 0 N-CA-C 112.155 -0.378 . . . . 0.0 112.155 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 65.7 m -72.06 133.79 83.56 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.571 0.224 . . . . 0.0 110.787 179.035 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . 0.415 ' C ' ' H ' ' X' ' 5' ' ' GLU . 66.5 Cg_endo -76.73 151.91 32.4 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.21 1.94 . . . . 0.0 111.46 177.107 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.64 22.94 0.24 Allowed 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.71 2.273 . . . . 0.0 113.278 -177.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . 0.415 ' H ' ' C ' ' X' ' 3' ' ' PRO . 51.6 mt-10 -108.89 -0.28 19.83 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.389 0.614 . . . . 0.0 109.929 174.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -172.98 37.95 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.472 -1.24 . . . . 0.0 109.706 -178.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . 0.502 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 0.3 OUTLIER -67.35 152.86 95.75 Favored Pre-proline 0 CA--C 1.512 -0.505 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.026 177.248 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . 0.502 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 23.6 Cg_endo -59.45 -13.17 19.6 Favored 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 121.452 1.435 . . . . 0.0 110.574 171.486 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . 0.419 ' H ' ' HB3' ' X' ' 7' ' ' ASP . 36.5 mmt180 -93.78 -50.0 5.57 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.424 -1.262 . . . . 0.0 111.823 175.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.791 HD22 ' HB2' ' X' ' 14' ' ' LEU . 89.5 mt -94.68 -17.02 22.62 Favored 'General case' 0 C--O 1.217 -0.608 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -169.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.521 ' O ' ' HB2' ' X' ' 15' ' ' SER . 0.2 OUTLIER -65.91 -25.23 35.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 175.471 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -94.87 -42.58 8.62 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.508 174.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . 0.478 ' HA ' HG23 ' X' ' 40' ' ' ILE . 4.0 t -94.97 -36.98 11.36 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 -166.807 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.791 ' HB2' HD22 ' X' ' 10' ' ' LEU . 8.4 tt -94.63 -42.82 8.59 Favored 'General case' 0 CA--C 1.51 -0.558 0 CA-C-O 121.51 0.671 . . . . 0.0 109.209 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.549 ' HA ' ' HB3' ' X' ' 18' ' ' LEU . 46.3 m -64.8 -17.27 64.07 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.123 -179.299 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 8.4 tm0? -58.46 -63.04 1.42 Allowed 'General case' 0 N--CA 1.457 -0.12 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.116 175.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.861 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 0.9 OUTLIER -76.13 -25.24 55.15 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.799 -0.361 . . . . 0.0 111.172 179.884 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . 0.549 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 37.2 tp -61.54 -34.8 76.18 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 120.817 0.342 . . . . 0.0 110.865 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 29.9 p -89.07 -42.21 11.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.574 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 91.4 mmm -66.53 -32.81 74.4 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -176.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 109.83 46.37 0.9 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.218 -0.991 . . . . 0.0 111.931 -179.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.861 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 95.4 m-85 -130.63 172.21 12.2 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 175.679 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . 0.419 ' O ' HG22 ' X' ' 47' ' ' ILE . 50.2 m -155.27 -173.86 4.73 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.571 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 30.7 p30 -83.39 154.11 24.19 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.939 0.4 . . . . 0.0 110.125 172.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . 0.505 ' HG2' ' CD1' ' X' ' 28' ' ' TRP . 7.5 pt-20 -82.59 -7.41 59.65 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.197 -174.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -170.66 -28.91 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.713 -178.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . 0.455 ' HA2' ' OD2' ' X' ' 24' ' ' ASP . . . 148.39 31.09 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 119.983 -1.103 . . . . 0.0 112.937 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.848 ' HH2' HG23 ' X' ' 47' ' ' ILE . 40.4 p-90 -96.17 -13.89 23.19 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 178.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.576 HD21 ' HG ' ' X' ' 14' ' ' LEU . 30.4 tp -58.11 -15.2 8.65 Favored 'General case' 0 N--CA 1.472 0.641 0 O-C-N 122.019 -0.426 . . . . 0.0 111.584 -174.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 82.7 p -94.46 -56.35 2.84 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 121.823 -0.548 . . . . 0.0 110.614 169.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . 0.689 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -69.72 -51.4 34.65 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 113.643 0.979 . . . . 0.0 113.643 -174.761 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . 0.845 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 3.4 tm? -51.05 -54.79 21.61 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.757 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 10.8 mp -54.95 -60.12 3.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.825 177.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -40.0 -48.98 2.49 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 123.868 0.73 . . . . 0.0 112.556 -179.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 7.6 m -59.57 -51.28 70.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.022 -0.536 . . . . 0.0 112.017 -174.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.57 37.4 1.2 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 40.2 t30 61.98 61.01 1.43 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.4 176.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.757 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 81.0 m-85 43.9 52.86 6.5 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.351 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -82.37 130.74 35.17 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.46 -173.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.579 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.69 -12.2 9.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.058 169.688 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.51 -41.73 83.62 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.457 -0.877 . . . . 0.0 112.135 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -91.31 -19.57 22.82 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.339 -0.431 . . . . 0.0 110.943 177.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.531 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -71.58 -39.69 70.41 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.789 178.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.727 ' HA ' HG12 ' X' ' 47' ' ' ILE . 7.0 mp -65.55 -37.09 85.71 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.886 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -54.14 -35.92 62.76 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.233 176.189 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 7.4 p -96.25 -22.12 17.44 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -177.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.848 HG23 ' HH2' ' X' ' 28' ' ' TRP . 28.0 pt -83.97 42.78 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.8 -0.562 . . . . 0.0 111.715 176.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 72.85 20.46 3.59 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.405 0.682 . . . . 0.0 112.094 174.377 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . 0.497 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 9.7 m-30 -121.74 55.81 1.09 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 173.658 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 6.8 t -83.44 3.67 31.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.353 0.596 . . . . 0.0 110.673 -178.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . 0.447 ' C ' ' HD3' ' X' ' 51' ' ' LYS . 0.5 OUTLIER -156.75 129.41 7.65 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.006 -0.997 . . . . 0.0 108.551 173.128 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 . . . . . 0 C--O 1.247 0.93 0 CA-C-O 118.331 -0.842 . . . . 0.0 110.233 -178.522 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.665 0 N-CA-C 112.044 -0.422 . . . . 0.0 112.044 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 35.1 t -111.14 107.77 57.4 Favored Pre-proline 0 C--N 1.326 -0.423 0 O-C-N 122.817 -0.226 . . . . 0.0 110.679 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -71.14 117.26 5.06 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.599 2.199 . . . . 0.0 112.398 -178.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -90.03 28.64 0.43 Allowed 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 122.501 2.134 . . . . 0.0 112.679 -179.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . 0.573 ' HA ' ' HG ' ' X' ' 10' ' ' LEU . 26.0 tt0 63.84 12.77 7.0 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.871 0.843 . . . . 0.0 109.844 -173.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -138.4 30.13 2.4 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.599 -1.182 . . . . 0.0 107.995 173.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . 0.545 ' O ' HG12 ' X' ' 11' ' ' ILE . 23.6 t70 -80.27 154.54 74.55 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 113.35 -1.75 . . . . 0.0 107.901 178.359 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . 0.457 ' HD2' ' CG ' ' X' ' 7' ' ' ASP . 68.8 Cg_exo -49.31 -21.66 4.9 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 121.98 1.787 . . . . 0.0 112.461 177.693 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . 0.44 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 34.6 mmt180 -87.27 -26.62 23.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.35 177.31 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.573 ' HG ' ' HA ' ' X' ' 5' ' ' GLU . 4.4 mm? -98.01 -33.39 11.21 Favored 'General case' 0 C--O 1.222 -0.38 0 O-C-N 122.292 -0.255 . . . . 0.0 110.75 -175.653 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.545 HG12 ' O ' ' X' ' 7' ' ' ASP . 18.1 pt -68.97 -12.53 16.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 170.287 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -96.56 -66.49 0.9 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.148 173.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . 0.472 ' OG ' HG23 ' X' ' 40' ' ' ILE . 34.6 t -83.77 -23.23 31.62 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -170.163 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.464 ' HB2' HD12 ' X' ' 10' ' ' LEU . 2.6 tm? -92.51 -42.53 9.66 Favored 'General case' 0 CA--C 1.508 -0.665 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 177.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.527 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 43.9 t -62.75 -24.93 67.95 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.209 179.304 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . 0.458 ' HB3' HE21 ' X' ' 16' ' ' GLN . 0.0 OUTLIER -55.17 -43.57 74.41 Favored 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.908 0.385 . . . . 0.0 110.551 176.99 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.651 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 9.5 ptm -96.66 -27.78 14.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.545 -178.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . 0.479 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 35.6 tp -64.22 -40.5 96.18 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.942 0.401 . . . . 0.0 110.815 179.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 19.0 m -91.72 -4.51 54.99 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.71 -176.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 16.7 tpt -102.78 -33.24 9.45 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.379 -179.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.65 46.52 0.67 Allowed Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.211 -0.995 . . . . 0.0 112.266 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.651 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 47.5 m-85 -125.63 163.62 22.38 Favored 'General case' 0 CA--C 1.507 -0.695 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 175.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . 0.478 ' O ' HG22 ' X' ' 47' ' ' ILE . 41.4 m -145.82 171.09 15.3 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 120.426 -0.51 . . . . 0.0 109.95 -179.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.472 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.6 p30 -69.51 134.0 48.36 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.2 0.524 . . . . 0.0 110.628 177.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . 0.591 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 33.3 tt0 -87.18 55.54 3.6 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.546 0.688 . . . . 0.0 109.379 177.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 136.01 -95.05 0.24 Allowed Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.371 -0.832 . . . . 0.0 111.918 -176.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -166.73 29.78 0.19 Allowed Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.991 -0.623 . . . . 0.0 111.673 178.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.629 ' HH2' HG23 ' X' ' 47' ' ' ILE . 53.6 p-90 -92.96 -14.08 27.96 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -176.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.472 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 13.8 tp -57.1 -24.52 54.67 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -168.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 77.1 p -82.71 -48.56 10.73 Favored 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.298 170.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 31.8 mtt-85 -60.07 -57.97 10.56 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.977 -177.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -50.28 -51.12 47.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.064 -176.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.46 HD13 ' O ' ' X' ' 29' ' ' LEU . 11.0 mp -62.64 -64.31 0.96 Allowed 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.27 179.554 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -43.42 -43.11 5.06 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -178.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 28.0 m -64.65 -52.24 58.4 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -176.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . 0.631 ' HB2' ' HB2' ' X' ' 39' ' ' ASP . 0.0 OUTLIER -93.38 40.28 1.06 Allowed 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -176.638 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 5.7 p-10 44.29 51.11 7.65 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.324 0.649 . . . . 0.0 111.84 -176.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.44 ' CD2' ' HB3' ' X' ' 9' ' ' ARG . 57.8 m-85 64.37 73.39 0.43 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 114.467 -1.242 . . . . 0.0 111.003 178.147 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . 0.631 ' HB2' ' HB2' ' X' ' 36' ' ' LYS . 2.5 t0 -97.35 117.72 32.23 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.045 -0.979 . . . . 0.0 111.127 -176.379 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.586 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -89.1 -18.38 7.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 121.102 0.477 . . . . 0.0 109.791 171.367 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.18 -34.12 89.08 Favored Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.543 179.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -100.01 -20.61 15.99 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.729 0.3 . . . . 0.0 111.282 177.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.471 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -72.47 -36.22 68.41 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.45 179.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.72 ' HA ' HG12 ' X' ' 47' ' ' ILE . 7.0 mp -63.68 -31.64 72.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.098 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . 0.564 ' HB2' ' HE1' ' X' ' 52' ' ' HIS . 10.9 t70 -55.18 -48.71 73.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.949 177.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 3.3 p -85.98 -5.61 59.19 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 -177.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.72 HG12 ' HA ' ' X' ' 44' ' ' LEU . 30.1 pt -106.24 43.3 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 O-C-N 121.902 -0.499 . . . . 0.0 111.272 175.151 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . 0.415 ' HB2' ' O ' ' X' ' 47' ' ' ILE . 1.1 mp0 85.05 22.86 0.09 Allowed 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.657 1.183 . . . . 0.0 113.308 173.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . 0.645 ' HE1' ' CZ ' ' X' ' 22' ' ' PHE . 32.2 m-85 -130.11 49.05 2.32 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 110.224 -0.288 . . . . 0.0 110.224 172.413 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 8.4 t -75.74 2.63 11.62 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.095 0.474 . . . . 0.0 111.611 -175.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 59.4 tttm -130.39 94.78 3.74 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.55 173.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . 0.564 ' HE1' ' HB2' ' X' ' 45' ' ' ASP . 59.2 m80 . . . . . 0 C--O 1.243 0.734 0 CA-C-O 118.321 -0.847 . . . . 0.0 110.375 -177.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.832 0 N-CA-C 112.296 -0.322 . . . . 0.0 112.296 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . 0.846 ' HB2' ' HA ' ' X' ' 7' ' ' ASP . 20.1 m -122.78 158.85 55.78 Favored Pre-proline 0 C--N 1.324 -0.511 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 179.517 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . 0.419 ' HD2' ' HB3' ' X' ' 2' ' ' SER . 29.9 Cg_endo -63.46 127.34 19.67 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.077 1.852 . . . . 0.0 110.894 177.4 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . 0.625 ' O ' ' HB2' ' X' ' 5' ' ' GLU . 87.7 Cg_exo -51.92 91.18 0.03 OUTLIER 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 123.388 2.726 . . . . 0.0 113.711 -174.423 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . 0.625 ' HB2' ' O ' ' X' ' 4' ' ' PRO . 60.5 tt0 156.93 -23.82 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.756 1.222 . . . . 0.0 108.892 179.042 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -130.26 31.99 4.54 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.259 -1.337 . . . . 0.0 110.397 179.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . 0.846 ' HA ' ' HB2' ' X' ' 2' ' ' SER . 1.2 m-20 -73.14 156.8 89.15 Favored Pre-proline 0 CA--C 1.509 -0.601 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.966 177.825 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -55.07 -12.76 5.5 Favored 'Trans proline' 0 CA--C 1.536 0.576 0 C-N-CA 121.307 1.338 . . . . 0.0 110.987 169.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 4.1 mtp180 -90.99 -49.13 6.59 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.01 177.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.517 HD22 ' HB2' ' X' ' 14' ' ' LEU . 53.9 mt -97.85 -17.55 19.24 Favored 'General case' 0 C--O 1.22 -0.491 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -173.168 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.608 ' O ' ' HB3' ' X' ' 15' ' ' SER . 0.5 OUTLIER -66.75 -21.33 28.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.876 0.846 . . . . 0.0 108.932 174.083 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -95.15 -45.83 7.04 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.584 175.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 8.1 t -94.05 -36.3 12.18 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -169.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.566 HD13 HD21 ' X' ' 29' ' ' LEU . 42.1 tp -92.71 -43.44 9.06 Favored 'General case' 0 CA--C 1.51 -0.582 0 O-C-N 121.682 -0.636 . . . . 0.0 109.791 179.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.608 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 33.4 t -61.43 -25.64 67.34 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.818 -175.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . 0.485 ' NE2' ' HB3' ' X' ' 17' ' ' MET . 4.2 pp0? -73.01 -30.58 63.87 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 120.584 -0.446 . . . . 0.0 111.21 179.22 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.781 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 23.7 ptp -90.14 -27.86 19.33 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.582 -0.447 . . . . 0.0 110.28 177.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 27.7 tp -63.93 -28.59 69.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.795 178.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 8.9 p -93.69 -44.21 8.28 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.901 -179.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 25.0 mmt -69.99 -24.09 63.26 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -175.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 103.82 47.39 1.27 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.087 -1.054 . . . . 0.0 112.555 -179.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.781 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 47.5 m-85 -127.06 144.5 51.01 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 176.274 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 14.3 m -144.39 169.95 16.95 Favored 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 119.855 -0.738 . . . . 0.0 111.233 -173.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.578 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 8.4 p-10 -71.73 131.19 42.76 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.798 173.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . 0.569 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 16.0 tp10 -69.21 -69.18 0.35 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.718 -177.475 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -97.47 -20.29 22.88 Favored Glycine 0 C--N 1.316 -0.539 0 C-N-CA 120.951 -0.643 . . . . 0.0 113.169 -179.236 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 124.52 32.67 0.81 Allowed Glycine 0 CA--C 1.507 -0.407 0 C-N-CA 120.537 -0.839 . . . . 0.0 111.211 -176.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.637 ' HH2' HG23 ' X' ' 47' ' ' ILE . 23.9 p-90 -96.15 -3.79 43.86 Favored 'General case' 0 C--O 1.217 -0.647 0 CA-C-N 115.173 -0.513 . . . . 0.0 111.452 -176.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.777 HD12 HD13 ' X' ' 33' ' ' LEU . 11.0 tp -60.19 -32.26 70.92 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 122.176 -0.328 . . . . 0.0 111.348 -172.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . 0.401 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 4.6 m -79.89 -15.39 57.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.965 0.412 . . . . 0.0 110.821 175.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . 0.547 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 11.3 mtm180 -96.33 -60.24 1.66 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.033 0.444 . . . . 0.0 111.168 -178.122 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -49.31 -72.63 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.773 -178.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.777 HD13 HD12 ' X' ' 29' ' ' LEU . 6.9 mp -56.75 -45.77 81.82 Favored 'General case' 0 C--O 1.221 -0.421 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.787 -174.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . 0.401 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.0 OUTLIER -49.59 -51.76 34.98 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -176.972 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 2.2 m -77.64 -7.44 56.41 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.073 0.463 . . . . 0.0 111.107 -177.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -115.06 37.83 3.37 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.362 179.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 11.7 p30 49.74 33.04 5.73 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.02 0.928 . . . . 0.0 112.777 179.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.505 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 67.8 m-85 63.83 70.15 0.52 Allowed 'General case' 0 C--O 1.234 0.267 0 C-N-CA 122.955 0.502 . . . . 0.0 110.818 178.196 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 44.7 p-10 -111.42 141.04 45.49 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.683 0.754 . . . . 0.0 112.72 -178.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.577 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -92.6 -6.17 10.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.385 170.244 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.21 -44.19 76.83 Favored Glycine 0 CA--C 1.505 -0.565 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.435 -177.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.84 -18.49 20.33 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 120.827 0.346 . . . . 0.0 110.831 177.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.577 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -71.63 -31.92 67.4 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.778 177.797 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.806 HD12 HD11 ' X' ' 47' ' ' ILE . 6.1 tp -65.14 -31.54 72.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.111 0.481 . . . . 0.0 110.443 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -73.94 -27.55 61.07 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.847 178.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 22.9 p -97.15 -31.12 12.63 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 -175.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.806 HD11 HD12 ' X' ' 44' ' ' LEU . 2.1 pt -64.63 -26.93 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -171.368 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -167.74 -39.09 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 120.77 0.319 . . . . 0.0 111.077 177.024 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 60.2 m-85 -78.87 -159.22 0.17 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.94 -177.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 17.1 p -178.73 41.76 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.297 -179.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -138.96 16.22 2.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.049 0.452 . . . . 0.0 110.791 -175.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 . . . . . 0 C--O 1.245 0.819 0 CA-C-O 118.281 -0.866 . . . . 0.0 111.549 179.596 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.829 0 N-CA-C 112.3 -0.32 . . . . 0.0 112.3 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 5.1 p -83.91 113.13 45.68 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 120.667 0.27 . . . . 0.0 110.613 178.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . 0.701 ' HG2' ' HB3' ' X' ' 6' ' ' ALA . 71.8 Cg_endo -86.23 142.44 7.38 Favored 'Trans proline' 0 C--O 1.236 0.39 0 C-N-CA 122.427 2.085 . . . . 0.0 113.091 -175.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 4.5 Cg_exo -78.29 44.13 1.55 Allowed 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 123.455 2.77 . . . . 0.0 112.024 177.015 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -162.33 26.32 0.11 Allowed 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . 0.701 ' HB3' ' HG2' ' X' ' 3' ' ' PRO . . . -174.32 42.42 0.01 OUTLIER 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 -177.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -102.02 150.03 37.08 Favored Pre-proline 0 C--N 1.317 -0.822 0 CA-C-N 114.191 -1.368 . . . . 0.0 108.127 -176.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_exo -45.24 -25.87 2.15 Favored 'Trans proline' 0 CA--C 1.539 0.733 0 C-N-CA 122.33 2.02 . . . . 0.0 113.11 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 50.5 mtp85 -92.95 -35.0 13.54 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 178.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 97.1 mt -88.28 -18.03 29.43 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 116.8 -0.182 . . . . 0.0 110.81 -177.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.481 ' HA ' ' HB2' ' X' ' 15' ' ' SER . 0.4 OUTLIER -63.83 -26.04 39.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.639 0.733 . . . . 0.0 109.272 171.318 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . 0.555 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 5.3 mm-40 -85.81 -45.24 11.77 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.368 176.596 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . 0.579 ' HB2' HD23 ' X' ' 33' ' ' LEU . 11.2 p -96.09 -43.14 7.9 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 113.858 1.058 . . . . 0.0 113.858 -169.44 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.592 ' HG ' HD11 ' X' ' 29' ' ' LEU . 2.9 tt -93.09 -45.44 7.9 Favored 'General case' 0 CA--C 1.508 -0.645 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 -176.224 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.481 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 33.1 m -68.5 -14.56 63.09 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.414 179.532 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . 0.555 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 0.7 OUTLIER -62.3 -65.95 0.61 Allowed 'General case' 0 CA--C 1.519 -0.218 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 171.106 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.488 ' CB ' ' HB2' ' X' ' 22' ' ' PHE . 70.5 mtm -62.71 -39.46 94.08 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.874 -179.051 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 30.0 tp -61.09 -34.4 74.87 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -177.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 27.8 t -94.99 -8.44 36.9 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.602 0.239 . . . . 0.0 111.563 -177.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 50.5 tpp -101.74 -31.81 10.6 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.495 -178.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.26 34.31 1.64 Allowed Glycine 0 CA--C 1.511 -0.214 0 C-N-CA 120.581 -0.818 . . . . 0.0 111.501 -177.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.508 ' HB3' HD12 ' X' ' 47' ' ' ILE . 4.5 m-85 -121.76 138.77 54.23 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 176.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 68.8 m -134.83 -128.15 0.16 Allowed 'General case' 0 C--N 1.31 -1.138 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.687 -176.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.589 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.6 p30 -120.98 136.96 54.86 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.751 173.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . 0.413 ' HB2' ' HE1' ' X' ' 28' ' ' TRP . 23.2 tt0 -68.46 -38.49 81.13 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.002 0.429 . . . . 0.0 110.385 -177.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -144.15 -0.14 1.07 Allowed Glycine 0 CA--C 1.519 0.33 0 C-N-CA 120.739 -0.743 . . . . 0.0 113.57 -178.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 123.09 28.67 1.33 Allowed Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.49 -0.862 . . . . 0.0 112.253 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.812 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 32.9 p-90 -96.53 -8.76 31.16 Favored 'General case' 0 C--O 1.218 -0.597 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -178.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.592 HD11 ' HG ' ' X' ' 14' ' ' LEU . 20.3 tp -65.48 -17.39 64.52 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.069 0.461 . . . . 0.0 110.342 -176.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -93.8 -16.34 24.23 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.799 172.052 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . 0.428 ' HD3' ' HA ' ' X' ' 28' ' ' TRP . 19.8 mtp85 -97.33 -66.07 0.92 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.213 0.53 . . . . 0.0 112.106 -177.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -46.92 -73.47 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 114.093 -1.412 . . . . 0.0 112.682 -172.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.678 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.8 mp -50.49 -51.94 42.74 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-O 121.027 0.441 . . . . 0.0 111.346 -174.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 15.0 mp0 -50.67 -38.55 47.19 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.69 -178.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 5.3 m -86.46 -6.77 58.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.986 0.422 . . . . 0.0 110.993 -177.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -125.41 38.83 4.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.891 -177.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 10.1 p30 56.91 22.45 7.15 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.247 1.019 . . . . 0.0 113.061 178.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.678 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 15.1 m-85 72.34 73.25 0.15 Allowed 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.608 0.763 . . . . 0.0 110.11 177.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 45.4 p-10 -115.11 142.92 45.99 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.558 0.694 . . . . 0.0 112.581 -177.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.612 HD13 ' H ' ' X' ' 40' ' ' ILE . 0.1 OUTLIER -91.54 -19.5 7.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.082 173.09 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.12 -39.42 97.61 Favored Glycine 0 CA--C 1.506 -0.526 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.598 -177.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . 0.446 ' O ' ' HB3' ' X' ' 45' ' ' ASP . . . -96.39 -10.36 27.8 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.47 -0.365 . . . . 0.0 110.642 176.627 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.527 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -73.69 -47.4 39.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.039 178.11 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . . . . . . . . . 10.7 mp -58.81 -33.55 70.5 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.72 0.295 . . . . 0.0 110.616 177.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . 0.446 ' HB3' ' O ' ' X' ' 42' ' ' ALA . 15.4 t0 -55.19 -45.78 75.83 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.197 175.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 1.2 p -86.13 -6.04 59.09 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 114.187 1.18 . . . . 0.0 114.187 -171.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.812 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 0.1 OUTLIER -109.58 -26.78 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-N 119.371 0.987 . . . . 0.0 112.893 178.685 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . 0.635 ' NE2' ' HB ' ' X' ' 47' ' ' ILE . 1.5 mp0 -155.59 -44.75 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.83 0.347 . . . . 0.0 111.54 -176.747 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -84.01 49.86 1.72 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.29 -174.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 14.0 p -82.55 2.94 30.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.354 0.597 . . . . 0.0 110.961 178.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -117.81 124.72 49.07 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.774 -1.103 . . . . 0.0 108.026 172.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 54.3 m-70 . . . . . 0 C--O 1.243 0.734 0 CA-C-O 118.333 -0.841 . . . . 0.0 110.632 -173.92 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.777 0 N-CA-C 111.847 -0.501 . . . . 0.0 111.847 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . 0.419 ' HA ' ' HD3' ' X' ' 3' ' ' PRO . 67.9 m -106.74 148.01 36.07 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-O 120.857 0.36 . . . . 0.0 111.333 -178.156 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' X' ' 2' ' ' SER . 4.3 Cg_exo -75.52 154.51 40.14 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.953 2.436 . . . . 0.0 111.901 178.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -74.25 21.66 0.39 Allowed 'Trans proline' 0 CA--C 1.532 0.39 0 C-N-CA 122.412 2.075 . . . . 0.0 112.777 177.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . 0.403 ' H ' ' C ' ' X' ' 3' ' ' PRO . 13.6 mp0 -137.6 12.05 2.96 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.505 175.212 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -166.81 50.72 0.07 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.227 -177.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . 0.516 ' H ' ' HB2' ' X' ' 10' ' ' LEU . 0.3 OUTLIER -85.83 155.48 58.6 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-N 114.823 -1.081 . . . . 0.0 109.24 -178.924 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -60.65 -14.31 30.63 Favored 'Trans proline' 0 CA--C 1.533 0.434 0 C-N-CA 121.144 1.229 . . . . 0.0 110.293 170.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 80.2 mtm180 -93.73 -30.67 14.76 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.245 175.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.516 ' HB2' ' H ' ' X' ' 7' ' ' ASP . 96.5 mt -98.44 -18.43 18.25 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -174.597 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.485 ' O ' ' HB3' ' X' ' 15' ' ' SER . 44.8 mm -68.35 -16.24 20.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 170.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . 0.569 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 38.2 tt0 -93.4 -54.79 3.54 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.253 174.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . 0.418 ' HA ' HG23 ' X' ' 40' ' ' ILE . 22.8 t -94.49 -27.94 15.72 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.452 0.908 . . . . 0.0 113.452 -169.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . . . . . . . . . 9.3 tt -94.5 -47.6 6.48 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 -179.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.485 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 35.1 t -62.87 -28.82 70.3 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.094 -179.397 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . 0.569 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 0.0 OUTLIER -50.11 -43.08 51.51 Favored 'General case' 0 N--CA 1.463 0.186 0 O-C-N 123.507 0.505 . . . . 0.0 110.993 178.326 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.806 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 18.9 ptp -99.26 -30.46 12.23 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.736 -176.05 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -65.44 -33.91 77.06 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -176.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 57.6 p -98.78 -12.16 21.16 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -178.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 12.3 tpt -88.04 -23.84 23.64 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.046 -178.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.93 44.93 0.72 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.621 179.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.806 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 4.0 m-85 -116.77 -174.26 2.54 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 176.36 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . 0.557 ' O ' HG21 ' X' ' 47' ' ' ILE . 50.6 m -150.47 -161.03 1.25 Allowed 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.126 -0.63 . . . . 0.0 111.143 178.143 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.479 ' HA ' ' HE1' ' X' ' 28' ' ' TRP . 7.6 t70 -116.63 123.99 48.68 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 177.056 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -119.24 78.98 1.35 Allowed 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 120.829 0.347 . . . . 0.0 110.493 -177.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 124.74 -6.79 8.38 Favored Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.524 -0.846 . . . . 0.0 113.831 176.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.37 12.16 63.43 Favored Glycine 0 C--O 1.23 -0.13 0 C-N-CA 120.61 -0.805 . . . . 0.0 111.663 -177.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.712 ' HE3' ' HB3' ' X' ' 32' ' ' LEU . 31.2 p-90 -65.1 -34.52 78.6 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-N 115.127 -0.537 . . . . 0.0 111.572 -179.116 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . . . . . . . . . 51.8 tp -55.11 -22.5 16.78 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -165.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 51.2 p -94.66 -32.52 13.35 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.697 -0.627 . . . . 0.0 111.774 175.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . 0.44 ' CG ' ' HA ' ' X' ' 28' ' ' TRP . 31.8 ptt180 -94.22 -40.1 10.18 Favored 'General case' 0 CA--C 1.537 0.442 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -173.286 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . 0.712 ' HB3' ' HE3' ' X' ' 28' ' ' TRP . 2.9 tm? -61.91 -56.27 21.04 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 123.401 0.68 . . . . 0.0 110.24 -178.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 10.5 mp -55.06 -50.4 69.21 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.504 177.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -47.35 -53.24 14.26 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.421 -177.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 19.7 m -73.62 -23.98 59.97 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.918 0.39 . . . . 0.0 110.966 -178.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . 0.53 ' HB3' ' HB3' ' X' ' 39' ' ' ASP . 14.7 mptt -95.33 33.67 1.54 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.515 178.27 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 15.0 p30 46.73 35.5 3.15 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.519 0.728 . . . . 0.0 112.446 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . . . . . . . . . 72.3 m-85 66.94 69.9 0.39 Allowed 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.364 0.666 . . . . 0.0 110.038 -178.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . 0.53 ' HB3' ' HB3' ' X' ' 36' ' ' LYS . 30.2 t70 -121.9 137.6 54.72 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.449 -173.272 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.756 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -90.43 -8.5 10.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.735 173.096 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . 0.419 ' H ' ' CG ' ' X' ' 39' ' ' ASP . . . -62.85 -48.35 81.61 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.124 -177.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -93.48 -10.56 34.56 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.898 -0.651 . . . . 0.0 110.818 175.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.756 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -68.29 -47.55 67.32 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.674 -179.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.414 HD13 ' O ' ' X' ' 40' ' ' ILE . 10.3 mp -71.57 -20.2 62.04 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.843 -0.343 . . . . 0.0 111.119 -178.408 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -70.45 -23.05 62.64 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.431 -178.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 33.0 p -95.3 -23.55 17.16 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -174.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.62 ' O ' ' HG3' ' X' ' 48' ' ' GLN . 1.7 pt -102.8 -26.75 3.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 114.426 1.269 . . . . 0.0 114.426 -172.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . 0.62 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.7 mt-30 -157.31 -53.36 0.07 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 118.351 0.523 . . . . 0.0 111.412 -176.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . 0.432 ' O ' ' HB2' ' X' ' 50' ' ' SER . 15.3 m-85 -78.07 175.98 9.61 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 176.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . 0.432 ' HB2' ' O ' ' X' ' 49' ' ' TYR . 2.1 t 174.75 71.98 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 176.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 46.7 tttm -162.32 143.64 10.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.006 -176.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 37.8 m80 . . . . . 0 C--N 1.32 -0.693 0 CA-C-O 118.739 -0.648 . . . . 0.0 109.757 175.937 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.985 0 N-CA-C 112.287 -0.325 . . . . 0.0 112.287 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 26.6 m -83.1 157.89 65.21 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 110.323 -0.251 . . . . 0.0 110.323 179.231 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -92.31 170.91 2.58 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 122.536 2.158 . . . . 0.0 112.446 -175.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . 1.06 ' HB2' ' HB2' ' X' ' 7' ' ' ASP . 23.4 Cg_exo -61.52 159.21 32.9 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.397 2.064 . . . . 0.0 111.766 176.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -77.04 93.14 3.8 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.179 -174.124 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . 56.59 64.4 1.69 Allowed 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 121.807 0.813 . . . . 0.0 109.987 -176.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . 1.06 ' HB2' ' HB2' ' X' ' 4' ' ' PRO . 13.3 t70 -94.28 149.47 36.78 Favored Pre-proline 0 C--N 1.315 -0.904 0 CA-C-N 114.606 -1.179 . . . . 0.0 108.237 -178.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . 0.749 ' O ' ' HB2' ' X' ' 12' ' ' GLU . 63.2 Cg_exo -48.28 -13.37 0.23 Allowed 'Trans proline' 0 CA--C 1.537 0.645 0 C-N-CA 123.022 2.482 . . . . 0.0 113.033 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . 0.449 ' HB3' ' CD1' ' X' ' 38' ' ' TYR . 10.4 mmt-85 -71.5 -48.81 46.61 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.394 173.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.548 HD22 ' HB2' ' X' ' 14' ' ' LEU . 24.3 mt -100.08 -41.16 7.26 Favored 'General case' 0 C--O 1.222 -0.366 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -178.2 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.621 ' O ' ' HB3' ' X' ' 15' ' ' SER . 11.2 tt -63.01 -22.3 30.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.1 0.476 . . . . 0.0 110.112 -179.057 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . 0.749 ' HB2' ' O ' ' X' ' 8' ' ' PRO . 0.4 OUTLIER -94.26 -59.58 1.92 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.809 172.378 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . 0.434 ' HB2' ' O ' ' X' ' 9' ' ' ARG . 49.4 m -85.62 -25.72 26.48 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -169.24 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.548 ' HB2' HD22 ' X' ' 10' ' ' LEU . 10.4 tt -93.0 -40.7 10.4 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 108.453 -0.943 . . . . 0.0 108.453 178.637 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.621 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 32.1 t -68.08 -16.65 64.11 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.022 -0.99 . . . . 0.0 110.867 177.211 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . 0.539 ' O ' ' HB2' ' X' ' 20' ' ' MET . 0.0 OUTLIER -55.24 -45.4 76.04 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.067 0.461 . . . . 0.0 110.316 174.464 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.668 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 15.0 ptm -99.9 -20.29 16.21 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.668 -176.305 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . 0.451 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 46.0 tp -60.12 -49.34 78.02 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.772 0.32 . . . . 0.0 111.005 -179.459 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 16.0 p -98.86 9.26 43.83 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -178.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . 0.539 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 27.4 ttt -91.43 -28.33 17.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.035 0.445 . . . . 0.0 111.022 -178.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.35 34.55 1.59 Allowed Glycine 0 N--CA 1.445 -0.746 0 C-N-CA 120.572 -0.823 . . . . 0.0 111.179 -174.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.668 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 14.9 m-30 -117.83 -174.72 2.69 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 107.73 -1.211 . . . . 0.0 107.73 175.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 71.7 p -161.38 -163.35 0.99 Allowed 'General case' 0 C--N 1.316 -0.85 0 C-N-CA 119.621 -0.832 . . . . 0.0 111.043 -178.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.634 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 0.7 OUTLIER -112.64 115.18 28.17 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 166.882 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . 0.563 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 62.9 tt0 -51.65 -34.88 39.88 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.007 -175.607 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -124.16 -68.65 0.21 Allowed Glycine 0 C--N 1.318 -0.465 0 N-CA-C 111.24 -0.744 . . . . 0.0 111.24 173.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -176.31 29.97 0.08 OUTLIER Glycine 0 CA--C 1.508 -0.379 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 177.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.759 ' HH2' HG23 ' X' ' 47' ' ' ILE . 45.7 p-90 -97.33 -9.73 26.95 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.869 0.692 . . . . 0.0 112.869 -172.281 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.634 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 12.5 tp -52.52 -25.71 11.07 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -169.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . 0.456 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 32.1 p -84.44 -55.9 3.91 Favored 'General case' 0 C--N 1.322 -0.604 0 O-C-N 121.876 -0.515 . . . . 0.0 110.421 170.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.4 -51.9 50.63 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.785 -177.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -51.26 -60.36 3.21 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 123.266 0.626 . . . . 0.0 111.114 -177.319 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.462 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 8.8 mp -62.86 -44.83 95.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.134 -179.114 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.8 OUTLIER -49.47 -47.06 48.68 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.347 0.499 . . . . 0.0 112.347 -178.45 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 4.7 m -80.8 -23.92 38.91 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.957 0.408 . . . . 0.0 111.25 -176.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -102.5 39.72 1.47 Allowed 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -175.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 12.2 p30 50.4 29.32 3.81 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.728 0.811 . . . . 0.0 112.512 179.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.462 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 92.6 m-85 71.27 71.46 0.18 Allowed 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.825 177.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 36.0 t0 -114.52 130.16 56.72 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.891 -174.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.565 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -90.92 -17.9 7.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.077 169.87 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.26 -34.78 90.28 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.219 179.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -98.82 -15.68 19.16 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.38 -0.41 . . . . 0.0 111.002 176.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.565 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -72.48 -38.94 68.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.939 0.4 . . . . 0.0 110.777 178.623 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.547 HD22 ' CE1' ' X' ' 52' ' ' HIS . 9.0 mp -76.75 -18.3 58.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.486 178.2 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -69.29 -34.73 75.16 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.547 175.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 7.1 p -95.75 -6.04 40.65 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -174.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.759 HG23 ' HH2' ' X' ' 28' ' ' TRP . 6.6 pt -100.2 -30.22 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 119.613 -0.835 . . . . 0.0 113.205 -179.378 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . 0.543 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.9 mp0 -165.79 -48.01 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.256 0.55 . . . . 0.0 110.595 -177.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -82.61 -165.96 1.18 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.977 -1.01 . . . . 0.0 110.53 -172.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 20.2 m -143.61 74.45 1.43 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 176.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 2.4 tppp? 66.68 45.36 2.0 Allowed 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 -174.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . 0.547 ' CE1' HD22 ' X' ' 44' ' ' LEU . 94.6 m-70 . . . . . 0 C--O 1.245 0.855 0 CA-C-N 114.248 -1.342 . . . . 0.0 110.675 -174.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.658 0 N-CA-C 111.734 -0.546 . . . . 0.0 111.734 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 20.2 m -95.13 110.03 47.9 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 116.788 0.294 . . . . 0.0 110.926 179.101 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . 0.436 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 27.0 Cg_exo -61.17 136.83 67.21 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.468 2.112 . . . . 0.0 111.288 178.771 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . 0.476 ' O ' HD22 ' X' ' 10' ' ' LEU . 23.3 Cg_exo -69.18 29.85 0.16 Allowed 'Trans proline' 0 CA--C 1.534 0.479 0 C-N-CA 122.977 2.451 . . . . 0.0 114.019 -174.543 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . 0.411 ' H ' ' C ' ' X' ' 3' ' ' PRO . 30.9 tt0 -140.16 9.29 2.3 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.801 0.81 . . . . 0.0 109.399 173.356 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -150.96 25.0 0.74 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.861 -1.063 . . . . 0.0 108.841 176.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -84.4 144.97 44.23 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 114.31 -1.313 . . . . 0.0 107.893 177.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -41.6 -26.77 0.42 Allowed 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 123.253 2.635 . . . . 0.0 113.764 -178.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . 0.524 ' HD2' ' CE2' ' X' ' 38' ' ' TYR . 83.9 mtm180 -83.45 -42.58 16.77 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 178.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.476 HD22 ' O ' ' X' ' 4' ' ' PRO . 3.9 mp -97.28 -17.08 20.02 Favored 'General case' 0 C--O 1.216 -0.659 0 O-C-N 122.277 -0.264 . . . . 0.0 111.55 -174.65 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.562 ' O ' ' HB3' ' X' ' 15' ' ' SER . 10.5 tt -73.93 -12.95 15.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 170.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -93.81 -50.23 5.45 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 114.396 -1.275 . . . . 0.0 110.761 174.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . 0.582 ' HA ' HG23 ' X' ' 40' ' ' ILE . 44.1 p -95.01 -34.09 12.47 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 113.629 0.974 . . . . 0.0 113.629 -171.236 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.522 ' HG ' HD11 ' X' ' 29' ' ' LEU . 6.4 tt -93.36 -44.54 8.23 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 -178.284 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.562 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 16.1 t -66.72 -21.72 66.07 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.924 -178.392 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 7.0 tm0? -56.54 -55.39 34.44 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.341 174.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.786 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 23.6 ptp -80.37 -26.91 38.36 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.926 -178.268 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . 0.436 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 33.5 tp -64.83 -29.38 70.34 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.03 0.443 . . . . 0.0 110.613 178.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 14.1 t -94.64 -14.23 25.1 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.892 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 35.9 tpp -96.05 -32.22 12.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.154 -176.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.27 38.0 1.16 Allowed Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.706 -0.759 . . . . 0.0 111.876 -179.163 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.786 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 51.8 m-85 -136.05 160.88 37.29 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 50.7 m -151.6 -161.95 1.43 Allowed 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.748 -0.381 . . . . 0.0 110.148 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.965 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 11.3 p-10 -69.17 120.63 15.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.926 0.394 . . . . 0.0 109.997 173.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 17.9 tt0 -102.64 58.25 0.79 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.447 0.641 . . . . 0.0 109.305 179.193 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 145.29 -8.1 1.63 Allowed Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.404 -176.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 96.82 15.48 39.5 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 121.193 -0.527 . . . . 0.0 111.847 -178.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.874 ' HH2' HG23 ' X' ' 47' ' ' ILE . 46.9 p-90 -95.7 -7.05 38.45 Favored 'General case' 0 C--O 1.221 -0.437 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -174.871 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.965 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 6.1 tp -59.06 -24.92 63.3 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.686 0.675 . . . . 0.0 111.11 -175.011 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 38.5 p -93.59 -40.2 10.41 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 121.853 -0.529 . . . . 0.0 110.855 170.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 15.8 mmm180 -60.61 -64.41 0.96 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.076 0.465 . . . . 0.0 111.339 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -53.22 -60.46 3.26 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.903 -178.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 10.9 mp -54.08 -68.01 0.22 Allowed 'General case' 0 C--O 1.224 -0.277 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.352 -174.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -47.71 -46.46 29.67 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -176.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 23.4 m -66.89 -33.02 74.69 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.7 0.286 . . . . 0.0 111.616 -178.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . 0.534 ' O ' ' HB2' ' X' ' 39' ' ' ASP . 5.6 mptp? -95.43 26.44 3.86 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 178.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 39.0 t30 62.82 50.1 3.43 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 121.238 0.542 . . . . 0.0 110.832 179.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.524 ' CE2' ' HD2' ' X' ' 9' ' ' ARG . 92.0 m-85 48.23 53.91 11.09 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.862 -179.623 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . 0.534 ' HB2' ' O ' ' X' ' 36' ' ' LYS . 1.8 t0 -93.27 128.78 39.4 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.394 -173.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.582 HG23 ' HA ' ' X' ' 13' ' ' SER . 0.0 OUTLIER -89.61 -12.01 9.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.413 171.829 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.97 -36.51 93.16 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.603 -179.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.02 -24.7 14.82 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.875 0.369 . . . . 0.0 110.988 177.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.577 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -64.84 -37.99 89.47 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.154 178.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.704 ' HA ' ' CG1' ' X' ' 47' ' ' ILE . 7.2 mp -68.28 -37.35 80.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.292 -178.319 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . 0.602 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 10.0 t70 -55.18 -37.32 66.91 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.832 0.349 . . . . 0.0 110.828 179.274 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 14.3 p -88.73 -29.05 20.11 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.874 HG23 ' HH2' ' X' ' 28' ' ' TRP . 24.6 pt -79.93 43.91 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 O-C-N 121.644 -0.66 . . . . 0.0 112.084 175.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 78.79 8.7 1.99 Allowed 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 172.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . 0.602 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 14.0 m-85 -105.3 55.34 0.69 Allowed 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 170.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 16.2 m -73.07 -6.62 46.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.117 0.484 . . . . 0.0 111.866 -174.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 72.0 tttt -125.74 -129.22 0.24 Allowed 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.26 -0.882 . . . . 0.0 108.929 173.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 6.8 p80 . . . . . 0 C--N 1.317 -0.839 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.457 177.347 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.749 0 N-CA-C 111.997 -0.441 . . . . 0.0 111.997 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 50.7 m -124.57 113.3 27.36 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-O 120.775 0.321 . . . . 0.0 111.157 179.278 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -69.56 140.16 42.76 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.373 2.049 . . . . 0.0 111.688 178.597 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -75.42 37.18 0.49 Allowed 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.522 2.148 . . . . 0.0 112.775 179.913 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -134.57 -5.9 2.54 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.247 -178.617 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -168.6 37.5 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.443 -178.157 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -86.0 145.91 41.94 Favored Pre-proline 0 C--N 1.32 -0.675 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 173.74 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -43.08 -26.79 0.83 Allowed 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.189 2.593 . . . . 0.0 113.191 -179.119 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . 0.506 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 69.1 mtt85 -80.03 -44.22 20.52 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.927 177.992 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.671 HD22 ' HB2' ' X' ' 14' ' ' LEU . 86.1 mt -98.07 -15.43 20.01 Favored 'General case' 0 C--O 1.217 -0.652 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -172.367 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.515 ' O ' ' HB2' ' X' ' 15' ' ' SER . 11.7 tt -71.8 -17.09 19.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 169.348 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 46.5 tp10 -94.46 -58.63 2.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.4 -1.273 . . . . 0.0 111.191 175.412 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 14.1 m -91.89 -22.66 19.95 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 -170.251 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.671 ' HB2' HD22 ' X' ' 10' ' ' LEU . 53.4 tp -94.3 -48.03 6.35 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 177.679 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.515 ' HB2' ' O ' ' X' ' 11' ' ' ILE . 45.0 m -66.89 -18.87 65.59 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.689 -176.345 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 5.0 tm0? -60.39 -49.19 78.55 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.161 0.505 . . . . 0.0 110.333 173.944 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.648 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 4.5 ppp? -91.31 -21.07 21.23 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.325 -177.04 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . 0.412 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 28.6 tp -69.62 -39.56 77.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.835 -179.985 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 21.0 p -72.7 -41.95 64.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.637 -179.571 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 15.5 tpt -71.61 -29.53 64.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.475 -176.198 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.48 47.23 1.7 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.041 -1.076 . . . . 0.0 112.066 -178.947 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.648 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 31.5 m-85 -106.96 172.2 6.95 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 174.345 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . 0.435 ' O ' HG22 ' X' ' 47' ' ' ILE . 10.7 m -148.24 169.95 18.96 Favored 'General case' 0 C--N 1.313 -1.009 0 C-N-CA 119.976 -0.69 . . . . 0.0 110.254 179.187 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.637 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 8.2 p-10 -71.24 140.92 50.58 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 170.98 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -116.35 65.85 0.71 Allowed 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.87 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 139.1 -3.56 2.78 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.662 -175.942 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 83.13 26.23 45.25 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.736 -0.745 . . . . 0.0 111.978 -179.575 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.775 ' HH2' HG23 ' X' ' 47' ' ' ILE . 55.0 p-90 -96.94 -17.93 19.79 Favored 'General case' 0 C--O 1.216 -0.683 0 CA-C-O 119.081 -0.485 . . . . 0.0 112.152 -176.353 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.637 ' HB2' ' HB3' ' X' ' 24' ' ' ASP . 35.3 tp -47.46 -45.55 26.01 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -168.303 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 30.2 p -69.05 -49.16 59.97 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.746 0.307 . . . . 0.0 110.878 176.017 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . 0.567 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 4.2 mtm180 -57.47 -60.59 3.42 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.617 -178.647 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . 0.479 ' O ' ' HB2' ' X' ' 36' ' ' LYS . 2.1 tm? -48.67 -55.03 12.46 Favored 'General case' 0 C--O 1.23 0.079 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.25 -178.543 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 92.6 mt -59.88 -67.7 0.36 Allowed 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.751 -178.373 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -43.19 -56.15 3.58 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -175.166 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 32.3 p -67.12 -27.54 67.41 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -175.917 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . 0.479 ' HB2' ' O ' ' X' ' 32' ' ' LEU . 1.9 tttm -97.45 37.55 1.35 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.171 179.951 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 43.1 45.83 4.75 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.483 0.713 . . . . 0.0 112.119 -176.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.506 ' CD2' ' HB3' ' X' ' 9' ' ' ARG . 24.4 m-85 56.84 68.28 0.88 Allowed 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.987 178.924 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -106.92 122.53 46.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.1 -178.651 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.656 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -89.85 -8.14 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.95 173.614 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.38 -43.0 97.73 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.214 177.666 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -94.45 -22.28 18.38 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.473 -0.364 . . . . 0.0 111.212 177.776 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.656 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -68.0 -38.83 83.1 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.792 178.741 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.779 HD12 HD11 ' X' ' 47' ' ' ILE . 6.9 mp -62.83 -33.26 74.86 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.654 -179.076 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . 0.474 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 18.9 t70 -53.15 -45.44 68.43 Favored 'General case' 0 C--N 1.33 -0.245 0 O-C-N 123.333 0.396 . . . . 0.0 111.468 178.272 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 3.2 p -96.45 -5.23 40.11 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 -176.124 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.779 HD11 HD12 ' X' ' 44' ' ' LEU . 23.6 pt -96.75 42.28 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 O-C-N 121.572 -0.705 . . . . 0.0 111.322 173.547 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 80.94 30.82 0.16 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.034 0.933 . . . . 0.0 112.634 174.453 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . 0.527 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 33.3 m-85 -136.03 56.3 1.83 Allowed 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 170.49 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 4.2 t -91.02 20.5 4.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.985 0.421 . . . . 0.0 111.282 -174.564 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 47.2 mttm -119.2 19.01 12.96 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.319 177.761 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 36.0 m170 . . . . . 0 C--O 1.244 0.806 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.823 -179.596 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . 0.498 ' O ' ' HD3' ' X' ' 3' ' ' PRO . . . . . . . . 0 N--CA 1.483 1.805 0 N-CA-C 112.003 -0.439 . . . . 0.0 112.003 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 24.6 m -106.79 98.36 20.75 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-O 120.685 0.278 . . . . 0.0 110.858 -179.285 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . 0.498 ' HD3' ' O ' ' X' ' 1' ' ' GLY . 1.4 Cg_endo -82.27 179.33 5.57 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 123.217 2.611 . . . . 0.0 110.227 175.981 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . 0.479 ' O ' ' HB2' ' X' ' 7' ' ' ASP . 78.2 Cg_exo -48.85 134.41 28.41 Favored 'Trans proline' 0 C--N 1.355 0.915 0 C-N-CA 121.936 1.757 . . . . 0.0 111.341 177.208 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . 0.448 ' O ' ' HB3' ' X' ' 6' ' ' ALA . 23.7 tt0 -78.41 107.97 11.43 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 -175.341 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . 0.448 ' HB3' ' O ' ' X' ' 5' ' ' GLU . . . 80.01 50.43 0.03 OUTLIER 'General case' 0 CA--C 1.513 -0.452 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 -168.067 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . 0.654 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 54.5 t0 -80.19 133.44 57.31 Favored Pre-proline 0 CA--C 1.506 -0.732 0 CA-C-N 113.693 -1.594 . . . . 0.0 107.521 177.916 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . 0.654 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 80.6 Cg_exo -40.56 -26.14 0.21 Allowed 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.908 2.405 . . . . 0.0 112.818 179.814 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 77.9 mtm180 -72.48 -53.03 13.26 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.41 175.263 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.498 ' HA ' ' HB3' ' X' ' 13' ' ' SER . 4.5 mp -95.72 -23.77 16.83 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -174.318 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.573 ' HA ' ' HB2' ' X' ' 15' ' ' SER . 0.0 OUTLIER -62.73 -28.01 44.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.76 0.79 . . . . 0.0 109.016 177.086 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' X' ' 16' ' ' GLN . 81.9 mt-10 -93.9 -22.09 18.83 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.576 174.937 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . 0.498 ' HB3' ' HA ' ' X' ' 10' ' ' LEU . 29.7 t -98.56 -61.03 1.43 Allowed 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -175.824 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.506 ' HG ' HD11 ' X' ' 29' ' ' LEU . 8.3 tt -92.58 -40.26 10.88 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-O 121.074 0.464 . . . . 0.0 109.749 -174.09 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.573 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 23.2 m -66.5 -26.91 67.39 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.644 -0.707 . . . . 0.0 112.009 -176.031 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' X' ' 12' ' ' GLU . 5.3 pp0? -69.3 -30.22 68.25 Favored 'General case' 0 C--O 1.228 -0.067 0 C-N-CA 120.695 -0.402 . . . . 0.0 111.046 -179.425 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.948 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 18.9 ptm -96.39 -32.95 12.1 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.25 -179.517 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 61.1 tp -55.13 -43.65 74.33 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 123.427 0.454 . . . . 0.0 111.592 -178.215 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 16.3 p -98.93 9.74 42.86 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -177.157 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 35.0 ttp -111.22 -12.85 14.07 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.63 -176.413 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 115.19 19.82 5.77 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.336 -0.935 . . . . 0.0 112.398 179.604 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.948 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 28.0 m-85 -116.63 163.11 16.6 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 107.734 -1.209 . . . . 0.0 107.734 170.892 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 47.5 m -154.65 -138.01 0.07 Allowed 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 120.201 -0.599 . . . . 0.0 109.919 179.96 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.773 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 25.0 p-10 -110.75 116.29 31.03 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.238 0.542 . . . . 0.0 110.907 176.298 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . 0.738 ' HG3' ' HA ' ' X' ' 47' ' ' ILE . 1.9 mm-40 -83.76 54.18 2.8 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.218 0.532 . . . . 0.0 110.9 177.631 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 136.08 2.65 2.67 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.561 -179.188 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . 0.459 ' HA2' ' OD2' ' X' ' 24' ' ' ASP . . . 87.86 13.6 64.35 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.645 179.39 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.77 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 42.4 p-90 -85.49 -13.24 49.72 Favored 'General case' 0 C--O 1.217 -0.657 0 O-C-N 122.629 -0.336 . . . . 0.0 111.046 179.64 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.773 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 54.5 tp -56.06 -24.26 38.63 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 120.836 -0.346 . . . . 0.0 111.366 -175.723 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 53.2 p -93.86 -21.81 19.02 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.793 -0.185 . . . . 0.0 111.43 176.339 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . 0.618 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 0.2 OUTLIER -95.02 -56.36 2.77 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 120.568 0.223 . . . . 0.0 111.528 -177.339 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -44.97 -68.85 0.16 Allowed 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 124.046 0.938 . . . . 0.0 112.063 -174.507 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.795 ' HB2' ' HA ' ' X' ' 38' ' ' TYR . 0.9 OUTLIER -67.59 -25.61 65.85 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.873 -0.331 . . . . 0.0 111.785 -176.153 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . 0.459 ' N ' HD12 ' X' ' 33' ' ' LEU . 0.8 OUTLIER -63.7 -31.43 72.6 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 122.21 -0.307 . . . . 0.0 111.685 179.481 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . 0.43 HG22 ' O ' ' X' ' 31' ' ' ARG . 4.9 t -99.26 -10.77 21.97 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 122.229 -0.294 . . . . 0.0 111.701 -179.214 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -114.39 39.92 2.66 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -174.868 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 16.3 p30 50.29 34.84 9.45 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.666 0.786 . . . . 0.0 112.025 -178.129 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.795 ' HA ' ' HB2' ' X' ' 33' ' ' LEU . 68.8 m-85 64.69 69.39 0.5 Allowed 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.786 178.512 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -93.26 107.21 19.07 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 113.972 -1.467 . . . . 0.0 111.176 -172.698 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.635 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.5 OUTLIER -92.24 -4.07 10.75 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.432 172.671 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -74.64 -34.23 54.15 Favored Glycine 0 N--CA 1.441 -1.014 0 C-N-CA 120.003 -1.094 . . . . 0.0 111.027 175.391 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.73 -25.0 15.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 114.778 -0.711 . . . . 0.0 110.979 177.327 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.689 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -64.52 -42.72 95.59 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.234 179.859 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.631 HD13 ' O ' ' X' ' 40' ' ' ILE . 10.9 mp -67.03 -27.68 67.6 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.909 179.614 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . 0.535 ' O ' ' HB2' ' X' ' 50' ' ' SER . 2.5 t70 -66.82 -58.01 5.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.193 174.798 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 21.2 p -61.9 -20.15 63.45 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 -174.064 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.77 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 1.8 pt -89.62 -30.05 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 C-N-CA 119.395 -0.922 . . . . 0.0 112.635 179.438 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . 0.631 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 1.5 mt-30 -163.28 -43.65 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 117.671 0.214 . . . . 0.0 111.542 -177.924 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -78.03 34.58 0.2 Allowed 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -172.737 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . 0.535 ' HB2' ' O ' ' X' ' 45' ' ' ASP . 1.1 t -98.19 36.47 1.58 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 175.493 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -155.05 141.8 18.99 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.98 -175.567 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 . . . . . 0 C--O 1.244 0.798 0 CA-C-O 118.312 -0.852 . . . . 0.0 110.551 -179.427 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.783 0 N-CA-C 112.322 -0.311 . . . . 0.0 112.322 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 15.0 m -79.89 119.18 75.85 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-O 120.576 0.227 . . . . 0.0 110.662 -178.997 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . 0.475 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 56.6 Cg_endo -72.73 128.5 13.42 Favored 'Trans proline' 0 N--CA 1.464 -0.241 0 C-N-CA 122.468 2.112 . . . . 0.0 112.275 -179.485 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 10.4 Cg_exo -71.7 24.08 0.24 Allowed 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 122.961 2.441 . . . . 0.0 113.309 -178.604 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -143.35 18.03 1.89 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.255 177.043 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . 0.417 ' HA ' ' HB ' ' X' ' 11' ' ' ILE . . . -170.17 15.19 0.02 OUTLIER 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.038 -177.692 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . 0.751 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 37.3 t0 -71.37 136.54 83.96 Favored Pre-proline 0 C--N 1.318 -0.77 0 N-CA-C 106.948 -1.501 . . . . 0.0 106.948 174.88 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . 0.751 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 78.5 Cg_exo -38.78 -28.48 0.14 Allowed 'Trans proline' 0 CA--C 1.534 0.507 0 C-N-CA 123.507 2.805 . . . . 0.0 113.186 -177.81 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 28.9 mmm180 -90.44 -50.55 5.89 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.958 176.15 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.712 HD22 ' HB2' ' X' ' 14' ' ' LEU . 96.0 mt -79.09 -15.22 58.48 Favored 'General case' 0 C--O 1.221 -0.446 0 N-CA-C 112.629 0.603 . . . . 0.0 112.629 -173.284 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.552 ' O ' ' HB3' ' X' ' 15' ' ' SER . 11.8 tt -69.59 -25.92 29.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 174.033 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . 0.555 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 48.4 mt-10 -95.9 -45.91 6.76 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.531 174.307 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . 0.467 ' HA ' HG23 ' X' ' 40' ' ' ILE . 20.4 m -89.67 -34.14 16.37 Favored 'General case' 0 C--O 1.222 -0.373 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -168.757 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.766 ' HG ' HD11 ' X' ' 29' ' ' LEU . 8.7 tt -95.94 -41.78 8.62 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-O 121.745 0.783 . . . . 0.0 109.017 -179.676 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.552 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 9.4 t -71.24 -16.08 62.47 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 114.73 -1.123 . . . . 0.0 111.243 -176.935 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . 0.555 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 3.8 tm0? -57.58 -58.77 6.84 Favored 'General case' 0 CA--C 1.521 -0.139 0 CA-C-O 120.786 0.327 . . . . 0.0 110.224 177.028 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 1.013 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 0.9 OUTLIER -82.91 -22.09 33.99 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.089 -179.298 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . 0.482 ' HB3' ' HA ' ' X' ' 15' ' ' SER . 29.4 tp -66.41 -34.79 78.75 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.773 0.32 . . . . 0.0 110.775 -179.376 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 10.7 m -98.63 -36.16 9.96 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.546 -176.811 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 26.6 ttt -68.33 -31.81 71.48 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -176.209 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.79 46.58 0.6 Allowed Glycine 0 CA--C 1.508 -0.38 0 C-N-CA 119.938 -1.125 . . . . 0.0 113.196 178.617 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 1.013 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 8.9 m-30 -111.97 -174.48 2.47 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 170.758 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 49.9 m -144.66 -161.28 1.26 Allowed 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 119.7 -0.8 . . . . 0.0 111.401 -179.109 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.561 ' HA ' ' CD1' ' X' ' 28' ' ' TRP . 10.5 t0 -115.28 121.23 42.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.422 -177.946 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . 0.553 ' OE2' ' HB ' ' X' ' 46' ' ' THR . 4.5 pt-20 -61.61 -25.02 67.08 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -178.214 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 148.63 30.91 0.06 OUTLIER Glycine 0 CA--C 1.519 0.311 0 C-N-CA 120.351 -0.928 . . . . 0.0 113.665 178.948 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . 0.564 ' O ' ' HB3' ' X' ' 31' ' ' ARG . . . 126.21 33.91 0.65 Allowed Glycine 0 N--CA 1.446 -0.7 0 C-N-CA 121.026 -0.606 . . . . 0.0 111.674 178.742 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.604 ' HE3' ' HB3' ' X' ' 32' ' ' LEU . 8.5 p-90 -97.67 -39.97 8.82 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-O 120.666 0.269 . . . . 0.0 110.98 -178.263 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.766 HD11 ' HG ' ' X' ' 14' ' ' LEU . 46.1 tp -69.83 -19.15 63.47 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 121.767 -0.583 . . . . 0.0 110.986 -166.45 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 1.7 t -95.0 -31.01 13.82 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.992 170.796 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . 0.564 ' HB3' ' O ' ' X' ' 27' ' ' GLY . 40.8 ttt180 -96.36 -62.26 1.3 Allowed 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -173.191 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . 0.604 ' HB3' ' HE3' ' X' ' 28' ' ' TRP . 2.8 tm? -50.62 -63.25 1.18 Allowed 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.441 0.696 . . . . 0.0 111.563 -176.472 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . . . . . . . . . 31.4 mt -45.77 -58.86 3.15 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 123.574 0.546 . . . . 0.0 111.739 -177.439 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -46.71 -58.78 3.53 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 123.83 0.707 . . . . 0.0 112.542 -178.947 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 60.9 p -62.5 -28.57 69.93 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.547 -176.889 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . 0.514 ' HB3' ' HB2' ' X' ' 39' ' ' ASP . 5.4 mptp? -94.63 39.3 1.1 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.548 176.606 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 31.82 53.12 0.24 Allowed 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.862 1.265 . . . . 0.0 113.744 -174.358 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 60.0 56.11 3.53 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.276 178.142 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . 0.514 ' HB2' ' HB3' ' X' ' 36' ' ' LYS . 24.5 m-20 -107.14 128.01 54.02 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.277 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.634 HD13 ' H ' ' X' ' 40' ' ' ILE . 0.1 OUTLIER -84.36 -3.13 7.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.732 169.239 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -69.67 -36.44 75.62 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.289 179.248 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.11 -12.49 20.45 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.951 0.405 . . . . 0.0 110.214 175.088 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.605 ' CB ' ' HA ' ' X' ' 40' ' ' ILE . . . -57.2 -53.22 60.52 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.821 -179.666 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.505 ' HG ' ' HE2' ' X' ' 22' ' ' PHE . 10.2 mp -61.35 -38.77 88.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.619 -179.258 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -52.16 -46.05 65.3 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.252 -179.654 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . 0.553 ' HB ' ' OE2' ' X' ' 25' ' ' GLU . 36.7 p -78.12 -35.11 49.53 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 113.459 0.911 . . . . 0.0 113.459 -171.44 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.544 HG12 ' O ' ' X' ' 43' ' ' ALA . 6.7 pt -96.25 -25.19 4.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 -168.999 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . 0.421 HE21 ' HB2' ' X' ' 48' ' ' GLN . 0.0 OUTLIER -153.64 -26.68 0.14 Allowed 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.687 0.625 . . . . 0.0 112.687 -178.207 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -101.33 54.7 0.83 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -178.284 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 17.3 m -92.12 8.24 38.77 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.72 -174.964 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . 0.684 ' HE2' ' HA ' ' X' ' 51' ' ' LYS . 10.0 mmpt? -130.75 133.13 45.76 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 176.041 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 60.1 t60 . . . . . 0 C--O 1.247 0.925 0 CA-C-O 118.491 -0.766 . . . . 0.0 110.596 -176.729 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.712 0 N-CA-C 112.219 -0.353 . . . . 0.0 112.219 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . 0.406 ' HA ' ' HD3' ' X' ' 3' ' ' PRO . 66.2 m -109.43 123.95 35.23 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 120.62 0.248 . . . . 0.0 110.777 179.759 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' X' ' 2' ' ' SER . 6.9 Cg_exo -73.42 133.93 19.9 Favored 'Trans proline' 0 CA--C 1.529 0.24 0 C-N-CA 122.795 2.33 . . . . 0.0 111.776 179.565 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -53.77 127.32 25.03 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 122.981 2.454 . . . . 0.0 112.931 -178.43 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 71.03 23.62 4.17 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 123.737 0.648 . . . . 0.0 110.953 -178.781 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -154.95 36.37 0.4 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 177.943 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . 0.454 ' O ' HG22 ' X' ' 11' ' ' ILE . 80.9 m-20 -70.38 155.49 93.35 Favored Pre-proline 0 CA--C 1.507 -0.703 0 CA-C-N 114.605 -1.18 . . . . 0.0 109.179 179.564 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -53.0 -18.37 9.45 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 122.134 1.889 . . . . 0.0 111.438 172.086 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 15.1 mmm180 -93.71 -35.82 12.61 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.901 -1.045 . . . . 0.0 111.353 179.744 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.684 HD22 ' HG ' ' X' ' 14' ' ' LEU . 63.9 mt -98.26 -25.33 14.9 Favored 'General case' 0 C--O 1.223 -0.342 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.792 -171.671 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.529 ' HA ' ' HB2' ' X' ' 15' ' ' SER . 10.6 tt -70.48 -14.53 18.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 171.032 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -96.58 -52.29 4.0 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.673 -1.148 . . . . 0.0 111.2 175.341 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 7.7 t -94.46 -32.71 13.4 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -168.963 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.684 ' HG ' HD22 ' X' ' 10' ' ' LEU . 32.3 mt -92.51 -39.16 11.54 Favored 'General case' 0 CA--C 1.506 -0.721 0 O-C-N 121.556 -0.715 . . . . 0.0 109.63 178.481 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.529 ' HB2' ' HA ' ' X' ' 11' ' ' ILE . 8.2 t -63.3 -22.31 66.8 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.519 -175.905 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . 0.482 HE21 ' HG3' ' X' ' 17' ' ' MET . 3.7 pp0? -72.73 -29.17 63.13 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 120.411 -0.516 . . . . 0.0 109.997 176.919 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.482 ' HG3' HE21 ' X' ' 16' ' ' GLN . 26.2 mtt -72.21 -40.13 68.06 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.325 171.886 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 11.1 mp -68.43 -14.13 62.79 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.453 178.911 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 2.8 t -98.92 -40.98 7.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.934 -178.389 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 83.8 mtp -83.92 -32.4 25.13 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -176.986 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.32 46.91 0.67 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.384 -0.912 . . . . 0.0 112.396 -179.548 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -117.14 160.94 20.23 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 174.134 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 13.8 m -140.9 -136.71 0.11 Allowed 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 120.196 -0.602 . . . . 0.0 110.145 -179.659 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.551 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 7.9 p-10 -121.77 122.3 39.2 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.164 173.001 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . 0.784 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 40.1 tt0 -67.68 -48.02 67.8 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.36 0.6 . . . . 0.0 110.377 -179.325 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -129.02 19.88 5.43 Favored Glycine 0 C--N 1.32 -0.326 0 CA-C-N 115.346 -0.843 . . . . 0.0 112.992 -178.838 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 87.93 4.87 78.16 Favored Glycine 0 C--O 1.228 -0.256 0 C-N-CA 120.539 -0.839 . . . . 0.0 112.688 178.462 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.786 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 36.3 p-90 -75.04 -9.16 58.28 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -178.985 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.551 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 59.0 tp -53.85 -23.56 12.85 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 -171.316 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . 0.638 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 43.9 p -84.59 -63.82 1.27 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.646 170.79 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . 0.568 ' CG ' ' HA ' ' X' ' 28' ' ' TRP . 12.1 ptm180 -57.07 -45.72 83.05 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -175.434 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -53.23 -64.4 0.83 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.782 0.325 . . . . 0.0 110.653 -178.347 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.545 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.7 mp -65.76 -43.69 88.11 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.891 -175.671 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . 0.638 ' HB2' ' O ' ' X' ' 30' ' ' THR . 0.0 OUTLIER -54.81 -38.92 67.94 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -178.293 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 19.3 m -85.05 -12.31 53.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.304 0.574 . . . . 0.0 110.892 -178.681 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -112.37 37.9 2.89 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.354 179.768 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 43.37 40.62 2.72 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.648 0.779 . . . . 0.0 112.733 -178.345 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.545 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 64.4 m-85 64.04 67.89 0.59 Allowed 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.688 177.771 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -105.67 120.1 40.81 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.13 -176.443 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.708 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.0 OUTLIER -91.26 -9.54 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 CA-C-O 121.033 0.444 . . . . 0.0 110.198 170.771 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -68.23 -34.65 81.14 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.394 -0.907 . . . . 0.0 111.517 176.978 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.27 -14.86 19.07 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.947 -0.626 . . . . 0.0 110.987 176.062 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.708 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -75.84 -33.57 60.04 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.242 -179.16 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.631 ' HA ' HD11 ' X' ' 47' ' ' ILE . 10.9 mp -72.89 -23.56 60.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.946 0.403 . . . . 0.0 110.053 177.359 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . 0.471 ' OD1' ' HA ' ' X' ' 50' ' ' SER . 17.3 t70 -68.62 -29.07 67.49 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.009 174.981 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 13.3 p -96.84 -14.96 21.51 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 -172.669 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.786 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 1.2 pp -97.84 -28.77 3.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 119.715 1.143 . . . . 0.0 113.104 -179.41 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . 0.489 ' HG3' ' O ' ' X' ' 47' ' ' ILE . 2.0 mp0 -161.19 -59.35 0.05 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.014 0.435 . . . . 0.0 110.573 179.853 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 29.2 m-85 -69.96 -179.15 1.78 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.919 -175.668 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . 0.472 ' C ' ' HD2' ' X' ' 51' ' ' LYS . 28.1 m -153.33 26.42 0.52 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.79 0.328 . . . . 0.0 111.436 -177.851 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . 0.472 ' HD2' ' C ' ' X' ' 50' ' ' SER . 12.7 mptt -132.42 129.43 39.28 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 178.055 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 60.1 m170 . . . . . 0 C--O 1.245 0.821 0 CA-C-O 118.652 -0.689 . . . . 0.0 110.68 -177.265 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.822 0 N-CA-C 112.095 -0.402 . . . . 0.0 112.095 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 48.2 m -64.2 119.96 60.38 Favored Pre-proline 0 C--N 1.331 -0.238 0 CA-C-O 120.862 0.363 . . . . 0.0 111.066 -179.582 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -95.05 176.02 1.0 Allowed 'Trans proline' 0 N--CA 1.457 -0.671 0 C-N-CA 123.254 2.636 . . . . 0.0 112.63 -177.148 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . 0.92 ' HB2' ' HB2' ' X' ' 7' ' ' ASP . 31.8 Cg_exo -58.28 167.09 5.06 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.617 2.211 . . . . 0.0 112.47 178.405 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 47.6 mm-40 -84.1 90.02 7.39 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.242 -176.539 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . 59.05 63.54 1.6 Allowed 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.63 0.729 . . . . 0.0 109.929 -177.549 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . 0.92 ' HB2' ' HB2' ' X' ' 4' ' ' PRO . 9.2 t70 -91.44 147.29 35.05 Favored Pre-proline 0 C--N 1.317 -0.812 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 179.211 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . 0.621 ' HA ' HG22 ' X' ' 11' ' ' ILE . 79.0 Cg_exo -42.07 -23.77 0.27 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.115 2.543 . . . . 0.0 113.169 179.824 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . 0.436 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 63.5 mtp180 -64.53 -55.59 19.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.946 173.792 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.451 ' HA ' ' OG ' ' X' ' 13' ' ' SER . 5.1 mp -99.41 -26.26 14.19 Favored 'General case' 0 C--O 1.22 -0.465 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -176.739 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.621 HG22 ' HA ' ' X' ' 8' ' ' PRO . 11.6 tt -64.64 -21.23 28.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.337 0.589 . . . . 0.0 109.467 178.751 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -93.63 -33.82 13.54 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.041 175.683 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . 0.636 ' HA ' HG23 ' X' ' 40' ' ' ILE . 56.6 p -96.54 -48.62 5.47 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -173.402 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.442 ' HG ' HD11 ' X' ' 29' ' ' LEU . 8.2 tt -93.49 -42.18 9.38 Favored 'General case' 0 CA--C 1.507 -0.706 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 -175.798 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.532 ' CB ' ' HA ' ' X' ' 11' ' ' ILE . 7.3 t -69.78 -22.69 63.32 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.754 -178.497 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 4.5 tm0? -56.33 -59.95 4.22 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.21 0.529 . . . . 0.0 109.993 173.694 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.758 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 11.8 ptm -77.09 -22.52 52.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.457 -176.303 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 20.8 tp -68.4 -39.42 81.68 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.912 0.387 . . . . 0.0 110.382 176.715 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 15.7 t -83.69 -31.35 26.15 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.186 -179.603 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 37.9 tpp -69.26 -29.23 67.09 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.886 0.374 . . . . 0.0 111.249 -177.259 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 113.21 38.48 1.23 Allowed Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.339 -0.934 . . . . 0.0 112.15 -178.858 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.758 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 14.2 m-30 -117.4 -173.61 2.45 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 176.595 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 60.2 m -159.28 -135.28 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 176.63 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.611 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.2 p30 -121.67 133.75 54.97 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.854 0.359 . . . . 0.0 110.036 171.804 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . 0.496 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 21.7 tt0 -87.37 48.47 1.65 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.043 0.449 . . . . 0.0 110.038 178.233 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 148.97 -8.21 0.93 Allowed Glycine 0 CA--C 1.518 0.278 0 C-N-CA 120.281 -0.961 . . . . 0.0 113.646 179.849 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 101.05 15.54 28.08 Favored Glycine 0 N--CA 1.453 -0.212 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.008 -179.126 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.718 ' CZ2' HG23 ' X' ' 47' ' ' ILE . 43.2 p-90 -91.67 -5.11 54.35 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -176.438 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.611 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 28.4 tp -56.83 -34.14 67.46 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 120.735 -0.386 . . . . 0.0 111.543 -172.293 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 70.5 p -89.32 -10.54 46.38 Favored 'General case' 0 C--N 1.321 -0.637 0 O-C-N 122.164 -0.335 . . . . 0.0 111.293 176.491 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . 0.49 ' HG2' ' HA ' ' X' ' 28' ' ' TRP . 22.6 mmm-85 -94.89 -53.04 3.99 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.021 0.439 . . . . 0.0 111.241 -177.545 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -54.71 -67.21 0.29 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.656 -177.727 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.557 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 6.8 mp -54.88 -52.45 62.8 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.531 -177.299 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 1.5 tp-100 -41.78 -60.0 1.5 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.903 0.705 . . . . 0.0 112.903 -177.743 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 2.9 m -66.59 -31.3 71.92 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.242 -176.622 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . 0.595 ' HE3' ' OD2' ' X' ' 39' ' ' ASP . 24.4 mtpp -96.56 39.38 1.16 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.968 -176.433 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 45.96 39.95 6.24 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.209 1.003 . . . . 0.0 113.086 179.859 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.557 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 43.5 m-85 59.89 74.12 0.46 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.439 -0.8 . . . . 0.0 111.599 175.69 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . 0.595 ' OD2' ' HE3' ' X' ' 36' ' ' LYS . 41.4 p-10 -112.45 138.91 48.52 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.756 0.789 . . . . 0.0 112.437 178.763 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.636 HG23 ' HA ' ' X' ' 13' ' ' SER . 0.0 OUTLIER -90.46 -13.42 9.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.084 175.025 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.5 -50.91 61.63 Favored Glycine 0 N--CA 1.444 -0.813 0 CA-C-N 115.517 -0.765 . . . . 0.0 112.511 -176.774 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -88.5 -16.97 31.32 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.216 -0.492 . . . . 0.0 111.137 178.054 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.502 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -67.66 -46.24 72.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.388 -179.781 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.556 HD13 ' OH ' ' X' ' 49' ' ' TYR . 37.5 mt -72.11 -25.54 61.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.985 0.421 . . . . 0.0 110.524 -179.189 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . 0.655 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 9.6 t70 -61.64 -36.86 82.0 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.729 178.507 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 10.7 p -96.03 -3.71 44.38 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 -172.486 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.718 HG23 ' CZ2' ' X' ' 28' ' ' TRP . 1.5 pp -99.78 -27.36 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 C-N-CA 118.379 -1.328 . . . . 0.0 112.614 -177.942 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . 0.446 ' N ' HD12 ' X' ' 47' ' ' ILE . 2.5 mp0 -158.74 -58.32 0.07 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.753 0.311 . . . . 0.0 110.801 178.701 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . 0.655 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 1.3 p90 -105.4 109.6 21.64 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.055 0.455 . . . . 0.0 112.226 -175.303 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 3.2 p -82.06 49.89 1.47 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.836 175.554 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 62.3 mmtt -140.15 129.17 23.51 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.229 179.57 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 47.1 m170 . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.339 -0.839 . . . . 0.0 110.649 -178.609 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.761 0 N-CA-C 112.4 -0.28 . . . . 0.0 112.4 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . 0.515 ' HB3' ' OD1' ' X' ' 7' ' ' ASP . 45.9 t -82.86 146.77 53.15 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 178.846 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . 0.527 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 77.9 Cg_exo -50.4 137.98 38.96 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.666 2.244 . . . . 0.0 112.031 179.221 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . 0.527 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 16.9 Cg_exo -70.92 38.48 0.32 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.995 2.464 . . . . 0.0 113.846 -175.087 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 59.0 mm-40 -132.98 8.07 4.05 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 175.676 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . 173.25 66.2 0.0 OUTLIER 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.004 -0.998 . . . . 0.0 108.671 -178.671 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . 0.589 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 39.2 t70 -107.22 149.72 39.04 Favored Pre-proline 0 C--N 1.315 -0.906 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 -177.88 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . 0.589 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 72.2 Cg_exo -47.4 -22.24 2.51 Favored 'Trans proline' 0 CA--C 1.537 0.627 0 C-N-CA 122.167 1.911 . . . . 0.0 112.5 179.58 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . 0.734 ' HB3' ' HB2' ' X' ' 38' ' ' TYR . 66.1 mtt85 -87.1 -28.82 22.3 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.272 178.185 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.554 HD22 ' HB2' ' X' ' 14' ' ' LEU . 95.7 mt -97.78 -27.58 14.25 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 122.218 -0.301 . . . . 0.0 110.696 -175.569 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.468 ' O ' ' HB3' ' X' ' 15' ' ' SER . 61.1 mt -61.88 -25.37 37.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 174.518 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . 0.467 ' HG2' ' O ' ' X' ' 8' ' ' PRO . 6.3 pt-20 -96.39 -58.75 1.99 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.828 171.494 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . 0.601 ' HB3' HG23 ' X' ' 40' ' ' ILE . 30.8 m -81.18 -26.73 35.78 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -168.275 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.554 ' HB2' HD22 ' X' ' 10' ' ' LEU . 30.6 tp -93.13 -40.29 10.57 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 179.169 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.468 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 24.4 t -65.16 -26.33 68.12 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 114.787 -1.097 . . . . 0.0 111.825 -177.762 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . . . . . . . . . 4.6 pp0? -74.35 -26.96 60.45 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.461 -179.211 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.799 ' HB2' ' HB2' ' X' ' 22' ' ' PHE . 20.8 ptm -93.73 -28.1 16.13 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.614 177.878 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 4.2 mp -66.89 -35.63 80.45 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.176 179.374 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 22.4 p -87.49 -27.62 22.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.62 -0.263 . . . . 0.0 111.648 -179.263 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 46.9 tpp -80.84 -32.57 35.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.711 -0.222 . . . . 0.0 111.578 -176.163 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 106.35 47.83 1.03 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.047 -1.073 . . . . 0.0 112.178 -179.4 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.799 ' HB2' ' HB2' ' X' ' 17' ' ' MET . 20.3 m-30 -108.92 168.28 9.47 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 108.083 -1.081 . . . . 0.0 108.083 176.454 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . 0.614 ' H ' HE22 ' X' ' 48' ' ' GLN . 20.3 m -146.33 -179.33 6.67 Favored 'General case' 0 C--N 1.315 -0.894 0 C-N-CA 119.895 -0.722 . . . . 0.0 110.832 179.45 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -77.95 132.3 37.81 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 172.125 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . 0.92 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 50.2 tt0 -76.76 -16.12 59.57 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.331 -0.548 . . . . 0.0 110.035 179.916 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -159.77 -80.11 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 111.505 -0.638 . . . . 0.0 111.505 176.637 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -162.12 32.63 0.33 Allowed Glycine 0 CA--C 1.508 -0.379 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 175.516 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.92 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 56.9 p-90 -98.37 -16.23 19.39 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -175.325 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.574 ' HA ' ' CE3' ' X' ' 28' ' ' TRP . 60.0 tp -51.16 -48.67 61.83 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -164.762 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . 0.544 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 40.8 p -75.86 -10.85 59.77 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.823 -0.548 . . . . 0.0 111.536 178.421 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 30.9 ttt180 -94.6 -54.87 3.34 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.37 0.268 . . . . 0.0 111.677 -179.688 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -52.47 -49.9 63.76 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.385 0.674 . . . . 0.0 110.4 179.671 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.92 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 73.1 mt -62.59 -53.68 50.99 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.564 179.25 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . 0.544 ' HB2' ' O ' ' X' ' 30' ' ' THR . 2.4 tp-100 -39.29 -56.81 1.47 Allowed 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.99 1.107 . . . . 0.0 113.99 -174.958 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 34.7 p -65.81 -17.12 64.41 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -174.859 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . 0.432 ' O ' ' HB3' ' X' ' 37' ' ' ASN . 50.9 mttm -114.33 30.32 7.38 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -176.568 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . 0.432 ' HB3' ' O ' ' X' ' 36' ' ' LYS . 32.2 t30 65.71 28.12 11.13 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.463 0.649 . . . . 0.0 110.311 179.438 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.92 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 50.1 m-85 60.8 68.25 0.76 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.525 -173.205 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -103.35 133.01 49.13 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.565 -174.362 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.854 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.1 OUTLIER -90.21 -3.99 10.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.136 175.805 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -62.41 -41.18 99.78 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 120.32 -0.943 . . . . 0.0 111.815 179.201 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -100.47 -14.88 18.09 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.949 -0.626 . . . . 0.0 111.015 175.391 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.854 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -72.26 -41.03 67.21 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.591 178.569 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.892 HD12 HD11 ' X' ' 47' ' ' ILE . 6.4 mp -56.06 -32.11 63.79 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 123.537 0.523 . . . . 0.0 111.202 179.794 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 58.1 t0 -51.76 -48.35 63.76 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.093 176.206 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 16.9 p -96.08 -20.15 18.88 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -175.453 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.892 HD11 HD12 ' X' ' 44' ' ' LEU . 7.2 pt -83.78 43.67 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 O-C-N 121.607 -0.683 . . . . 0.0 112.025 177.729 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . 0.614 HE22 ' H ' ' X' ' 23' ' ' SER . 2.4 mp0 82.14 34.07 0.08 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.347 1.059 . . . . 0.0 112.874 173.158 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -146.16 55.36 1.16 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.227 0.537 . . . . 0.0 110.768 173.307 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 4.0 t -91.84 54.05 2.35 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.141 179.071 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . 0.483 ' HD3' ' N ' ' X' ' 52' ' ' HIS . 8.5 tmtt? -136.68 123.76 21.62 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 179.168 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . 0.483 ' N ' ' HD3' ' X' ' 51' ' ' LYS . 55.9 m170 . . . . . 0 C--O 1.247 0.926 0 CA-C-O 118.431 -0.795 . . . . 0.0 110.332 179.681 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.836 0 N-CA-C 111.827 -0.509 . . . . 0.0 111.827 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . 0.539 ' HB3' ' HA ' ' X' ' 7' ' ' ASP . 15.2 m -110.27 100.82 45.9 Favored Pre-proline 0 C--N 1.324 -0.54 0 O-C-N 122.66 -0.318 . . . . 0.0 111.129 -177.511 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . 0.413 ' C ' ' H ' ' X' ' 5' ' ' GLU . 7.3 Cg_exo -72.82 155.63 53.47 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 123.019 2.479 . . . . 0.0 111.74 179.194 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 14.4 Cg_exo -69.95 24.0 0.18 Allowed 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 123.098 2.532 . . . . 0.0 113.615 -178.802 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . 0.413 ' H ' ' C ' ' X' ' 3' ' ' PRO . 97.4 mt-10 -143.58 15.45 1.8 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.03 174.728 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -167.74 31.32 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.731 -178.686 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . 0.539 ' HA ' ' HB3' ' X' ' 2' ' ' SER . 35.8 t70 -77.31 148.11 77.09 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 114.932 -1.031 . . . . 0.0 108.284 177.975 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . 0.532 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 86.4 Cg_exo -41.54 -34.97 2.26 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.645 2.23 . . . . 0.0 112.33 179.312 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 31.1 mmt-85 -77.97 -56.17 4.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.177 -0.919 . . . . 0.0 111.587 174.83 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.484 HD22 ' HB2' ' X' ' 14' ' ' LEU . 77.4 mt -73.0 -29.78 63.28 Favored 'General case' 0 C--O 1.214 -0.812 0 CA-C-N 115.348 -0.842 . . . . 0.0 112.604 -169.034 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.503 ' O ' ' HB2' ' X' ' 15' ' ' SER . 12.1 tt -64.25 -20.82 27.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.656 0.741 . . . . 0.0 109.613 175.476 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . 0.457 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 40.1 tt0 -96.26 -58.48 2.06 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.388 175.246 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 16.4 t -91.93 -23.19 19.68 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 -168.56 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.717 HD11 ' HG ' ' X' ' 29' ' ' LEU . 16.1 tp -92.18 -45.72 8.11 Favored 'General case' 0 CA--C 1.504 -0.802 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 177.145 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.579 ' HA ' ' HB2' ' X' ' 18' ' ' LEU . 48.8 m -64.97 -18.38 65.22 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.158 178.017 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . 0.659 HE21 ' HG2' ' X' ' 17' ' ' MET . 0.0 OUTLIER -57.44 -42.07 81.7 Favored 'General case' 0 CA--C 1.521 -0.151 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 173.276 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.659 ' HG2' HE21 ' X' ' 16' ' ' GLN . 1.9 mtp -86.98 -35.7 18.69 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.722 -176.957 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . 0.579 ' HB2' ' HA ' ' X' ' 15' ' ' SER . 3.8 mm? -62.38 -44.98 95.19 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.667 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 50.6 p -86.92 -24.55 24.78 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 -175.023 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 51.0 ttm -78.77 -32.26 46.47 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.755 0.312 . . . . 0.0 110.88 -177.674 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 112.75 47.45 0.67 Allowed Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.215 -0.993 . . . . 0.0 112.081 -179.506 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.512 ' HB2' ' HB3' ' X' ' 17' ' ' MET . 12.6 m-30 -114.7 163.83 14.9 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 176.341 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . 0.473 ' O ' HG22 ' X' ' 47' ' ' ILE . 72.0 m -150.1 150.46 31.72 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.499 -179.855 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.669 ' HB3' ' HB2' ' X' ' 29' ' ' LEU . 0.6 OUTLIER -71.07 129.05 37.97 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.389 0.614 . . . . 0.0 111.688 178.869 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . 0.809 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 30.8 tt0 -56.76 -30.04 63.2 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.71 178.581 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -146.3 -19.22 0.13 Allowed Glycine 0 CA--C 1.521 0.448 0 C-N-CA 120.351 -0.928 . . . . 0.0 114.113 -178.389 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . 0.402 ' H ' ' HB2' ' X' ' 24' ' ' ASP . . . 126.72 27.15 1.07 Allowed Glycine 0 C--O 1.228 -0.234 0 C-N-CA 120.409 -0.901 . . . . 0.0 112.224 -177.781 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.809 ' HE1' ' HB3' ' X' ' 25' ' ' GLU . 38.8 p-90 -96.36 -4.62 41.63 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 123.127 0.571 . . . . 0.0 111.57 -178.472 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.717 ' HG ' HD11 ' X' ' 14' ' ' LEU . 63.5 tp -47.87 -32.65 6.47 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -167.885 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 60.8 p -90.36 -40.13 12.28 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 121.917 -0.489 . . . . 0.0 111.432 175.365 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . 0.674 ' HG3' ' HA ' ' X' ' 28' ' ' TRP . 0.0 OUTLIER -72.98 -37.27 67.1 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 112.84 0.682 . . . . 0.0 112.84 -173.628 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -61.99 -55.51 28.61 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.132 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.579 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 10.5 mp -56.6 -50.39 72.1 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.643 178.125 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -48.55 -44.43 36.48 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -179.696 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 8.6 m -72.67 -37.44 67.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.921 0.391 . . . . 0.0 110.845 179.707 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . 0.467 ' O ' ' HB2' ' X' ' 39' ' ' ASP . 5.1 mptp? -90.98 37.3 0.92 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.492 179.509 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 41.91 53.88 4.06 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.669 0.788 . . . . 0.0 112.667 -178.187 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.579 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 34.6 m-85 54.72 62.91 2.33 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.374 178.009 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . 0.467 ' HB2' ' O ' ' X' ' 36' ' ' LYS . 32.4 t0 -118.05 134.27 55.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.917 -176.053 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.777 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.1 OUTLIER -89.72 -7.53 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.271 170.601 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -61.4 -35.02 90.38 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.306 -179.731 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -100.03 -22.16 15.34 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.527 -0.336 . . . . 0.0 110.606 175.285 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.777 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -68.25 -37.66 81.01 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.328 -179.924 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.727 HD13 ' HB ' ' X' ' 40' ' ' ILE . 9.2 mp -68.75 -17.84 64.11 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.735 0.302 . . . . 0.0 111.173 179.162 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -83.92 -29.99 26.69 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.96 0.41 . . . . 0.0 110.463 176.667 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 15.2 p -96.01 -21.69 17.84 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -172.29 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.76 HG23 ' HH2' ' X' ' 28' ' ' TRP . 1.1 pp -67.16 -26.12 35.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 119.525 -0.87 . . . . 0.0 111.476 -173.955 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . 0.616 ' HB3' ' O ' ' X' ' 47' ' ' ILE . 0.1 OUTLIER 153.95 -5.66 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.682 1.193 . . . . 0.0 110.374 169.739 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . 0.54 ' H ' HD12 ' X' ' 47' ' ' ILE . 11.3 m-30 -86.66 57.76 4.68 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.305 174.081 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 7.6 m -86.27 26.22 1.07 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.556 -176.843 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 5.0 tmtp? 72.46 68.54 0.13 Allowed 'General case' 0 CA--C 1.515 -0.384 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 -176.082 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 72.2 t60 . . . . . 0 C--O 1.244 0.802 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.414 -175.201 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.97 0 N-CA-C 112.117 -0.393 . . . . 0.0 112.117 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . . . . . . . . . 14.5 p -63.53 126.48 89.63 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.544 0.172 . . . . 0.0 111.148 -178.184 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . 0.464 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 33.0 Cg_exo -59.23 118.1 4.94 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.722 2.281 . . . . 0.0 111.796 -179.947 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . 0.522 ' HA ' HD12 ' X' ' 10' ' ' LEU . 3.5 Cg_exo -82.14 32.9 0.52 Allowed 'Trans proline' 0 CA--C 1.53 0.303 0 C-N-CA 123.041 2.494 . . . . 0.0 113.891 -173.492 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -137.79 15.68 2.89 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 121.108 -0.237 . . . . 0.0 111.304 178.14 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -179.42 31.91 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.444 0 CA-C-O 121.374 0.607 . . . . 0.0 109.568 178.574 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . 0.527 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 38.7 t70 -81.36 143.56 52.1 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 179.085 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . 0.527 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 82.9 Cg_exo -42.53 -30.92 1.73 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.662 2.242 . . . . 0.0 112.562 179.295 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . 0.49 ' HB3' ' CD2' ' X' ' 38' ' ' TYR . 39.3 mmt180 -87.76 -52.07 5.51 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.021 177.324 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.522 HD12 ' HA ' ' X' ' 4' ' ' PRO . 91.8 mt -81.54 -14.08 57.31 Favored 'General case' 0 C--O 1.216 -0.697 0 CA-C-N 116.0 -0.546 . . . . 0.0 112.446 -171.404 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.502 ' HA ' ' CB ' ' X' ' 15' ' ' SER . 13.9 tt -66.05 -24.76 34.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.4 0.619 . . . . 0.0 109.604 175.873 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -94.47 -28.86 15.24 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.963 174.528 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . 0.415 ' HB2' ' HA ' ' X' ' 10' ' ' LEU . 16.3 m -96.21 -54.33 3.33 Favored 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -171.132 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.421 ' HG ' ' HG ' ' X' ' 29' ' ' LEU . 9.9 tt -94.81 -46.74 6.76 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 -176.429 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.502 ' CB ' ' HA ' ' X' ' 11' ' ' ILE . 14.4 m -63.2 -25.53 68.38 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.178 -177.991 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' X' ' 20' ' ' MET . 2.5 tm0? -61.37 -47.68 84.74 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-O 121.029 0.442 . . . . 0.0 109.901 174.703 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.603 ' SD ' HD13 ' X' ' 47' ' ' ILE . 42.1 mtt -77.74 -39.8 43.13 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.046 -177.473 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 35.6 tp -64.47 -37.77 88.69 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.235 -177.723 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 3.7 t -85.7 -22.23 27.93 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.628 0.251 . . . . 0.0 110.932 -178.633 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . 0.401 ' HB2' ' O ' ' X' ' 16' ' ' GLN . 15.4 tpt -78.01 -32.42 51.1 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.925 0.393 . . . . 0.0 110.887 -178.733 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.6 34.53 1.55 Allowed Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.836 -177.89 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.495 ' HB2' ' HB3' ' X' ' 17' ' ' MET . 14.8 m-30 -110.33 -177.31 3.21 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 174.284 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -151.13 -178.33 6.56 Favored 'General case' 0 C--N 1.314 -0.939 0 C-N-CA 120.384 -0.526 . . . . 0.0 110.113 178.54 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -94.35 144.16 25.78 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 173.973 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . 0.507 ' HB3' ' HE1' ' X' ' 28' ' ' TRP . 29.4 tt0 -107.5 57.3 0.63 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.151 0.5 . . . . 0.0 110.189 179.65 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . 141.38 -29.31 2.29 Favored Glycine 0 CA--C 1.517 0.191 0 C-N-CA 120.65 -0.786 . . . . 0.0 113.076 179.407 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . 120.03 16.16 4.95 Favored Glycine 0 CA--C 1.506 -0.528 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 -177.931 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.906 ' HH2' HG23 ' X' ' 47' ' ' ILE . 60.9 p-90 -84.97 -11.85 54.59 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.132 -0.534 . . . . 0.0 111.347 -177.91 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.421 ' HG ' ' HG ' ' X' ' 14' ' ' LEU . 30.7 tp -66.17 -19.59 65.88 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.393 -0.817 . . . . 0.0 110.018 -176.914 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . 0.46 ' O ' ' HG3' ' X' ' 34' ' ' GLN . 0.1 OUTLIER -95.74 -31.54 13.16 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.921 167.814 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . 0.739 ' HB3' ' HA ' ' X' ' 28' ' ' TRP . 50.0 ttt-85 -87.27 -65.88 0.97 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 112.759 0.652 . . . . 0.0 112.759 -174.256 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . 0.882 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 3.3 tm? -41.67 -59.83 1.53 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.022 0.929 . . . . 0.0 111.39 179.307 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.415 HD12 ' O ' ' X' ' 29' ' ' LEU . 65.9 mt -47.36 -68.88 0.15 Allowed 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.281 -175.754 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . 0.46 ' HG3' ' O ' ' X' ' 30' ' ' THR . 5.3 mt-30 -57.4 -27.37 62.28 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -171.531 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 15.4 m -71.96 -21.74 61.55 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.952 0.406 . . . . 0.0 111.034 179.22 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . 0.443 ' HB2' ' HB2' ' X' ' 39' ' ' ASP . 18.5 mtpp -121.28 37.38 4.35 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.953 -175.661 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 50.6 t30 63.72 39.03 8.9 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.377 0.608 . . . . 0.0 110.737 178.818 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.49 ' CD2' ' HB3' ' X' ' 9' ' ' ARG . 11.4 m-85 55.57 66.35 1.24 Allowed 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.425 -176.784 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . 0.443 ' HB2' ' HB2' ' X' ' 36' ' ' LYS . 17.8 t70 -88.86 124.59 34.34 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.034 -0.984 . . . . 0.0 112.177 -169.499 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.662 ' O ' HD13 ' X' ' 44' ' ' LEU . 1.5 mm -89.7 -24.32 5.9 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.131 175.838 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -66.19 -33.08 84.14 Favored Glycine 0 N--CA 1.441 -1.027 0 CA-C-N 115.264 -0.88 . . . . 0.0 112.762 -177.701 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -100.16 -21.88 15.38 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.873 0.368 . . . . 0.0 111.387 -178.632 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.617 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -70.89 -32.66 69.7 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.655 178.557 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.814 HD12 HD11 ' X' ' 47' ' ' ILE . 6.3 mp -64.65 -35.25 80.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.757 -178.99 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . 0.47 ' HA ' ' HA ' ' X' ' 50' ' ' SER . 2.9 t70 -52.83 -38.92 61.98 Favored 'General case' 0 C--N 1.33 -0.268 0 O-C-N 123.174 0.296 . . . . 0.0 111.683 179.779 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 2.0 p -96.07 -22.15 17.52 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -176.95 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.906 HG23 ' HH2' ' X' ' 28' ' ' TRP . 16.8 pt -83.34 42.64 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-N 118.478 0.581 . . . . 0.0 112.145 176.915 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 74.74 13.51 3.5 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.359 0.664 . . . . 0.0 112.383 173.912 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -120.59 52.59 1.16 Allowed 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 120.655 0.264 . . . . 0.0 110.501 176.161 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . 0.47 ' HA ' ' HA ' ' X' ' 45' ' ' ASP . 8.5 t -80.97 9.08 7.01 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.086 0.47 . . . . 0.0 111.723 -176.449 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -140.86 21.25 2.31 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.691 176.645 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 17.4 t-160 . . . . . 0 C--O 1.244 0.775 0 CA-C-O 118.035 -0.983 . . . . 0.0 109.887 -177.193 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.701 0 N-CA-C 111.949 -0.46 . . . . 0.0 111.949 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . 0.419 ' HA ' ' HD3' ' X' ' 3' ' ' PRO . 35.3 t -90.64 140.47 26.59 Favored Pre-proline 0 C--N 1.322 -0.612 0 O-C-N 122.96 -0.141 . . . . 0.0 110.671 -178.076 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . 0.444 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 19.5 Cg_exo -63.8 146.38 91.81 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.657 2.238 . . . . 0.0 111.563 177.497 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 16.0 Cg_exo -71.31 30.65 0.23 Allowed 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 122.999 2.466 . . . . 0.0 113.863 -176.36 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -134.23 6.97 3.62 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.021 0.439 . . . . 0.0 110.451 176.114 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -165.99 28.35 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.073 178.16 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . 0.45 ' O ' HG22 ' X' ' 11' ' ' ILE . 57.6 p30 -83.67 156.18 65.05 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.252 179.465 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -47.19 -14.6 0.19 Allowed 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.07 2.513 . . . . 0.0 114.244 -176.064 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . . . . . . . . . 68.8 mtm180 -94.37 -42.71 8.75 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 111.987 0.365 . . . . 0.0 111.987 179.506 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.409 HD22 ' HB2' ' X' ' 14' ' ' LEU . 53.1 mt -97.64 -26.08 14.89 Favored 'General case' 0 C--O 1.221 -0.446 0 O-C-N 122.213 -0.305 . . . . 0.0 111.458 -177.153 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.642 ' O ' ' HB3' ' X' ' 15' ' ' SER . 7.8 tt -70.68 -15.2 18.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 169.536 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -93.73 -59.06 2.08 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.118 -0.946 . . . . 0.0 111.33 174.267 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 36.7 m -82.91 -33.86 26.76 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.315 0.857 . . . . 0.0 113.315 -172.411 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.445 HD23 HD23 ' X' ' 18' ' ' LEU . 9.4 tt -93.92 -39.25 10.78 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-O 121.393 0.616 . . . . 0.0 109.444 -177.421 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.642 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 6.4 t -73.67 -21.21 60.33 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.374 -176.667 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . 0.622 HE21 ' CG ' ' X' ' 17' ' ' MET . 2.4 pp0? -69.61 -26.16 64.3 Favored 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 120.134 -0.627 . . . . 0.0 109.311 173.863 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.622 ' CG ' HE21 ' X' ' 16' ' ' GLN . 77.4 mtp -73.28 -46.35 50.36 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.649 175.642 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . 0.445 HD23 HD23 ' X' ' 14' ' ' LEU . 4.3 mm? -63.32 -41.87 98.94 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.889 179.19 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 16.1 m -70.05 -17.25 63.24 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -178.936 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 30.4 ttm -101.84 -30.23 11.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.864 0.364 . . . . 0.0 111.136 -176.41 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 114.48 45.74 0.65 Allowed Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.659 -0.782 . . . . 0.0 111.627 -178.785 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.422 ' HB2' ' HB3' ' X' ' 17' ' ' MET . 41.0 m-85 -133.74 166.27 23.02 Favored 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 108.129 -1.064 . . . . 0.0 108.129 177.771 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 70.2 m -158.72 -123.51 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -178.601 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.644 ' HB3' ' CB ' ' X' ' 29' ' ' LEU . 1.3 p30 -118.78 130.98 56.09 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 169.485 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . 1.089 ' HG3' ' HE1' ' X' ' 28' ' ' TRP . 3.0 pp20? -78.73 1.62 22.45 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.051 0.453 . . . . 0.0 110.5 -178.534 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -152.02 -73.49 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.384 0 CA-C-N 115.289 -0.869 . . . . 0.0 110.98 172.38 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . . . . . . . . . . . -175.34 28.25 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.479 0 N-CA-C 110.896 -0.882 . . . . 0.0 110.896 175.486 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 1.089 ' HE1' ' HG3' ' X' ' 25' ' ' GLU . 53.3 p-90 -98.31 -19.87 17.53 Favored 'General case' 0 C--O 1.212 -0.898 0 CA-C-O 118.557 -0.735 . . . . 0.0 112.227 -175.035 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.644 ' CB ' ' HB3' ' X' ' 24' ' ' ASP . 28.5 tp -40.35 -53.21 2.62 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -168.917 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . 0.425 ' O ' ' HB2' ' X' ' 34' ' ' GLN . 60.2 p -72.78 -17.66 61.56 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -178.773 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -94.59 -48.88 5.9 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.673 -174.944 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . 0.674 ' O ' ' HD3' ' X' ' 36' ' ' LYS . 3.4 tm? -50.12 -71.99 0.06 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 123.72 0.808 . . . . 0.0 111.381 -178.166 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.719 ' HB2' ' HA ' ' X' ' 38' ' ' TYR . 0.5 OUTLIER -62.83 -25.06 68.07 Favored 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -175.292 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . 0.486 ' NE2' ' HE1' ' X' ' 38' ' ' TYR . 5.9 tp-100 -57.65 -36.21 71.56 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 111.825 0.306 . . . . 0.0 111.825 -179.118 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 7.1 m -96.03 -11.48 26.37 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.927 0.394 . . . . 0.0 110.939 -178.789 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . 0.674 ' HD3' ' O ' ' X' ' 32' ' ' LEU . 4.3 mptp? -108.17 36.55 2.75 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -177.505 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 41.6 t30 59.21 37.17 23.93 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.534 0.683 . . . . 0.0 111.084 178.169 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.719 ' HA ' ' HB2' ' X' ' 33' ' ' LEU . 54.8 m-85 54.34 59.12 4.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.256 179.48 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . 0.487 ' HB2' ' O ' ' X' ' 36' ' ' LYS . 2.4 t0 -91.72 128.9 37.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.667 -1.151 . . . . 0.0 111.428 -172.415 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.472 ' O ' HD13 ' X' ' 44' ' ' LEU . 0.0 OUTLIER -90.12 -7.6 10.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.346 170.416 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -70.76 -42.23 62.03 Favored Glycine 0 N--CA 1.442 -0.964 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.077 -178.977 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -91.26 -22.6 20.5 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.16 -0.52 . . . . 0.0 111.216 178.444 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.491 ' O ' HG12 ' X' ' 47' ' ' ILE . . . -69.04 -41.16 78.04 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.418 -179.387 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.472 HD13 ' O ' ' X' ' 40' ' ' ILE . 10.9 mp -75.14 -33.86 61.58 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.727 0.299 . . . . 0.0 110.362 178.839 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -57.32 -35.14 69.49 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.291 179.425 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 1.5 p -86.12 -44.03 12.58 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -176.206 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.653 HG23 ' CH2' ' X' ' 28' ' ' TRP . 4.5 pt -67.1 -30.35 49.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.48 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 -170.85 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -165.61 -32.07 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 111.606 0.224 . . . . 0.0 111.606 -177.488 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . 0.438 ' HB2' ' O ' ' X' ' 44' ' ' LEU . 13.3 m-85 -77.88 42.31 0.38 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 120.765 0.316 . . . . 0.0 110.834 -179.27 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . . . . . . . . . 14.6 m -87.5 20.94 2.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.966 0.413 . . . . 0.0 111.192 -177.219 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 1.7 mmmp? -111.69 38.07 2.74 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 174.996 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 49.5 t-80 . . . . . 0 C--O 1.245 0.831 0 CA-C-N 114.819 -1.082 . . . . 0.0 109.841 -173.924 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' X' X ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.885 0 N-CA-C 112.208 -0.357 . . . . 0.0 112.208 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' X' X ' 2' ' ' SER . . . . . 0.418 ' HA ' ' HD3' ' X' ' 3' ' ' PRO . 5.6 p -92.26 137.03 25.02 Favored Pre-proline 0 C--N 1.326 -0.451 0 O-C-N 122.815 -0.227 . . . . 0.0 111.046 -179.053 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 3' ' ' PRO . . . . . 0.431 ' HA ' ' HD3' ' X' ' 4' ' ' PRO . 37.0 Cg_exo -60.6 133.96 51.65 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.029 2.486 . . . . 0.0 112.073 -179.869 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 4' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' X' ' 3' ' ' PRO . 8.8 Cg_exo -73.8 24.39 0.33 Allowed 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 122.892 2.394 . . . . 0.0 113.382 -177.482 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -141.05 13.49 2.24 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.228 0.537 . . . . 0.0 109.948 175.242 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' X' X ' 6' ' ' ALA . . . . . . . . . . . . . . . -162.57 21.75 0.1 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.453 -178.783 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' X' X ' 7' ' ' ASP . . . . . 0.621 ' OD1' ' HD2' ' X' ' 8' ' ' PRO . 25.0 t70 -75.87 146.07 78.84 Favored Pre-proline 0 C--N 1.319 -0.751 0 CA-C-N 114.367 -1.288 . . . . 0.0 108.172 175.965 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 8' ' ' PRO . . . . . 0.621 ' HD2' ' OD1' ' X' ' 7' ' ' ASP . 80.2 Cg_exo -42.97 -25.61 0.57 Allowed 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.062 2.508 . . . . 0.0 112.982 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 9' ' ' ARG . . . . . 0.488 ' HB3' ' CG ' ' X' ' 38' ' ' TYR . 64.3 mmt-85 -93.41 -39.1 11.1 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.537 179.844 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.571 HD22 ' HB2' ' X' ' 14' ' ' LEU . 79.3 mt -95.66 -19.55 19.63 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 122.137 -0.352 . . . . 0.0 111.631 -170.764 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 11' ' ' ILE . . . . . 0.52 ' O ' ' HB3' ' X' ' 15' ' ' SER . 0.0 OUTLIER -66.39 -24.62 33.62 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 171.635 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' X' X ' 12' ' ' GLU . . . . . 0.402 ' O ' ' HB2' ' X' ' 16' ' ' GLN . 41.4 mt-10 -95.91 -62.29 1.31 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.613 173.625 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 13' ' ' SER . . . . . . . . . . . . . 35.9 m -81.07 -21.25 40.18 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 -169.445 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' X' X ' 14' ' ' LEU . . . . . 0.853 HD12 HD11 ' X' ' 29' ' ' LEU . 8.8 tp -92.97 -45.83 7.76 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.798 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 15' ' ' SER . . . . . 0.52 ' HB3' ' O ' ' X' ' 11' ' ' ILE . 19.3 t -67.6 -26.24 66.16 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 114.004 -1.453 . . . . 0.0 111.528 -178.031 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 16' ' ' GLN . . . . . 0.402 ' HB2' ' O ' ' X' ' 12' ' ' GLU . 3.9 tm0? -52.25 -52.09 54.57 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 121.058 0.456 . . . . 0.0 110.944 177.485 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 17' ' ' MET . . . . . 0.692 ' SD ' HD13 ' X' ' 29' ' ' LEU . 8.4 ptm -89.06 -26.71 21.26 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.116 -175.619 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 18' ' ' LEU . . . . . . . . . . . . . 28.8 mt -72.08 -17.69 61.98 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 119.961 -0.696 . . . . 0.0 112.126 -179.474 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' X' X ' 19' ' ' SER . . . . . . . . . . . . . 32.4 p -94.52 -21.72 18.69 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 121.059 -0.256 . . . . 0.0 111.383 178.584 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' X' X ' 20' ' ' MET . . . . . . . . . . . . . 86.6 mtp -87.08 -31.66 20.35 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.702 0.287 . . . . 0.0 111.321 -179.13 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' X' X ' 21' ' ' GLY . . . . . . . . . . . . . . . 108.31 35.56 2.47 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.487 -175.329 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' X' X ' 22' ' ' PHE . . . . . 0.633 ' HD2' HD12 ' X' ' 47' ' ' ILE . 15.0 m-30 -112.82 146.72 38.36 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 175.295 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 23' ' ' SER . . . . . . . . . . . . . 62.6 m -136.72 -177.56 4.79 Favored 'General case' 0 C--N 1.308 -1.211 0 C-N-CA 119.903 -0.719 . . . . 0.0 110.779 -174.878 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' X' X ' 24' ' ' ASP . . . . . 0.874 ' HB3' ' HB3' ' X' ' 29' ' ' LEU . 1.3 p30 -79.55 123.13 27.3 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.213 0.53 . . . . 0.0 110.117 175.251 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 25' ' ' GLU . . . . . 0.53 ' CB ' ' HE1' ' X' ' 28' ' ' TRP . 18.4 tp10 -68.57 -35.29 77.19 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.264 -177.089 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 26' ' ' GLY . . . . . . . . . . . . . . . -139.92 20.28 2.88 Favored Glycine 0 C--N 1.32 -0.334 0 CA-C-N 115.518 -0.764 . . . . 0.0 112.787 178.101 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' X' X ' 27' ' ' GLY . . . . . 0.574 ' O ' ' HG2' ' X' ' 31' ' ' ARG . . . 91.31 23.18 29.93 Favored Glycine 0 C--O 1.225 -0.424 0 C-N-CA 120.509 -0.853 . . . . 0.0 112.309 -179.736 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 28' ' ' TRP . . . . . 0.742 ' CH2' HG23 ' X' ' 47' ' ' ILE . 47.8 p-90 -89.83 -13.7 35.98 Favored 'General case' 0 C--O 1.217 -0.644 0 O-C-N 122.887 -0.184 . . . . 0.0 111.311 -178.385 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 29' ' ' LEU . . . . . 0.874 ' HB3' ' HB3' ' X' ' 24' ' ' ASP . 11.4 tp -63.0 -20.96 65.8 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 121.791 -0.568 . . . . 0.0 109.898 -179.259 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 30' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -93.5 -25.7 17.49 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.266 171.224 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 31' ' ' ARG . . . . . 0.574 ' HG2' ' O ' ' X' ' 27' ' ' GLY . 15.7 mmm180 -95.92 -65.47 0.97 Allowed 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -175.433 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 32' ' ' LEU . . . . . 0.715 ' HB2' ' HB2' ' X' ' 28' ' ' TRP . 2.8 tm? -39.12 -54.94 1.7 Allowed 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.853 1.261 . . . . 0.0 112.533 -176.197 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 33' ' ' LEU . . . . . 0.735 ' HB3' ' HA ' ' X' ' 38' ' ' TYR . 93.4 mt -54.63 -61.85 2.04 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.497 -176.796 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 34' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -38.1 -55.89 1.23 Allowed 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -175.653 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' X' X ' 35' ' ' THR . . . . . . . . . . . . . 6.4 p -76.46 -2.44 32.13 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -169.179 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' X' X ' 36' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -112.79 -27.31 8.19 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 119.995 -0.682 . . . . 0.0 111.971 -179.009 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' X' X ' 37' ' ' ASN . . . . . . . . . . . . . 20.7 p30 136.87 15.86 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 125.931 1.693 . . . . 0.0 109.979 178.214 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' X' X ' 38' ' ' TYR . . . . . 0.735 ' HA ' ' HB3' ' X' ' 33' ' ' LEU . 26.0 m-85 72.42 56.25 0.15 Allowed 'General case' 0 C--N 1.341 0.217 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 -170.102 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 39' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -100.72 125.94 47.22 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.766 -171.265 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' X' X ' 40' ' ' ILE . . . . . 0.818 ' HA ' ' HB3' ' X' ' 43' ' ' ALA . 0.1 OUTLIER -89.58 -8.6 10.76 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.123 173.664 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' X' X ' 41' ' ' GLY . . . . . . . . . . . . . . . -59.97 -37.27 92.42 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.355 -0.926 . . . . 0.0 111.915 177.279 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' X' X ' 42' ' ' ALA . . . . . . . . . . . . . . . -99.08 -21.39 16.21 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.506 -0.347 . . . . 0.0 110.74 175.904 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' X' X ' 43' ' ' ALA . . . . . 0.818 ' HB3' ' HA ' ' X' ' 40' ' ' ILE . . . -67.23 -33.78 76.08 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.018 178.049 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 44' ' ' LEU . . . . . 0.84 HD12 HD11 ' X' ' 47' ' ' ILE . 7.1 mp -63.98 -30.42 71.5 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.153 179.429 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 45' ' ' ASP . . . . . 0.572 ' HA ' ' O ' ' X' ' 49' ' ' TYR . 21.1 t70 -57.37 -39.55 76.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.19 0.519 . . . . 0.0 110.812 174.749 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 46' ' ' THR . . . . . . . . . . . . . 11.7 p -94.46 -5.53 46.01 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -175.626 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' X' X ' 47' ' ' ILE . . . . . 0.84 HD11 HD12 ' X' ' 44' ' ' LEU . 2.0 pt -102.63 43.91 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 O-C-N 121.999 -0.438 . . . . 0.0 111.666 173.804 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 48' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 82.0 33.45 0.09 Allowed 'General case' 0 N--CA 1.474 0.744 0 O-C-N 124.276 0.985 . . . . 0.0 112.549 173.009 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' X' X ' 49' ' ' TYR . . . . . 0.572 ' O ' ' HA ' ' X' ' 45' ' ' ASP . 63.8 m-85 -141.58 58.16 1.51 Allowed 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 173.855 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 50' ' ' SER . . . . . 0.526 ' HA ' ' OD1' ' X' ' 45' ' ' ASP . 8.1 p -97.35 23.78 7.19 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -174.493 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' X' X ' 51' ' ' LYS . . . . . . . . . . . . . 28.6 ttpp -126.06 92.19 3.53 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 178.855 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' X' X ' 52' ' ' HIS . . . . . . . . . . . . . 28.1 m80 . . . . . 0 C--O 1.245 0.84 0 CA-C-O 118.351 -0.833 . . . . 0.0 110.255 -178.288 . . . . . . . . 0 0 . 1 stop_ save_